#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a4s h GLN 2 N 0.00 0.55 -0.59 0.00 -0.00 -2.05 -1.51 115.11 111.51 1a4s h GLN 2 Ca 0.00 -0.39 0.03 0.00 -0.00 0.00 0.00 58.65 58.30 1a4s h GLN 2 Cb 0.00 0.06 -0.04 0.00 -0.00 0.00 0.00 27.48 27.50 1a4s h GLN 2 CO 0.00 1.00 0.35 1.25 -0.00 0.00 0.00 178.83 181.44 1a4s h LEU 3 N 0.40 0.56 -0.48 0.06 5.85 -2.00 -0.97 115.31 118.74 1a4s h LEU 3 Ca -0.01 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1a4s h LEU 3 Cb 1.19 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.09 1a4s h LEU 3 CO 0.12 0.39 0.23 0.58 -0.34 0.00 0.00 178.44 179.42 1a4s h VAL 4 N 0.69 1.19 0.00 1.05 2.07 -1.91 -2.10 116.25 117.24 1a4s h VAL 4 Ca 0.24 -0.54 -0.03 0.00 0.82 0.00 0.00 66.70 67.20 1a4s h VAL 4 Cb 0.05 0.66 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1a4s h VAL 4 CO -0.11 0.21 -0.12 0.44 0.02 0.00 0.00 177.57 178.00 1a4s h ASP 5 N 0.63 0.00 -0.02 0.57 3.32 -0.72 -2.66 116.42 117.54 1a4s h ASP 5 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 1a4s h ASP 5 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 1a4s h ASP 5 CO -0.02 0.12 0.00 -1.54 -1.72 0.00 0.00 179.24 176.08 1a4s n SER 6 N -3.48 0.42 0.01 6.45 3.41 -0.42 -4.34 113.62 115.68 1a4s n SER 6 Ca -0.01 -1.28 -0.02 0.00 -0.26 0.00 0.00 58.87 57.30 1a4s n SER 6 Cb 0.28 -0.01 0.25 0.00 -0.26 0.00 0.00 64.21 64.46 1a4s n SER 6 CO 0.00 0.00 0.00 0.24 -0.16 0.00 0.00 175.04 175.12 1a4s h MET 7 N 0.62 0.49 -0.05 4.33 2.86 -1.42 -2.95 114.93 118.82 1a4s h MET 7 Ca 0.00 -0.15 0.01 0.00 -2.06 0.00 0.00 59.70 57.51 1a4s h MET 7 Cb 0.13 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.74 1a4s h MET 7 CO 0.00 0.62 0.08 -1.35 1.06 0.00 0.00 176.91 177.32 1a4s h PRO 8 N 0.45 0.00 -0.48 -0.22 0.11 -1.84 0.26 132.00 130.29 1a4s h PRO 8 Ca 0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1a4s h PRO 8 Cb 0.51 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.62 1a4s h PRO 8 CO 0.03 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.69 1a4s n SER 9 N -3.53 3.29 -4.94 -2.05 3.41 -1.11 -5.00 113.62 103.68 1a4s n SER 9 Ca -0.02 -1.98 -0.24 0.00 -0.26 0.00 0.00 58.87 56.37 1a4s n SER 9 Cb 0.17 -0.32 0.01 0.00 -0.26 0.00 0.00 64.21 63.81 1a4s n SER 9 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a4s s ALA 10 N -1.02 3.63 0.28 7.33 0.00 0.93 -5.11 121.76 127.80 1a4s s ALA 10 Ca 0.33 -0.92 -0.16 0.00 0.00 0.00 0.00 51.96 51.22 1a4s s ALA 10 Cb 0.17 -2.26 0.01 0.00 0.00 0.00 0.00 23.12 21.04 1a4s s ALA 10 CO 0.23 -0.40 0.61 -1.54 0.00 0.00 0.00 175.76 174.66 1a4s s SER 11 N -4.20 -0.07 0.24 0.00 1.04 -1.26 -5.04 113.70 104.41 1a4s s SER 11 Ca 0.48 -0.87 -0.30 0.00 0.48 0.00 0.00 55.95 55.73 1a4s s SER 11 Cb -0.10 0.68 -0.10 0.00 0.10 0.00 0.00 66.02 66.60 1a4s s SER 11 CO 0.40 -1.30 1.45 -0.89 0.98 0.00 0.00 173.24 173.87 1a4s s THR 12 N -3.71 2.68 0.00 2.02 2.01 -1.26 -1.65 115.64 115.74 1a4s s THR 12 Ca 0.18 0.57 0.00 0.00 0.31 0.00 0.00 61.69 62.74 1a4s s THR 12 Cb -0.03 -3.36 0.00 0.00 0.01 0.00 0.00 72.50 69.12 1a4s s THR 12 CO 0.09 0.09 0.00 0.61 -0.69 0.00 0.00 174.62 174.72 1a4s n GLY 13 N 2.35 1.00 0.08 4.40 0.00 -1.26 -4.92 105.19 106.84 1a4s n GLY 13 Ca 0.07 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.04 1a4s n GLY 13 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1a4s n SER 14 N 0.00 0.03 -4.80 1.61 3.41 -0.66 -5.00 113.62 108.21 1a4s n SER 14 Ca 0.00 0.01 -0.36 0.00 -0.26 0.00 0.00 58.87 58.26 1a4s n SER 14 Cb 0.00 1.20 -0.06 0.00 -0.26 0.00 0.00 64.21 65.09 1a4s n SER 14 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1a4s s VAL 15 N -2.74 4.40 -0.01 -3.33 1.01 -1.26 -4.99 120.40 113.48 1a4s s VAL 15 Ca -0.09 1.51 0.04 0.00 0.00 0.00 0.00 61.98 63.44 1a4s s VAL 15 Cb 0.08 -3.87 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 1a4s s VAL 15 CO 0.85 0.08 -0.13 0.54 0.00 0.00 0.00 175.10 176.44 1a4s s VAL 16 N -1.68 1.04 -0.24 2.92 0.11 -1.26 -4.84 120.40 116.45 1a4s s VAL 16 Ca 0.49 -0.56 -0.08 0.00 -2.93 0.00 0.00 61.98 58.90 1a4s s VAL 16 Cb -0.16 -0.87 -0.04 0.00 -1.53 0.00 0.00 36.38 33.78 1a4s s VAL 16 CO 0.21 0.29 0.10 -0.69 -3.33 0.00 0.00 175.10 171.68 1a4s s VAL 17 N -0.30 4.77 -0.18 2.04 1.01 0.34 -4.97 120.40 123.10 1a4s s VAL 17 Ca 0.05 -0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.02 1a4s s VAL 17 Cb -0.05 -3.21 0.05 0.00 0.00 0.00 0.00 36.38 33.16 1a4s s VAL 17 CO -0.00 0.36 0.95 0.35 0.00 0.00 0.00 175.10 176.75 1a4s n THR 18 N 4.49 0.80 -2.60 3.92 -2.24 -1.26 -4.56 114.28 112.83 1a4s n THR 18 Ca -0.16 -0.90 -0.31 0.00 -2.27 0.00 0.00 64.05 60.41 1a4s n THR 18 Cb 0.52 0.61 -0.03 0.00 -2.10 0.00 0.00 70.33 69.32 1a4s n THR 18 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1a4s s ASP 19 N -0.83 6.59 0.23 3.42 1.01 -1.26 -5.03 116.67 120.79 1a4s s ASP 19 Ca 0.04 1.39 -0.30 0.00 0.71 0.00 0.00 52.55 54.39 1a4s s ASP 19 Cb 0.02 -2.43 -0.09 0.00 1.01 0.00 0.00 42.92 41.43 1a4s s ASP 19 CO 0.03 -0.50 1.16 -1.81 0.21 0.00 0.00 175.17 174.25 1a4s s ASP 20 N -3.08 7.15 0.00 0.27 1.01 -1.26 -4.96 116.67 115.80 1a4s s ASP 20 Ca 0.56 2.26 0.13 0.00 0.71 0.00 0.00 52.55 56.21 1a4s s ASP 20 Cb -0.10 -2.62 0.04 0.00 1.01 0.00 0.00 42.92 41.25 1a4s s ASP 20 CO 0.31 -0.28 0.81 0.18 0.21 0.00 0.00 175.17 176.40 1a4s n LEU 21 N 1.91 1.69 -4.81 1.23 4.77 -1.26 -4.74 117.00 115.79 1a4s n LEU 21 Ca 0.02 -0.86 -0.37 0.00 -0.03 0.00 0.00 56.01 54.77 1a4s n LEU 21 Cb 0.45 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.48 1a4s n LEU 21 CO 0.55 0.32 0.38 0.20 -1.33 0.00 0.00 177.39 177.51 1a4s s ASN 22 N -1.43 7.10 -0.21 -1.43 0.01 -1.26 -4.73 114.94 112.98 1a4s s ASN 22 Ca 0.13 1.39 -0.04 0.00 -0.71 0.00 0.00 52.86 53.63 1a4s s ASN 22 Cb 0.11 -2.41 0.11 0.00 0.41 0.00 0.00 41.25 39.47 1a4s s ASN 22 CO 0.27 0.13 0.33 -0.47 -1.51 0.00 0.00 177.10 175.85 1a4s s TYR 23 N -1.35 -0.65 0.10 2.20 5.04 -0.58 -0.15 117.35 121.96 1a4s s TYR 23 Ca 0.38 0.80 -0.20 0.00 -2.44 0.00 0.00 57.07 55.61 1a4s s TYR 23 Cb -0.18 -0.04 0.05 0.00 0.35 0.00 0.00 41.96 42.14 1a4s s TYR 23 CO 0.21 -0.62 0.50 1.67 -1.34 0.00 0.00 175.55 175.97 1a4s s TRP 24 N 2.49 -0.37 -1.01 4.97 -2.14 -0.98 0.38 118.94 122.27 1a4s s TRP 24 Ca 0.08 0.22 0.00 0.00 2.66 0.00 0.00 56.10 59.07 1a4s s TRP 24 Cb -0.15 0.36 0.00 0.00 -3.10 0.00 0.00 33.47 30.59 1a4s s TRP 24 CO -0.14 -0.71 0.00 0.41 -2.66 0.00 0.00 176.95 173.85 1a4s n GLY 25 N -0.01 0.83 2.01 3.67 0.00 -1.26 -2.69 105.19 107.75 1a4s n GLY 25 Ca -0.17 -0.54 -0.00 0.00 0.00 0.00 0.00 46.02 45.30 1a4s n GLY 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a4s n GLY 26 N -1.55 0.43 3.43 -0.02 0.00 -1.26 -4.69 105.19 101.53 1a4s n GLY 26 Ca -0.11 -0.76 -0.15 0.00 0.00 0.00 0.00 46.02 45.00 1a4s n GLY 26 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1a4s s ARG 27 N -1.45 1.06 0.15 1.61 1.70 -1.09 -5.01 118.95 115.92 1a4s s ARG 27 Ca 0.00 -0.10 -0.31 0.00 -0.47 0.00 0.00 55.73 54.86 1a4s s ARG 27 Cb 0.00 0.49 -0.09 0.00 -0.57 0.00 0.00 34.95 34.78 1a4s s ARG 27 CO 0.00 -0.37 1.39 1.03 -1.08 0.00 0.00 175.30 176.27 1a4s s ARG 28 N -2.14 4.32 -0.21 3.89 0.52 -1.26 -2.33 118.95 121.75 1a4s s ARG 28 Ca -0.07 2.12 -0.13 0.00 -0.52 0.00 0.00 55.73 57.13 1a4s s ARG 28 Cb -0.01 -3.21 -0.05 0.00 0.52 0.00 0.00 34.95 32.21 1a4s s ARG 28 CO 0.01 -0.40 0.25 0.42 0.02 0.00 0.00 175.30 175.60 1a4s s ILE 29 N 0.74 5.31 -0.23 1.52 -1.09 0.79 -4.96 121.20 123.28 1a4s s ILE 29 Ca 0.62 0.40 -0.29 0.00 -2.23 0.00 0.00 60.65 59.16 1a4s s ILE 29 Cb -0.38 -3.59 -0.02 0.00 -1.58 0.00 0.00 42.46 36.90 1a4s s ILE 29 CO 0.34 0.34 1.52 -0.54 -1.23 0.00 0.00 174.94 175.37 1a4s s LYS 30 N 0.89 3.86 0.66 2.79 3.01 -1.26 -4.43 119.74 125.25 1a4s s LYS 30 Ca 0.13 1.58 -0.17 0.00 -1.01 0.00 0.00 55.97 56.49 1a4s s LYS 30 Cb -0.13 -3.98 -0.03 0.00 -1.01 0.00 0.00 37.83 32.67 1a4s s LYS 30 CO 0.04 -1.21 0.86 -1.13 0.51 0.00 0.00 175.35 174.43 1a4s n SER 31 N 8.11 0.22 -2.63 2.83 3.41 -1.26 -5.03 113.62 119.27 1a4s n SER 31 Ca 0.17 0.72 -0.08 0.00 -0.26 0.00 0.00 58.87 59.42 1a4s n SER 31 Cb 0.45 -1.35 0.03 0.00 -0.26 0.00 0.00 64.21 63.08 1a4s n SER 31 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1a4s n LYS 32 N -1.21 1.00 0.00 4.33 3.00 -1.26 -4.94 118.16 119.08 1a4s n LYS 32 Ca 0.13 -1.97 0.00 0.00 -0.00 0.00 0.00 58.31 56.47 1a4s n LYS 32 Cb 0.49 2.47 0.00 0.00 0.00 0.00 0.00 35.03 37.98 1a4s n LYS 32 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 1a4s n ASP 33 N -1.47 0.00 -3.79 3.14 2.03 -1.26 -3.54 116.55 111.67 1a4s n ASP 33 Ca -0.08 0.00 -0.25 0.00 0.52 0.00 0.00 54.79 54.99 1a4s n ASP 33 Cb 0.53 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.95 1a4s n ASP 33 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1a4s n GLY 34 N -2.00 -0.40 3.75 0.27 0.00 -1.26 -4.95 105.19 100.60 1a4s n GLY 34 Ca 0.00 0.20 -0.37 0.00 0.00 0.00 0.00 46.02 45.86 1a4s n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4s s ALA 35 N -3.75 2.54 -0.00 4.61 0.00 -1.23 -4.84 121.76 119.08 1a4s s ALA 35 Ca 0.09 1.11 -0.31 0.00 0.00 0.00 0.00 51.96 52.86 1a4s s ALA 35 Cb -0.03 -3.50 -0.09 0.00 0.00 0.00 0.00 23.12 19.50 1a4s s ALA 35 CO 0.85 -1.31 1.98 2.41 0.00 0.00 0.00 175.76 179.69 1a4s n THR 36 N -1.59 0.72 -2.49 0.00 -1.04 -1.26 -4.94 114.28 103.68 1a4s n THR 36 Ca 0.14 -0.15 -0.23 0.00 -2.04 0.00 0.00 64.05 61.77 1a4s n THR 36 Cb 0.49 -2.26 0.06 0.00 -1.82 0.00 0.00 70.33 66.80 1a4s n THR 36 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1a4s s THR 37 N 4.64 2.48 0.03 12.58 -4.23 -1.26 -4.61 115.64 125.26 1a4s s THR 37 Ca 0.90 -0.53 0.04 0.00 -1.18 0.00 0.00 61.69 60.93 1a4s s THR 37 Cb -0.48 -2.95 -0.02 0.00 1.34 0.00 0.00 72.50 70.40 1a4s s THR 37 CO 0.43 0.00 -0.12 -1.61 -0.54 0.00 0.00 174.62 172.78 1a4s s GLU 38 N -4.97 0.83 0.42 3.99 0.41 -0.63 -4.92 118.70 113.83 1a4s s GLU 38 Ca 0.59 -0.65 -0.24 0.00 -0.41 0.00 0.00 54.97 54.26 1a4s s GLU 38 Cb -0.10 -0.80 -0.08 0.00 -1.78 0.00 0.00 34.13 31.37 1a4s s GLU 38 CO 0.41 0.20 1.16 -1.25 -0.49 0.00 0.00 175.26 175.29 1a4s s PRO 39 N -0.97 3.96 -0.10 0.39 0.04 -1.26 0.69 135.00 137.75 1a4s s PRO 39 Ca 0.01 1.79 0.03 0.00 0.04 0.00 0.00 61.00 62.87 1a4s s PRO 39 Cb -0.07 -2.57 0.01 0.00 0.04 0.00 0.00 34.50 31.91 1a4s s PRO 39 CO 0.01 -0.39 -0.19 0.14 0.04 0.00 0.00 177.00 176.61 1a4s s VAL 40 N -1.48 1.77 0.23 -0.36 -7.23 -0.53 -4.80 120.40 108.00 1a4s s VAL 40 Ca 0.59 -0.83 0.08 0.00 -1.81 0.00 0.00 61.98 60.02 1a4s s VAL 40 Cb -0.29 -1.56 -0.04 0.00 0.56 0.00 0.00 36.38 35.04 1a4s s VAL 40 CO 0.36 0.49 0.05 -0.36 -0.31 0.00 0.00 175.10 175.33 1a4s s PHE 41 N 0.66 2.86 -0.42 2.82 0.08 -1.26 0.41 117.98 123.12 1a4s s PHE 41 Ca -0.13 -0.16 -0.17 0.00 0.12 0.00 0.00 56.93 56.60 1a4s s PHE 41 Cb -0.16 -1.32 0.02 0.00 -0.57 0.00 0.00 43.02 40.99 1a4s s PHE 41 CO 0.03 0.56 0.42 -2.00 -0.10 0.00 0.00 175.22 174.13 1a4s s GLU 42 N -3.43 3.07 0.35 0.44 2.12 -0.58 -4.74 118.70 115.94 1a4s s GLU 42 Ca 0.30 -0.83 0.03 0.00 0.36 0.00 0.00 54.97 54.83 1a4s s GLU 42 Cb -0.08 -3.98 0.66 0.00 0.26 0.00 0.00 34.13 30.99 1a4s s GLU 42 CO 0.21 -0.85 2.00 -1.35 -0.54 0.00 0.00 175.26 174.73 1a4s h PRO 43 N 8.72 0.81 0.00 4.30 0.11 -1.79 0.19 132.00 144.34 1a4s h PRO 43 Ca -0.27 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1a4s h PRO 43 Cb 1.11 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.04 1a4s h PRO 43 CO 0.79 0.54 0.00 0.00 -0.21 0.00 0.00 178.00 179.12 1a4s n ALA 44 N -2.44 1.60 0.00 -0.75 0.00 -1.26 -1.45 120.51 116.21 1a4s n ALA 44 Ca 0.07 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1a4s n ALA 44 Cb 0.07 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.19 1a4s n ALA 44 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1a4s n THR 45 N -2.00 0.00 -0.82 0.00 -2.24 -0.96 -4.00 114.28 104.27 1a4s n THR 45 Ca 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 1a4s n THR 45 Cb 0.19 0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 1a4s n THR 45 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1a4s n GLY 46 N 0.30 0.82 3.79 3.38 0.00 0.63 -3.76 105.19 110.35 1a4s n GLY 46 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 1a4s n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a4s s ARG 47 N -0.18 3.00 -0.17 1.61 0.52 -1.25 -4.76 118.95 117.71 1a4s s ARG 47 Ca 0.00 1.24 -0.25 0.00 -0.52 0.00 0.00 55.73 56.20 1a4s s ARG 47 Cb 0.00 -1.99 -0.01 0.00 0.52 0.00 0.00 34.95 33.47 1a4s s ARG 47 CO 0.00 -1.07 0.83 0.08 0.02 0.00 0.00 175.30 175.16 1a4s s VAL 48 N -2.52 4.88 -0.00 3.52 1.01 -1.26 -1.52 120.40 124.51 1a4s s VAL 48 Ca 0.64 1.63 0.11 0.00 0.00 0.00 0.00 61.98 64.35 1a4s s VAL 48 Cb -0.17 -4.13 -0.23 0.00 0.00 0.00 0.00 36.38 31.85 1a4s s VAL 48 CO 0.42 0.03 0.82 -0.07 0.00 0.00 0.00 175.10 176.30 1a4s h LEU 49 N 8.31 0.01 0.00 3.92 3.38 -0.36 -3.48 115.31 127.10 1a4s h LEU 49 Ca -0.29 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1a4s h LEU 49 Cb 1.13 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1a4s h LEU 49 CO 0.84 1.02 0.00 0.00 0.09 0.00 0.00 178.44 180.39 1a4s s GLN 51 N -2.00 3.04 -0.12 0.00 -1.52 -1.26 -1.45 119.66 116.35 1a4s s GLN 51 Ca 0.00 -0.41 -0.13 0.00 -1.95 0.00 0.00 55.36 52.87 1a4s s GLN 51 Cb 0.00 -2.84 -0.05 0.00 -0.22 0.00 0.00 33.01 29.90 1a4s s GLN 51 CO 0.00 0.70 0.30 0.00 -0.25 0.00 0.00 175.29 176.03 1a4s s MET 52 N -1.13 4.07 -0.33 2.91 0.23 0.22 -4.88 119.30 120.38 1a4s s MET 52 Ca 0.16 0.13 -0.01 0.00 -1.03 0.00 0.00 55.69 54.94 1a4s s MET 52 Cb -0.12 -3.35 0.07 0.00 -1.53 0.00 0.00 34.83 29.91 1a4s s MET 52 CO 0.05 0.41 0.06 0.54 -2.03 0.00 0.00 175.02 174.05 1a4s s VAL 53 N -0.07 2.93 0.55 5.16 0.11 -1.26 -1.61 120.40 126.22 1a4s s VAL 53 Ca 0.18 -1.72 -0.18 0.00 -2.93 0.00 0.00 61.98 57.33 1a4s s VAL 53 Cb -0.14 -2.84 -0.05 0.00 -1.53 0.00 0.00 36.38 31.82 1a4s s VAL 53 CO 0.06 -0.33 1.09 -2.16 -3.33 0.00 0.00 175.10 170.43 1a4s s PRO 54 N 1.17 3.37 -0.02 1.54 0.04 -1.26 -4.71 135.00 135.13 1a4s s PRO 54 Ca 0.01 1.46 -0.14 0.00 0.04 0.00 0.00 61.00 62.36 1a4s s PRO 54 Cb -0.21 -2.02 -0.05 0.00 0.04 0.00 0.00 34.50 32.26 1a4s s PRO 54 CO -0.03 -0.80 0.37 0.00 0.04 0.00 0.00 177.00 176.58 1a4s n GLY 56 N 1.90 2.05 0.33 0.00 0.00 -1.26 -4.44 105.19 103.77 1a4s n GLY 56 Ca -0.15 -2.12 -0.04 0.00 0.00 0.00 0.00 46.02 43.71 1a4s n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4s h ALA 57 N 0.35 1.07 -0.80 4.61 0.00 -1.98 -2.30 119.26 120.21 1a4s h ALA 57 Ca 0.00 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1a4s h ALA 57 Cb 0.00 -0.34 -0.04 0.00 0.00 0.00 0.00 17.79 17.41 1a4s h ALA 57 CO 0.00 0.50 0.36 0.93 0.00 0.00 0.00 179.25 181.04 1a4s h GLU 58 N 1.14 1.17 -0.10 0.00 3.07 -1.99 -2.01 114.58 115.86 1a4s h GLU 58 Ca 0.30 -0.19 -0.08 0.00 -0.50 0.00 0.00 59.36 58.90 1a4s h GLU 58 Cb -0.09 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 27.62 1a4s h GLU 58 CO -0.06 0.92 -0.24 0.93 -1.40 0.00 0.00 179.01 179.15 1a4s h GLU 59 N 1.14 0.35 -0.96 2.33 3.07 -1.85 -2.38 114.58 116.27 1a4s h GLU 59 Ca 0.27 -0.24 0.00 0.00 -0.50 0.00 0.00 59.36 58.90 1a4s h GLU 59 Cb 0.16 0.03 -0.05 0.00 -0.84 0.00 0.00 28.75 28.06 1a4s h GLU 59 CO -0.03 0.84 0.62 0.28 -1.40 0.00 0.00 179.01 179.32 1a4s h VAL 60 N -0.10 1.25 -0.38 3.13 2.07 -1.39 -1.41 116.25 119.43 1a4s h VAL 60 Ca -0.00 -0.50 -0.08 0.00 0.82 0.00 0.00 66.70 66.94 1a4s h VAL 60 Cb 0.84 -0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 1a4s h VAL 60 CO 0.05 0.26 -0.09 -0.78 0.02 0.00 0.00 177.57 177.03 1a4s h ASP 61 N 1.32 0.63 -0.41 0.57 3.58 -1.35 -0.85 116.42 119.91 1a4s h ASP 61 Ca 0.35 -0.17 -0.07 0.00 0.42 0.00 0.00 57.03 57.56 1a4s h ASP 61 Cb -0.11 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 40.75 1a4s h ASP 61 CO -0.07 0.76 -0.01 1.56 -2.88 0.00 0.00 179.24 178.59 1a4s h GLN 62 N 0.60 0.73 -0.48 0.28 4.20 -0.82 -0.62 115.11 119.00 1a4s h GLN 62 Ca 0.11 -0.24 0.01 0.00 0.06 0.00 0.00 58.65 58.59 1a4s h GLN 62 Cb 0.51 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.20 1a4s h GLN 62 CO 0.03 0.82 0.30 0.00 -0.67 0.00 0.00 178.83 179.31 1a4s h ALA 63 N 0.88 0.61 -0.23 3.87 0.00 -0.51 -1.92 119.26 121.96 1a4s h ALA 63 Ca 0.11 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1a4s h ALA 63 Cb 0.50 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1a4s h ALA 63 CO 0.02 0.02 -0.06 0.28 0.00 0.00 0.00 179.25 179.51 1a4s h VAL 64 N 0.61 1.29 -0.79 0.00 2.07 -1.05 -1.85 116.25 116.53 1a4s h VAL 64 Ca 0.18 -1.08 0.09 0.00 0.82 0.00 0.00 66.70 66.72 1a4s h VAL 64 Cb -0.04 1.52 -0.07 0.00 -1.52 0.00 0.00 31.29 31.18 1a4s h VAL 64 CO -0.06 0.33 0.45 1.56 0.02 0.00 0.00 177.57 179.87 1a4s h GLN 65 N 0.18 0.74 -0.29 1.57 4.20 -1.12 0.12 115.11 120.51 1a4s h GLN 65 Ca 0.06 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.72 1a4s h GLN 65 Cb 0.53 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 1a4s h GLN 65 CO 0.02 0.49 0.15 1.03 -0.67 0.00 0.00 178.83 179.86 1a4s h SER 66 N 0.76 0.36 -0.67 1.46 0.87 -1.20 -2.47 113.55 112.66 1a4s h SER 66 Ca 0.38 -0.09 0.09 0.00 -1.23 0.00 0.00 61.79 60.94 1a4s h SER 66 Cb 0.34 -0.09 -0.07 0.00 -0.44 0.00 0.00 62.40 62.14 1a4s h SER 66 CO -0.24 0.35 0.32 0.00 -0.53 0.00 0.00 176.83 176.72 1a4s h ALA 67 N 1.03 0.90 -0.67 6.23 0.00 -0.58 -2.46 119.26 123.71 1a4s h ALA 67 Ca 0.10 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1a4s h ALA 67 Cb 0.07 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1a4s h ALA 67 CO -0.02 -0.08 0.43 0.37 0.00 0.00 0.00 179.25 179.96 1a4s h GLN 68 N 0.56 0.88 -0.49 0.00 5.75 -0.74 -0.51 115.11 120.55 1a4s h GLN 68 Ca 0.32 -0.06 -0.13 0.00 -0.15 0.00 0.00 58.65 58.64 1a4s h GLN 68 Cb 0.33 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 28.67 1a4s h GLN 68 CO -0.26 0.60 -0.20 0.00 -2.65 0.00 0.00 178.83 176.32 1a4s h ALA 69 N 1.24 0.72 -0.55 3.38 0.00 -1.26 -2.05 119.26 120.74 1a4s h ALA 69 Ca 0.24 -0.38 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 1a4s h ALA 69 Cb -0.09 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1a4s h ALA 69 CO -0.05 0.67 0.08 0.00 0.00 0.00 0.00 179.25 179.95 1a4s h ALA 70 N 0.90 1.11 -0.87 0.00 0.00 -1.07 -3.07 119.26 116.27 1a4s h ALA 70 Ca 0.12 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 54.85 1a4s h ALA 70 Cb 0.77 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 1a4s h ALA 70 CO 0.06 0.58 0.54 -0.92 0.00 0.00 0.00 179.25 179.51 1a4s h TYR 71 N 0.83 1.00 -0.72 0.00 3.20 -0.64 -0.87 116.97 119.77 1a4s h TYR 71 Ca 0.17 0.03 0.13 0.00 3.14 0.00 0.00 58.73 62.20 1a4s h TYR 71 Cb 0.38 -0.32 -0.05 0.00 1.54 0.00 0.00 36.73 38.28 1a4s h TYR 71 CO 0.02 0.50 0.48 -0.07 -1.64 0.00 0.00 178.16 177.46 1a4s h LEU 72 N 0.98 0.42 0.00 2.82 4.07 -1.28 -1.28 115.31 121.04 1a4s h LEU 72 Ca 0.38 0.02 -0.09 0.00 0.08 0.00 0.00 57.88 58.27 1a4s h LEU 72 Cb 0.18 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 41.84 1a4s h LEU 72 CO -0.18 0.23 -0.48 0.50 -1.08 0.00 0.00 178.44 177.43 1a4s h LYS 73 N 0.45 0.00 -0.11 1.13 1.63 -1.34 -3.37 116.57 114.97 1a4s h LYS 73 Ca 0.35 0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 60.07 1a4s h LYS 73 Cb 0.72 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.34 1a4s h LYS 73 CO -0.11 0.99 -0.27 2.35 -3.45 0.00 0.00 179.45 178.96 1a4s h TRP 74 N -1.00 0.21 0.00 1.91 2.91 -1.11 -2.44 115.95 116.43 1a4s h TRP 74 Ca -0.13 -0.04 0.00 0.00 1.13 0.00 0.00 58.89 59.85 1a4s h TRP 74 Cb 1.11 -0.05 0.00 0.00 -0.51 0.00 0.00 29.16 29.71 1a4s h TRP 74 CO 0.21 0.45 0.00 -1.13 -1.03 0.00 0.00 178.44 176.94 1a4s n SER 75 N -4.16 0.00 -0.29 2.65 3.41 -0.49 -1.76 113.62 112.98 1a4s n SER 75 Ca -0.01 0.48 0.11 0.00 -0.26 0.00 0.00 58.87 59.19 1a4s n SER 75 Cb 0.36 -0.49 0.09 0.00 -0.26 0.00 0.00 64.21 63.91 1a4s n SER 75 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1a4s n LYS 76 N -1.49 0.77 -3.02 4.33 4.01 -0.92 -4.86 118.16 116.98 1a4s n LYS 76 Ca 0.05 -0.59 -0.38 0.00 -0.51 0.00 0.00 58.31 56.88 1a4s n LYS 76 Cb 0.23 -1.49 -0.06 0.00 -0.51 0.00 0.00 35.03 33.20 1a4s n LYS 76 CO 0.00 0.00 0.00 -1.64 -1.11 0.00 0.00 177.40 174.65 1a4s s MET 77 N -2.64 4.47 0.92 1.97 -1.94 -0.72 -5.07 119.30 116.30 1a4s s MET 77 Ca 0.17 1.07 -0.13 0.00 -1.71 0.00 0.00 55.69 55.09 1a4s s MET 77 Cb 0.18 -3.15 0.15 0.00 2.01 0.00 0.00 34.83 34.02 1a4s s MET 77 CO 0.63 0.52 1.18 0.00 -0.01 0.00 0.00 175.02 177.34 1a4s s ALA 78 N -1.25 1.93 0.15 3.03 0.00 -1.26 -4.74 121.76 119.62 1a4s s ALA 78 Ca 0.38 -0.70 -0.18 0.00 0.00 0.00 0.00 51.96 51.46 1a4s s ALA 78 Cb -0.21 -2.96 0.06 0.00 0.00 0.00 0.00 23.12 20.00 1a4s s ALA 78 CO 0.24 -2.30 1.69 0.78 0.00 0.00 0.00 175.76 176.17 1a4s h GLY 79 N -1.53 0.27 2.00 0.00 0.00 -1.93 -0.97 103.07 100.91 1a4s h GLY 79 Ca -0.48 0.08 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 1a4s h GLY 79 CO 0.56 -0.11 -0.05 1.19 0.00 0.00 0.00 176.54 178.14 1a4s h ILE 80 N 0.04 0.91 0.13 2.60 6.09 -1.91 0.12 117.51 125.49 1a4s h ILE 80 Ca 0.16 -0.17 -0.30 0.00 -1.37 0.00 0.00 64.86 63.18 1a4s h ILE 80 Cb 0.24 1.09 -0.00 0.00 0.47 0.00 0.00 36.82 38.62 1a4s h ILE 80 CO -0.31 0.05 -1.44 -0.33 -3.07 0.00 0.00 178.15 173.04 1a4s h GLU 81 N 0.00 0.27 -0.38 2.19 5.08 -1.68 -3.20 114.58 116.86 1a4s h GLU 81 Ca -0.00 -0.45 -0.15 0.00 -1.00 0.00 0.00 59.36 57.76 1a4s h GLU 81 Cb 0.09 0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1a4s h GLU 81 CO 0.01 1.16 -0.33 0.00 -1.00 0.00 0.00 179.01 178.84 1a4s h ARG 82 N 0.07 0.90 -0.57 2.33 3.08 -0.65 -3.23 114.38 116.31 1a4s h ARG 82 Ca -0.21 -0.46 0.11 0.00 0.07 0.00 0.00 59.98 59.50 1a4s h ARG 82 Cb 2.01 0.01 -0.11 0.00 0.08 0.00 0.00 29.97 31.96 1a4s h ARG 82 CO 0.18 1.11 -0.15 1.03 -1.07 0.00 0.00 179.97 181.07 1a4s h SER 83 N 0.71 -0.54 -0.77 7.04 0.87 -0.86 -1.87 113.55 118.13 1a4s h SER 83 Ca 0.07 0.17 0.03 0.00 -1.23 0.00 0.00 61.79 60.83 1a4s h SER 83 Cb 0.92 0.36 -0.05 0.00 -0.44 0.00 0.00 62.40 63.19 1a4s h SER 83 CO 0.08 -0.19 0.48 0.03 -0.53 0.00 0.00 176.83 176.71 1a4s h ARG 84 N -0.01 0.91 -0.25 2.24 2.47 -1.56 -0.30 114.38 117.87 1a4s h ARG 84 Ca 0.27 -0.05 -0.08 0.00 -1.26 0.00 0.00 59.98 58.86 1a4s h ARG 84 Cb 0.42 -0.21 -0.01 0.00 -1.65 0.00 0.00 29.97 28.53 1a4s h ARG 84 CO -0.59 0.60 -0.14 0.28 0.56 0.00 0.00 179.97 180.69 1a4s h VAL 85 N 0.94 1.30 -0.76 2.04 2.07 -1.58 -2.68 116.25 117.58 1a4s h VAL 85 Ca 0.31 -1.23 -0.01 0.00 0.82 0.00 0.00 66.70 66.58 1a4s h VAL 85 Cb 0.03 1.57 -0.04 0.00 -1.52 0.00 0.00 31.29 31.33 1a4s h VAL 85 CO -0.12 0.39 0.41 0.24 0.02 0.00 0.00 177.57 178.51 1a4s h MET 86 N 0.26 1.05 -0.46 1.57 2.86 -1.14 -1.12 114.93 117.95 1a4s h MET 86 Ca 0.05 -0.12 -0.04 0.00 -2.06 0.00 0.00 59.70 57.53 1a4s h MET 86 Cb 0.65 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 32.08 1a4s h MET 86 CO 0.04 0.77 0.10 -0.07 1.06 0.00 0.00 176.91 178.81 1a4s h LEU 87 N 1.06 0.65 -0.58 1.22 3.38 -0.94 -1.99 115.31 118.10 1a4s h LEU 87 Ca 0.27 -0.11 -0.14 0.00 0.09 0.00 0.00 57.88 57.99 1a4s h LEU 87 Cb 0.03 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1a4s h LEU 87 CO -0.04 0.65 -0.36 -0.33 0.09 0.00 0.00 178.44 178.44 1a4s h GLU 88 N 0.68 0.73 -0.77 1.13 4.39 -1.04 -1.12 114.58 118.57 1a4s h GLU 88 Ca 0.15 -0.36 -0.02 0.00 0.34 0.00 0.00 59.36 59.47 1a4s h GLU 88 Cb 0.27 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.88 1a4s h GLU 88 CO -0.00 0.97 0.40 0.00 -1.16 0.00 0.00 179.01 179.22 1a4s h ALA 89 N 0.99 0.99 -0.51 3.43 0.00 -0.70 -1.81 119.26 121.65 1a4s h ALA 89 Ca 0.06 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1a4s h ALA 89 Cb 0.90 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1a4s h ALA 89 CO 0.08 0.52 0.20 0.00 0.00 0.00 0.00 179.25 180.05 1a4s h ALA 90 N 1.21 0.67 -0.59 0.00 0.00 -1.20 -2.35 119.26 117.00 1a4s h ALA 90 Ca 0.27 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.10 1a4s h ALA 90 Cb 0.07 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 17.59 1a4s h ALA 90 CO -0.04 0.28 0.24 -0.09 0.00 0.00 0.00 179.25 179.64 1a4s h ARG 91 N 0.69 0.43 -0.42 0.00 2.43 -0.78 -1.19 114.38 115.54 1a4s h ARG 91 Ca 0.17 -0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.21 1a4s h ARG 91 Cb 0.21 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 1a4s h ARG 91 CO -0.01 0.28 -0.15 0.82 -1.51 0.00 0.00 179.97 179.40 1a4s h ILE 92 N 0.44 1.26 -0.45 1.20 2.04 -1.04 -1.78 117.51 119.19 1a4s h ILE 92 Ca 0.29 -1.22 -0.11 0.00 1.00 0.00 0.00 64.86 64.82 1a4s h ILE 92 Cb 0.32 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1a4s h ILE 92 CO -0.27 0.41 -0.15 0.40 0.00 0.00 0.00 178.15 178.55 1a4s h ILE 93 N 0.69 1.27 -0.41 -0.67 2.04 -1.17 -2.10 117.51 117.16 1a4s h ILE 93 Ca 0.11 -1.28 0.07 0.00 1.00 0.00 0.00 64.86 64.76 1a4s h ILE 93 Cb 0.63 1.17 -0.06 0.00 -0.74 0.00 0.00 36.82 37.82 1a4s h ILE 93 CO 0.04 0.44 0.04 0.03 0.00 0.00 0.00 178.15 178.71 1a4s h ARG 94 N 0.72 0.16 -0.39 2.37 3.08 -0.81 -0.49 114.38 119.02 1a4s h ARG 94 Ca 0.11 -0.01 -0.05 0.00 0.07 0.00 0.00 59.98 60.10 1a4s h ARG 94 Cb 0.71 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.70 1a4s h ARG 94 CO 0.05 0.10 0.02 0.93 -1.07 0.00 0.00 179.97 180.01 1a4s h GLU 95 N 0.16 0.60 -0.53 0.04 5.08 -1.05 -3.01 114.58 115.88 1a4s h GLU 95 Ca 0.20 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.41 1a4s h GLU 95 Cb 0.27 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1a4s h GLU 95 CO -0.30 0.61 0.02 0.54 -1.00 0.00 0.00 179.01 178.88 1a4s n ARG 96 N -4.27 4.46 0.05 2.33 1.74 -0.81 -4.77 116.66 115.39 1a4s n ARG 96 Ca 0.02 -3.11 -0.13 0.00 -0.77 0.00 0.00 57.85 53.86 1a4s n ARG 96 Cb 0.25 -2.19 -0.07 0.00 -1.02 0.00 0.00 32.46 29.43 1a4s n ARG 96 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1a4s h ARG 97 N 3.49 -0.55 -0.68 5.56 1.12 -0.96 -1.04 114.38 121.32 1a4s h ARG 97 Ca 0.02 0.04 -0.04 0.00 -1.11 0.00 0.00 59.98 58.89 1a4s h ARG 97 Cb 1.92 0.12 -0.03 0.00 -0.01 0.00 0.00 29.97 31.97 1a4s h ARG 97 CO 0.46 -0.36 0.28 -0.44 -3.11 0.00 0.00 179.97 176.80 1a4s h ASP 98 N -0.57 0.91 -0.30 -3.80 3.32 -1.86 -1.45 116.42 112.68 1a4s h ASP 98 Ca 0.05 -0.12 -0.13 0.00 0.02 0.00 0.00 57.03 56.85 1a4s h ASP 98 Cb 0.65 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.96 1a4s h ASP 98 CO -0.33 0.80 -0.33 0.78 -1.72 0.00 0.00 179.24 178.45 1a4s h ASN 99 N 0.98 0.80 -0.51 6.45 2.35 -1.78 -2.26 115.58 121.61 1a4s h ASN 99 Ca 0.23 -0.48 -0.06 0.00 -0.55 0.00 0.00 56.30 55.44 1a4s h ASN 99 Cb 0.17 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 1a4s h ASN 99 CO -0.02 1.12 0.10 0.40 -1.65 0.00 0.00 177.43 177.37 1a4s h ILE 100 N 0.50 1.25 -0.61 2.81 2.04 -1.18 -2.12 117.51 120.21 1a4s h ILE 100 Ca 0.04 -0.91 0.06 0.00 1.00 0.00 0.00 64.86 65.05 1a4s h ILE 100 Cb 0.91 0.85 -0.06 0.00 -0.74 0.00 0.00 36.82 37.79 1a4s h ILE 100 CO 0.08 0.33 0.31 0.00 0.00 0.00 0.00 178.15 178.87 1a4s h ALA 101 N 0.98 0.80 0.21 1.87 0.00 -1.17 -1.30 119.26 120.66 1a4s h ALA 101 Ca 0.16 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1a4s h ALA 101 Cb 0.38 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1a4s h ALA 101 CO 0.01 -0.04 -0.10 -0.22 0.00 0.00 0.00 179.25 178.90 1a4s h LYS 102 N 0.58 -0.27 -0.21 0.00 3.64 -1.20 -0.95 116.57 118.16 1a4s h LYS 102 Ca 0.28 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1a4s h LYS 102 Cb 0.21 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1a4s h LYS 102 CO -0.20 -0.17 0.13 1.25 -2.27 0.00 0.00 179.45 178.19 1a4s h LEU 103 N -0.28 0.25 -0.43 5.20 6.46 -0.90 -1.90 115.31 123.70 1a4s h LEU 103 Ca -0.03 -0.01 -0.07 0.00 -0.12 0.00 0.00 57.88 57.65 1a4s h LEU 103 Cb 0.22 -0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 40.07 1a4s h LEU 103 CO 0.05 0.19 -0.01 -0.08 -0.62 0.00 0.00 178.44 177.97 1a4s h GLU 104 N 0.29 0.77 -0.55 1.25 4.57 -0.82 -2.90 114.58 117.20 1a4s h GLU 104 Ca 0.08 -0.25 0.04 0.00 -1.18 0.00 0.00 59.36 58.04 1a4s h GLU 104 Cb -0.01 -0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.47 1a4s h GLU 104 CO -0.01 0.85 0.31 0.28 -1.18 0.00 0.00 179.01 179.25 1a4s h VAL 105 N 0.60 1.01 -0.63 0.32 2.07 -0.59 -1.33 116.25 117.70 1a4s h VAL 105 Ca 0.12 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 1a4s h VAL 105 Cb 0.51 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 1a4s h VAL 105 CO 0.02 0.11 0.34 0.40 0.02 0.00 0.00 177.57 178.46 1a4s h ILE 106 N 0.60 1.20 0.23 4.57 2.04 -1.17 0.21 117.51 125.19 1a4s h ILE 106 Ca 0.23 -0.52 -0.33 0.00 1.00 0.00 0.00 64.86 65.24 1a4s h ILE 106 Cb 0.08 0.40 0.03 0.00 -0.74 0.00 0.00 36.82 36.60 1a4s h ILE 106 CO -0.13 0.22 -1.44 -1.13 0.00 0.00 0.00 178.15 175.68 1a4s h ASN 107 N 0.85 0.80 0.26 1.72 -0.00 -1.34 -3.37 115.58 114.52 1a4s h ASN 107 Ca 0.22 -0.85 -0.34 0.00 -0.00 0.00 0.00 56.30 55.33 1a4s h ASN 107 Cb 0.05 -0.26 -0.04 0.00 -0.00 0.00 0.00 38.32 38.07 1a4s h ASN 107 CO -0.03 1.66 -1.97 -3.20 -0.00 0.00 0.00 177.43 173.89 1a4s n ASN 108 N -3.70 1.26 0.00 1.15 2.85 -0.52 -4.50 115.26 111.80 1a4s n ASN 108 Ca -0.16 0.24 0.00 0.00 -0.11 0.00 0.00 54.58 54.55 1a4s n ASN 108 Cb 1.09 -0.21 0.00 0.00 1.24 0.00 0.00 39.78 41.90 1a4s n ASN 108 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1a4s n GLY 109 N 1.79 0.87 3.84 8.20 0.00 0.73 -4.64 105.19 115.98 1a4s n GLY 109 Ca -0.27 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.45 1a4s n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1a4s s LYS 110 N -0.80 2.70 0.60 1.61 -2.85 -1.26 -3.88 119.74 115.87 1a4s s LYS 110 Ca 0.00 0.67 -0.17 0.00 -1.00 0.00 0.00 55.97 55.48 1a4s s LYS 110 Cb 0.00 -1.99 -0.03 0.00 -2.06 0.00 0.00 37.83 33.76 1a4s s LYS 110 CO 0.00 -1.20 1.10 0.95 0.10 0.00 0.00 175.35 176.30 1a4s s THR 111 N -3.19 3.39 0.31 3.79 -4.23 -1.26 -4.63 115.64 109.82 1a4s s THR 111 Ca 0.59 0.71 0.03 0.00 -1.18 0.00 0.00 61.69 61.84 1a4s s THR 111 Cb -0.13 -3.23 0.13 0.00 1.34 0.00 0.00 72.50 70.61 1a4s s THR 111 CO 0.54 -0.33 1.82 0.16 -0.54 0.00 0.00 174.62 176.26 1a4s h ILE 112 N 0.50 1.22 -0.71 2.99 -0.00 -1.60 0.10 117.51 120.02 1a4s h ILE 112 Ca -0.48 -0.94 0.14 0.00 -0.00 0.00 0.00 64.86 63.58 1a4s h ILE 112 Cb 1.24 1.06 -0.09 0.00 -0.00 0.00 0.00 36.82 39.03 1a4s h ILE 112 CO 0.56 0.31 0.24 0.74 -0.00 0.00 0.00 178.15 180.00 1a4s h THR 113 N 0.50 0.63 -0.04 0.16 2.02 -1.87 -2.13 112.91 112.17 1a4s h THR 113 Ca 0.10 -0.13 -0.23 0.00 0.77 0.00 0.00 66.41 66.92 1a4s h THR 113 Cb 0.44 0.23 0.02 0.00 -1.74 0.00 0.00 68.15 67.09 1a4s h THR 113 CO 0.02 0.07 -0.88 -0.33 0.37 0.00 0.00 175.52 174.77 1a4s h GLU 114 N 0.37 0.68 -0.76 6.66 5.08 -1.69 -3.33 114.58 121.58 1a4s h GLU 114 Ca 0.39 -0.67 -0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1a4s h GLU 114 Cb 0.59 0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.98 1a4s h GLU 114 CO -0.42 1.26 0.47 0.00 -1.00 0.00 0.00 179.01 179.33 1a4s h ALA 115 N 0.43 1.40 -0.74 3.43 0.00 -0.49 -1.64 119.26 121.65 1a4s h ALA 115 Ca -0.10 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.77 1a4s h ALA 115 Cb 1.54 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 18.97 1a4s h ALA 115 CO 0.18 0.53 0.47 0.93 0.00 0.00 0.00 179.25 181.35 1a4s h GLU 116 N 1.04 0.88 -0.68 0.00 5.08 -1.51 -1.16 114.58 118.23 1a4s h GLU 116 Ca 0.27 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.55 1a4s h GLU 116 Cb -0.07 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 28.95 1a4s h GLU 116 CO -0.05 0.58 0.29 1.88 -1.00 0.00 0.00 179.01 180.71 1a4s h TYR 117 N 0.91 0.99 -0.74 4.33 0.05 -1.44 -1.70 116.97 119.37 1a4s h TYR 117 Ca 0.30 -0.05 -0.01 0.00 0.05 0.00 0.00 58.73 59.02 1a4s h TYR 117 Cb 0.02 -0.31 -0.04 0.00 1.01 0.00 0.00 36.73 37.42 1a4s h TYR 117 CO -0.04 0.75 0.44 -0.44 -1.05 0.00 0.00 178.16 177.81 1a4s h ASP 118 N 0.98 0.90 0.88 3.88 5.19 -0.78 -0.45 116.42 127.01 1a4s h ASP 118 Ca 0.23 -0.07 -0.21 0.00 -0.62 0.00 0.00 57.03 56.36 1a4s h ASP 118 Cb 0.15 -0.23 -0.02 0.00 0.18 0.00 0.00 39.33 39.41 1a4s h ASP 118 CO -0.02 0.71 -0.98 0.40 -3.12 0.00 0.00 179.24 176.22 1a4s h ILE 119 N 1.01 1.65 -0.28 0.35 1.08 -0.93 -1.29 117.51 119.11 1a4s h ILE 119 Ca 0.26 -3.19 -0.04 0.00 -0.39 0.00 0.00 64.86 61.50 1a4s h ILE 119 Cb -0.02 2.76 -0.01 0.00 -3.07 0.00 0.00 36.82 36.48 1a4s h ILE 119 CO -0.05 0.92 0.02 0.44 -0.69 0.00 0.00 178.15 178.78 1a4s h ASP 120 N 0.02 0.47 -0.95 1.72 3.32 -1.21 -1.79 116.42 117.99 1a4s h ASP 120 Ca -0.03 -0.29 0.09 0.00 0.02 0.00 0.00 57.03 56.82 1a4s h ASP 120 Cb 1.71 -0.13 -0.07 0.00 0.22 0.00 0.00 39.33 41.06 1a4s h ASP 120 CO 0.13 0.65 0.60 0.00 -1.72 0.00 0.00 179.24 178.90 1a4s h ALA 121 N 0.84 1.36 -0.36 3.45 0.00 -0.87 -0.93 119.26 122.74 1a4s h ALA 121 Ca 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1a4s h ALA 121 Cb 0.40 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1a4s h ALA 121 CO 0.01 0.30 0.12 0.00 0.00 0.00 0.00 179.25 179.68 1a4s h ALA 122 N 1.47 0.46 -0.20 0.00 0.00 -0.42 -0.92 119.26 119.65 1a4s h ALA 122 Ca 0.44 -0.15 -0.16 0.00 0.00 0.00 0.00 54.91 55.03 1a4s h ALA 122 Cb 0.29 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1a4s h ALA 122 CO -0.21 0.09 -0.53 0.11 0.00 0.00 0.00 179.25 178.71 1a4s h TRP 123 N 0.42 0.74 -0.38 0.00 5.08 -1.08 -2.72 115.95 118.01 1a4s h TRP 123 Ca 0.12 -0.26 -0.02 0.00 1.08 0.00 0.00 58.89 59.81 1a4s h TRP 123 Cb 0.23 -0.14 -0.02 0.00 -3.00 0.00 0.00 29.16 26.23 1a4s h TRP 123 CO 0.01 0.99 0.14 1.96 -1.28 0.00 0.00 178.44 180.26 1a4s h GLN 124 N 0.46 0.54 -0.33 0.12 4.20 -1.07 -0.67 115.11 118.36 1a4s h GLN 124 Ca 0.01 -0.07 -0.17 0.00 0.06 0.00 0.00 58.65 58.48 1a4s h GLN 124 Cb 1.07 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.75 1a4s h GLN 124 CO 0.10 0.46 -0.46 0.00 -0.67 0.00 0.00 178.83 178.26 1a4s h ILE 126 N 0.70 1.23 -0.32 0.00 2.04 -1.23 -1.71 117.51 118.23 1a4s h ILE 126 Ca 0.04 -0.76 -0.08 0.00 1.00 0.00 0.00 64.86 65.06 1a4s h ILE 126 Cb 1.06 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.86 1a4s h ILE 126 CO 0.11 0.28 -0.12 -0.08 0.00 0.00 0.00 178.15 178.34 1a4s h GLU 127 N 0.72 0.55 -0.45 2.37 4.81 -0.93 -1.41 114.58 120.23 1a4s h GLU 127 Ca 0.17 -0.16 -0.11 0.00 -0.13 0.00 0.00 59.36 59.13 1a4s h GLU 127 Cb 0.26 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1a4s h GLU 127 CO -0.01 0.66 -0.13 -0.92 -0.73 0.00 0.00 179.01 177.88 1a4s h TYR 128 N 0.50 1.01 0.00 0.92 3.20 -0.23 -2.60 116.97 119.77 1a4s h TYR 128 Ca 0.09 -0.22 -0.19 0.00 3.14 0.00 0.00 58.73 61.55 1a4s h TYR 128 Cb 0.51 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.51 1a4s h TYR 128 CO 0.02 0.99 -0.91 1.88 -1.64 0.00 0.00 178.16 178.51 1a4s h TYR 129 N 0.73 0.00 -0.38 -3.82 0.05 -1.22 -2.05 116.97 110.27 1a4s h TYR 129 Ca 0.11 0.00 0.05 0.00 0.05 0.00 0.00 58.73 58.95 1a4s h TYR 129 Cb 0.68 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.37 1a4s h TYR 129 CO 0.05 0.91 0.10 0.00 -1.05 0.00 0.00 178.16 178.17 1a4s h ALA 130 N 1.09 0.43 -0.18 3.88 0.00 -1.28 -1.13 119.26 122.07 1a4s h ALA 130 Ca -0.01 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1a4s h ALA 130 Cb 1.61 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.46 1a4s h ALA 130 CO 0.12 -0.30 0.05 0.78 0.00 0.00 0.00 179.25 179.90 1a4s h GLY 131 N 0.24 0.26 1.98 0.00 0.00 -1.03 -3.02 103.07 101.50 1a4s h GLY 131 Ca 0.18 -0.12 -0.20 0.00 0.00 0.00 0.00 47.33 47.19 1a4s h GLY 131 CO -0.22 0.11 -0.97 1.41 0.00 0.00 0.00 176.54 176.88 1a4s h LEU 132 N 0.25 0.02 -0.70 3.11 4.07 -0.68 -3.39 115.31 117.99 1a4s h LEU 132 Ca 0.06 -0.02 0.15 0.00 0.08 0.00 0.00 57.88 58.15 1a4s h LEU 132 Cb 0.10 -0.01 -0.11 0.00 1.08 0.00 0.00 40.66 41.72 1a4s h LEU 132 CO -0.00 0.97 0.09 0.00 -1.08 0.00 0.00 178.44 178.42 1a4s h ALA 133 N 1.02 0.82 0.00 1.53 0.00 -1.09 -0.27 119.26 121.27 1a4s h ALA 133 Ca -0.01 0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1a4s h ALA 133 Cb 1.70 0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.78 1a4s h ALA 133 CO 0.13 -0.37 0.00 -2.30 0.00 0.00 0.00 179.25 176.70 1a4s n PRO 134 N -5.23 0.48 -0.03 0.00 -0.02 -1.26 -2.78 135.00 126.16 1a4s n PRO 134 Ca 0.13 0.04 0.04 0.00 -2.02 0.00 0.00 63.50 61.68 1a4s n PRO 134 Cb 0.43 -1.50 -0.15 0.00 -0.02 0.00 0.00 33.50 32.27 1a4s n PRO 134 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1a4s n THR 135 N -1.11 0.58 -1.62 3.45 -1.04 -0.14 -4.90 114.28 109.50 1a4s n THR 135 Ca 0.12 -0.63 -0.50 0.00 -2.04 0.00 0.00 64.05 61.01 1a4s n THR 135 Cb 0.10 -0.23 -0.05 0.00 -1.82 0.00 0.00 70.33 68.32 1a4s n THR 135 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1a4s n LEU 136 N -2.50 2.14 -3.62 -4.42 4.32 -1.06 -4.97 117.00 106.90 1a4s n LEU 136 Ca -0.13 1.11 -0.06 0.00 -0.02 0.00 0.00 56.01 56.90 1a4s n LEU 136 Cb 0.77 -1.27 -0.02 0.00 -1.62 0.00 0.00 43.42 41.28 1a4s n LEU 136 CO 0.44 -0.80 0.67 -0.94 -1.22 0.00 0.00 177.39 175.55 1a4s s SER 137 N 0.60 -0.30 0.00 -1.43 1.04 -1.26 -5.00 113.70 107.35 1a4s s SER 137 Ca 0.82 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 57.06 1a4s s SER 137 Cb -0.86 0.45 0.00 0.00 0.10 0.00 0.00 66.02 65.72 1a4s s SER 137 CO 0.44 -0.79 0.00 0.61 0.98 0.00 0.00 173.24 174.48 1a4s n GLY 138 N -0.36 2.13 3.67 7.32 0.00 -1.24 -4.68 105.19 112.03 1a4s n GLY 138 Ca -0.08 -1.99 -0.26 0.00 0.00 0.00 0.00 46.02 43.68 1a4s n GLY 138 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1a4s s GLN 139 N 3.23 2.08 -0.11 1.61 -0.21 -1.23 -4.88 119.66 120.15 1a4s s GLN 139 Ca 0.00 -1.94 0.00 0.00 0.02 0.00 0.00 55.36 53.44 1a4s s GLN 139 Cb 0.00 -1.83 0.02 0.00 1.00 0.00 0.00 33.01 32.21 1a4s s GLN 139 CO 0.00 -0.04 -0.10 -1.58 -2.12 0.00 0.00 175.29 171.45 1a4s s HIS 140 N -2.63 1.59 -0.06 0.91 5.65 -1.26 -1.52 115.29 117.97 1a4s s HIS 140 Ca 0.37 -0.77 0.02 0.00 0.25 0.00 0.00 55.06 54.93 1a4s s HIS 140 Cb 0.06 -1.26 0.01 0.00 -1.18 0.00 0.00 32.58 30.21 1a4s s HIS 140 CO 0.20 -0.48 -0.11 0.42 -0.65 0.00 0.00 174.74 174.12 1a4s s ILE 141 N 1.41 1.02 -0.05 0.89 1.01 -0.28 -5.02 121.20 120.19 1a4s s ILE 141 Ca 0.00 -0.42 -0.26 0.00 0.00 0.00 0.00 60.65 59.97 1a4s s ILE 141 Cb -0.13 -0.94 -0.03 0.00 0.01 0.00 0.00 42.46 41.36 1a4s s ILE 141 CO -0.06 0.33 0.80 -1.10 0.00 0.00 0.00 174.94 174.91 1a4s s GLN 142 N 0.62 4.48 0.35 2.79 -0.21 -1.26 -1.58 119.66 124.84 1a4s s GLN 142 Ca -0.13 1.06 0.08 0.00 0.02 0.00 0.00 55.36 56.40 1a4s s GLN 142 Cb -0.15 -3.45 -0.04 0.00 1.00 0.00 0.00 33.01 30.37 1a4s s GLN 142 CO 0.03 0.02 0.19 -0.51 -2.12 0.00 0.00 175.29 172.90 1a4s s LEU 143 N 0.89 3.33 0.21 2.90 1.43 -0.47 -4.96 118.68 122.01 1a4s s LEU 143 Ca 0.42 -0.73 -0.32 0.00 -1.03 0.00 0.00 54.13 52.47 1a4s s LEU 143 Cb -0.19 -1.84 -0.13 0.00 0.03 0.00 0.00 46.19 44.07 1a4s s LEU 143 CO 0.21 -0.34 1.63 -2.65 0.23 0.00 0.00 176.35 175.43 1a4s n PRO 144 N -1.22 2.51 -2.32 1.29 -0.02 -1.26 -3.36 135.00 130.62 1a4s n PRO 144 Ca -0.02 0.90 -0.02 0.00 -2.02 0.00 0.00 63.50 62.34 1a4s n PRO 144 Cb 0.61 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 1a4s n PRO 144 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1a4s n GLY 145 N 3.28 0.53 3.30 -1.23 0.00 -1.26 -3.73 105.19 106.07 1a4s n GLY 145 Ca 0.14 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.47 1a4s n GLY 145 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a4s n GLY 146 N -0.84 2.97 3.69 -0.02 0.00 -1.21 -4.91 105.19 104.86 1a4s n GLY 146 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 1a4s n GLY 146 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4s s ALA 147 N -2.29 1.28 0.03 4.61 0.00 -1.24 -4.60 121.76 119.54 1a4s s ALA 147 Ca 0.00 -0.04 -0.14 0.00 0.00 0.00 0.00 51.96 51.78 1a4s s ALA 147 Cb 0.00 -3.21 0.02 0.00 0.00 0.00 0.00 23.12 19.93 1a4s s ALA 147 CO 0.00 -2.58 0.31 -0.59 0.00 0.00 0.00 175.76 172.90 1a4s s PHE 148 N -2.86 -0.13 0.27 0.00 -0.71 -0.98 -1.37 117.98 112.20 1a4s s PHE 148 Ca 0.64 0.03 0.10 0.00 -1.04 0.00 0.00 56.93 56.66 1a4s s PHE 148 Cb -0.19 0.10 -0.05 0.00 -1.21 0.00 0.00 43.02 41.67 1a4s s PHE 148 CO 0.58 -0.49 -0.15 0.00 -1.34 0.00 0.00 175.22 173.82 1a4s s ALA 149 N -2.35 2.51 -0.00 1.99 0.00 -0.62 -0.93 121.76 122.37 1a4s s ALA 149 Ca -0.06 -1.85 -0.05 0.00 0.00 0.00 0.00 51.96 49.99 1a4s s ALA 149 Cb -0.02 -0.12 -0.00 0.00 0.00 0.00 0.00 23.12 22.98 1a4s s ALA 149 CO -0.02 0.14 0.10 1.52 0.00 0.00 0.00 175.76 177.51 1a4s s TYR 150 N -2.72 0.06 -0.07 0.00 1.13 -0.14 -1.12 117.35 114.47 1a4s s TYR 150 Ca 0.28 -0.14 0.01 0.00 -1.41 0.00 0.00 57.07 55.81 1a4s s TYR 150 Cb -0.02 -0.06 -0.03 0.00 -1.10 0.00 0.00 41.96 40.76 1a4s s TYR 150 CO 0.12 -0.23 -0.08 0.95 -2.51 0.00 0.00 175.55 173.80 1a4s s THR 151 N -1.16 3.59 -0.17 -3.49 -4.23 -0.58 -0.36 115.64 109.24 1a4s s THR 151 Ca -0.13 -0.52 -0.11 0.00 -1.18 0.00 0.00 61.69 59.76 1a4s s THR 151 Cb -0.07 -2.47 -0.05 0.00 1.34 0.00 0.00 72.50 71.26 1a4s s THR 151 CO 0.01 0.59 0.18 -0.13 -0.54 0.00 0.00 174.62 174.73 1a4s s ARG 152 N -0.66 4.07 -0.57 3.99 0.52 -0.65 -3.55 118.95 122.10 1a4s s ARG 152 Ca 0.10 -0.10 -0.22 0.00 -0.52 0.00 0.00 55.73 54.98 1a4s s ARG 152 Cb -0.11 -3.38 0.06 0.00 0.52 0.00 0.00 34.95 32.03 1a4s s ARG 152 CO 0.02 0.38 0.87 0.50 0.02 0.00 0.00 175.30 177.08 1a4s s ARG 153 N 0.11 3.21 0.21 3.54 3.52 -1.26 -1.36 118.95 126.92 1a4s s ARG 153 Ca 0.12 -0.60 0.07 0.00 -0.13 0.00 0.00 55.73 55.20 1a4s s ARG 153 Cb -0.12 -4.12 -0.04 0.00 -1.56 0.00 0.00 34.95 29.11 1a4s s ARG 153 CO 0.01 -1.51 0.07 -1.21 -0.81 0.00 0.00 175.30 171.85 1a4s s GLU 154 N 3.63 2.60 1.02 5.12 2.02 0.25 -4.90 118.70 128.44 1a4s s GLU 154 Ca 0.24 -1.10 -0.12 0.00 0.02 0.00 0.00 54.97 54.01 1a4s s GLU 154 Cb -0.16 -2.43 0.20 0.00 0.10 0.00 0.00 34.13 31.85 1a4s s GLU 154 CO 0.15 0.43 1.08 -1.25 0.02 0.00 0.00 175.26 175.69 1a4s s PRO 155 N -3.30 0.25 -0.21 0.39 0.04 -1.25 -0.91 135.00 130.01 1a4s s PRO 155 Ca 0.30 0.69 -0.18 0.00 0.04 0.00 0.00 61.00 61.85 1a4s s PRO 155 Cb -0.09 -1.70 -0.15 0.00 0.04 0.00 0.00 34.50 32.60 1a4s s PRO 155 CO 0.21 -2.90 0.04 1.28 0.04 0.00 0.00 177.00 175.68 1a4s n LEU 156 N -4.32 1.87 0.00 -3.56 4.32 -1.26 -4.67 117.00 109.39 1a4s n LEU 156 Ca 0.05 0.44 0.00 0.00 -0.02 0.00 0.00 56.01 56.48 1a4s n LEU 156 Cb 0.56 -0.92 0.00 0.00 -1.62 0.00 0.00 43.42 41.44 1a4s n LEU 156 CO 0.57 0.18 0.00 0.61 -1.22 0.00 0.00 177.39 177.53 1a4s n GLY 157 N 1.43 0.21 3.58 -0.72 0.00 -1.26 -4.86 105.19 103.57 1a4s n GLY 157 Ca -0.31 -0.63 -0.41 0.00 0.00 0.00 0.00 46.02 44.66 1a4s n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a4s s VAL 158 N 0.00 4.94 -0.14 1.61 1.01 -1.26 -2.08 120.40 124.48 1a4s s VAL 158 Ca 0.00 0.60 -0.09 0.00 0.00 0.00 0.00 61.98 62.49 1a4s s VAL 158 Cb 0.00 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 1a4s s VAL 158 CO 0.00 -0.23 0.17 0.00 0.00 0.00 0.00 175.10 175.03 1a4s s ALA 160 N -0.50 3.24 -0.10 0.00 0.00 0.38 -1.87 121.76 122.91 1a4s s ALA 160 Ca 0.14 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.33 1a4s s ALA 160 Cb -0.12 -1.67 -0.01 0.00 0.00 0.00 0.00 23.12 21.32 1a4s s ALA 160 CO 0.03 0.32 -0.17 0.20 0.00 0.00 0.00 175.76 176.14 1a4s s GLY 161 N -0.03 1.47 -0.26 0.00 0.00 -0.63 -0.21 107.32 107.66 1a4s s GLY 161 Ca 0.04 -0.94 -0.02 0.00 0.00 0.00 0.00 44.72 43.80 1a4s s GLY 161 CO 0.02 -0.37 -0.04 -0.42 0.00 0.00 0.00 173.10 172.28 1a4s s ILE 162 N 0.09 2.92 0.37 0.90 1.01 -0.40 -1.47 121.20 124.62 1a4s s ILE 162 Ca -0.08 -1.13 0.07 0.00 0.00 0.00 0.00 60.65 59.52 1a4s s ILE 162 Cb -0.15 -2.54 -0.02 0.00 0.01 0.00 0.00 42.46 39.76 1a4s s ILE 162 CO 0.05 0.10 0.39 -0.76 0.00 0.00 0.00 174.94 174.73 1a4s s LEU 163 N 1.30 3.63 0.47 2.97 1.43 -1.03 -1.75 118.68 125.71 1a4s s LEU 163 Ca -0.02 -0.48 0.07 0.00 -1.03 0.00 0.00 54.13 52.67 1a4s s LEU 163 Cb -0.18 -2.35 0.01 0.00 0.03 0.00 0.00 46.19 43.70 1a4s s LEU 163 CO -0.03 -0.50 0.42 0.00 0.23 0.00 0.00 176.35 176.47 1a4s s ALA 164 N -2.33 4.22 -2.10 4.21 0.00 -1.26 -3.29 121.76 121.21 1a4s s ALA 164 Ca 0.46 -1.75 0.22 0.00 0.00 0.00 0.00 51.96 50.88 1a4s s ALA 164 Cb -0.07 -0.97 0.02 0.00 0.00 0.00 0.00 23.12 22.11 1a4s s ALA 164 CO 0.29 -0.35 1.08 -2.67 0.00 0.00 0.00 175.76 174.11 1a4s n TRP 165 N -1.67 0.00 0.10 0.00 4.27 -1.26 -4.31 117.44 114.57 1a4s n TRP 165 Ca 0.03 0.00 -0.03 0.00 -3.89 0.00 0.00 57.50 53.62 1a4s n TRP 165 Cb 0.62 0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 30.53 1a4s n TRP 165 CO 0.00 0.00 0.00 -2.95 -2.29 0.00 0.00 177.69 172.45 1a4s h ASN 166 N 2.71 0.00 -2.00 -0.67 -1.07 -1.96 -3.38 115.58 109.20 1a4s h ASN 166 Ca 0.00 0.00 -0.48 0.00 0.07 0.00 0.00 56.30 55.89 1a4s h ASN 166 Cb 0.76 0.00 -0.40 0.00 -2.07 0.00 0.00 38.32 36.61 1a4s h ASN 166 CO 0.00 0.78 -1.19 -1.22 0.07 0.00 0.00 177.43 175.87 1a4s n TYR 167 N -3.32 0.22 -0.02 4.14 4.02 -1.26 -5.04 117.16 115.91 1a4s n TYR 167 Ca 0.01 -3.82 -0.10 0.00 -0.01 0.00 0.00 57.90 53.98 1a4s n TYR 167 Cb 0.84 -0.42 -0.03 0.00 -0.02 0.00 0.00 39.34 39.71 1a4s n TYR 167 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1a4s h PRO 168 N 3.02 -0.33 -0.05 -0.72 0.11 -1.75 0.04 132.00 132.33 1a4s h PRO 168 Ca 0.10 0.02 -0.13 0.00 0.11 0.00 0.00 66.00 66.11 1a4s h PRO 168 Cb 0.96 0.08 0.01 0.00 0.11 0.00 0.00 31.00 32.15 1a4s h PRO 168 CO 0.50 -0.22 -0.46 0.35 -0.21 0.00 0.00 178.00 177.96 1a4s h PHE 169 N -0.34 0.56 -0.22 0.65 3.57 -1.93 -2.89 116.94 116.33 1a4s h PHE 169 Ca 0.11 -0.27 0.01 0.00 3.53 0.00 0.00 57.97 61.36 1a4s h PHE 169 Cb 0.52 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.16 1a4s h PHE 169 CO -0.41 1.05 0.11 1.98 -2.23 0.00 0.00 178.31 178.81 1a4s h MET 170 N -0.09 0.23 -0.30 1.11 4.05 -1.80 -2.62 114.93 115.52 1a4s h MET 170 Ca -0.04 -0.01 -0.10 0.00 -0.28 0.00 0.00 59.70 59.26 1a4s h MET 170 Cb 1.14 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.87 1a4s h MET 170 CO 0.09 0.15 -0.25 0.97 0.23 0.00 0.00 176.91 178.11 1a4s h ILE 171 N 0.23 1.27 -0.90 1.77 2.10 -1.09 0.78 117.51 121.68 1a4s h ILE 171 Ca 0.09 -1.30 0.03 0.00 1.08 0.00 0.00 64.86 64.76 1a4s h ILE 171 Cb 0.02 1.31 -0.05 0.00 -1.09 0.00 0.00 36.82 37.01 1a4s h ILE 171 CO -0.06 0.42 0.58 0.00 -1.08 0.00 0.00 178.15 178.01 1a4s h ALA 172 N 1.22 1.18 -0.03 0.18 0.00 -1.41 -2.38 119.26 118.03 1a4s h ALA 172 Ca 0.07 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1a4s h ALA 172 Cb 0.70 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1a4s h ALA 172 CO 0.05 0.44 0.00 0.00 0.00 0.00 0.00 179.25 179.74 1a4s h ALA 173 N 1.37 0.04 -0.61 0.00 0.00 -1.20 0.39 119.26 119.25 1a4s h ALA 173 Ca 0.36 -0.14 0.18 0.00 0.00 0.00 0.00 54.91 55.30 1a4s h ALA 173 Cb 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1a4s h ALA 173 CO -0.12 -0.33 0.44 -1.49 0.00 0.00 0.00 179.25 177.76 1a4s h TRP 174 N -0.21 0.00 0.02 0.00 4.06 -0.56 0.40 115.95 119.65 1a4s h TRP 174 Ca 0.01 0.00 -0.32 0.00 2.06 0.00 0.00 58.89 60.64 1a4s h TRP 174 Cb 0.27 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.38 1a4s h TRP 174 CO 0.02 0.00 -1.90 1.63 -3.56 0.00 0.00 178.44 174.63 1a4s n LYS 175 N -4.33 0.66 -0.14 0.49 5.02 -0.92 -4.37 118.16 114.58 1a4s n LYS 175 Ca 0.12 0.23 -0.10 0.00 -2.02 0.00 0.00 58.31 56.54 1a4s n LYS 175 Cb 0.69 -1.72 0.03 0.00 -0.02 0.00 0.00 35.03 34.00 1a4s n LYS 175 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1a4s h ALA 177 N 0.94 -0.88 -0.41 0.00 0.00 -1.13 -0.41 119.26 117.37 1a4s h ALA 177 Ca 0.11 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1a4s h ALA 177 Cb 0.77 0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1a4s h ALA 177 CO 0.06 -0.89 0.16 -1.00 0.00 0.00 0.00 179.25 177.58 1a4s h PRO 178 N -1.09 0.57 -0.19 0.00 0.13 -1.78 -0.83 132.00 128.81 1a4s h PRO 178 Ca -0.09 -0.07 -0.02 0.00 -0.87 0.00 0.00 66.00 64.94 1a4s h PRO 178 Cb 0.72 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 31.73 1a4s h PRO 178 CO 0.15 0.48 0.03 0.00 -0.23 0.00 0.00 178.00 178.43 1a4s h ALA 179 N 1.61 0.25 -0.27 -0.56 0.00 -1.48 -2.22 119.26 116.59 1a4s h ALA 179 Ca 0.14 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1a4s h ALA 179 Cb 0.12 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1a4s h ALA 179 CO -0.01 -0.08 -0.09 -0.07 0.00 0.00 0.00 179.25 178.99 1a4s h LEU 180 N 0.11 0.55 -0.78 0.00 4.07 -0.81 -0.60 115.31 117.86 1a4s h LEU 180 Ca 0.06 -0.38 0.12 0.00 0.08 0.00 0.00 57.88 57.76 1a4s h LEU 180 Cb 0.30 -0.15 -0.09 0.00 1.08 0.00 0.00 40.66 41.81 1a4s h LEU 180 CO 0.00 0.81 0.38 0.00 -1.08 0.00 0.00 178.44 178.55 1a4s h ALA 181 N 0.76 1.12 0.00 1.53 0.00 -1.08 -0.93 119.26 120.65 1a4s h ALA 181 Ca 0.07 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1a4s h ALA 181 Cb 0.58 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1a4s h ALA 181 CO 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 179.25 179.19 1a4s n GLY 183 N 0.74 0.87 3.93 0.00 0.00 -0.35 -3.80 105.19 106.58 1a4s n GLY 183 Ca 0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.95 1a4s n GLY 183 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1a4s s ASN 184 N -2.20 4.85 0.24 1.61 0.01 -0.25 -3.93 114.94 115.28 1a4s s ASN 184 Ca 0.00 0.47 0.07 0.00 -0.71 0.00 0.00 52.86 52.68 1a4s s ASN 184 Cb 0.00 -1.13 -0.04 0.00 0.41 0.00 0.00 41.25 40.49 1a4s s ASN 184 CO 0.00 -1.58 0.19 0.00 -1.51 0.00 0.00 177.10 174.20 1a4s s ALA 185 N -3.24 3.59 -0.01 0.60 0.00 -0.88 -4.37 121.76 117.45 1a4s s ALA 185 Ca 0.60 -1.38 0.01 0.00 0.00 0.00 0.00 51.96 51.19 1a4s s ALA 185 Cb -0.11 -1.32 0.00 0.00 0.00 0.00 0.00 23.12 21.70 1a4s s ALA 185 CO 0.45 0.29 -0.04 0.08 0.00 0.00 0.00 175.76 176.54 1a4s s VAL 186 N -2.07 0.31 -0.19 0.00 1.01 0.44 -1.49 120.40 118.41 1a4s s VAL 186 Ca 0.33 -0.14 0.01 0.00 0.00 0.00 0.00 61.98 62.18 1a4s s VAL 186 Cb -0.08 -0.29 0.03 0.00 0.00 0.00 0.00 36.38 36.04 1a4s s VAL 186 CO 0.25 0.10 -0.15 -0.69 0.00 0.00 0.00 175.10 174.61 1a4s s VAL 187 N 0.09 1.86 0.22 2.92 1.01 -0.78 -0.85 120.40 124.86 1a4s s VAL 187 Ca -0.01 -0.97 0.10 0.00 0.00 0.00 0.00 61.98 61.10 1a4s s VAL 187 Cb -0.04 -1.79 -0.05 0.00 0.00 0.00 0.00 36.38 34.51 1a4s s VAL 187 CO -0.00 0.36 -0.18 0.72 0.00 0.00 0.00 175.10 176.00 1a4s s PHE 188 N 1.34 1.96 -0.31 5.22 -0.12 -0.30 -1.60 117.98 124.17 1a4s s PHE 188 Ca 0.02 -0.46 0.01 0.00 -0.05 0.00 0.00 56.93 56.45 1a4s s PHE 188 Cb -0.15 -0.90 0.09 0.00 -0.63 0.00 0.00 43.02 41.44 1a4s s PHE 188 CO -0.10 0.48 0.07 0.21 -0.05 0.00 0.00 175.22 175.83 1a4s s LYS 189 N -3.38 1.03 0.92 1.99 2.20 -0.54 -1.45 119.74 120.50 1a4s s LYS 189 Ca 0.24 -1.29 -0.11 0.00 -0.36 0.00 0.00 55.97 54.45 1a4s s LYS 189 Cb -0.04 -2.42 0.13 0.00 -1.51 0.00 0.00 37.83 34.00 1a4s s LYS 189 CO 0.10 -0.92 1.04 -2.30 -0.36 0.00 0.00 175.35 172.90 1a4s n PRO 190 N 4.66 -0.41 -1.66 4.03 -0.02 -1.26 -2.46 135.00 137.88 1a4s n PRO 190 Ca -0.01 -0.06 -0.42 0.00 -2.02 0.00 0.00 63.50 60.98 1a4s n PRO 190 Cb 0.42 -2.30 -0.00 0.00 -0.02 0.00 0.00 33.50 31.60 1a4s n PRO 190 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1a4s n SER 191 N -3.78 2.19 0.07 2.55 2.88 -1.21 -4.54 113.62 111.77 1a4s n SER 191 Ca 0.11 1.16 0.09 0.00 -1.33 0.00 0.00 58.87 58.90 1a4s n SER 191 Cb 0.52 -1.43 0.39 0.00 -0.75 0.00 0.00 64.21 62.95 1a4s n SER 191 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1a4s n PRO 192 N 0.44 0.10 0.15 -1.46 -0.04 -1.26 -1.64 135.00 131.29 1a4s n PRO 192 Ca 0.07 0.37 0.05 0.00 -0.04 0.00 0.00 63.50 63.95 1a4s n PRO 192 Cb 0.36 -1.70 0.05 0.00 -0.04 0.00 0.00 33.50 32.17 1a4s n PRO 192 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 1a4s h MET 193 N 0.00 0.00 -2.07 0.54 2.86 -1.91 -3.39 114.93 110.95 1a4s h MET 193 Ca 0.00 0.00 -0.55 0.00 -2.06 0.00 0.00 59.70 57.09 1a4s h MET 193 Cb 0.27 0.00 -0.40 0.00 0.06 0.00 0.00 31.60 31.53 1a4s h MET 193 CO 0.00 0.30 -0.97 0.25 1.06 0.00 0.00 176.91 177.55 1a4s n THR 194 N -3.11 0.54 0.79 2.22 -2.24 -0.65 -4.60 114.28 107.23 1a4s n THR 194 Ca 0.01 -4.61 0.12 0.00 -2.27 0.00 0.00 64.05 57.30 1a4s n THR 194 Cb 0.68 -1.46 0.27 0.00 -2.10 0.00 0.00 70.33 67.71 1a4s n THR 194 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1a4s n PRO 195 N 0.78 0.14 -0.00 -0.78 -0.04 -1.20 -4.54 135.00 129.37 1a4s n PRO 195 Ca 0.25 0.05 -0.19 0.00 -0.04 0.00 0.00 63.50 63.58 1a4s n PRO 195 Cb 0.52 -1.60 -0.14 0.00 -0.04 0.00 0.00 33.50 32.24 1a4s n PRO 195 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1a4s n VAL 196 N -1.81 1.74 0.20 0.52 0.24 -1.26 -4.13 118.33 113.83 1a4s n VAL 196 Ca 0.05 -0.69 0.08 0.00 -2.04 0.00 0.00 64.34 61.74 1a4s n VAL 196 Cb 0.39 -1.58 0.32 0.00 -1.47 0.00 0.00 33.84 31.50 1a4s n VAL 196 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 1a4s h THR 197 N 0.06 0.61 -0.99 3.34 1.35 -1.93 -3.00 112.91 112.35 1a4s h THR 197 Ca -0.40 -1.41 0.08 0.00 -0.55 0.00 0.00 66.41 64.14 1a4s h THR 197 Cb 2.03 1.96 -0.07 0.00 -1.73 0.00 0.00 68.15 70.34 1a4s h THR 197 CO 0.09 0.28 0.64 1.23 -0.25 0.00 0.00 175.52 177.50 1a4s h GLY 198 N 2.56 1.53 2.00 5.82 0.00 -1.84 -1.86 103.07 111.28 1a4s h GLY 198 Ca -0.00 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 46.87 1a4s h GLY 198 CO 0.04 0.28 0.00 -0.24 0.00 0.00 0.00 176.54 176.62 1a4s h VAL 199 N 1.11 0.00 -0.21 4.60 3.04 -1.71 -2.71 116.25 120.37 1a4s h VAL 199 Ca 0.45 -0.62 -0.02 0.00 -1.01 0.00 0.00 66.70 65.50 1a4s h VAL 199 Cb 0.27 1.58 -0.01 0.00 -2.01 0.00 0.00 31.29 31.12 1a4s h VAL 199 CO -0.19 0.00 0.06 0.40 -1.01 0.00 0.00 177.57 176.83 1a4s h ILE 200 N 0.00 1.19 -0.43 3.17 1.08 -1.47 -0.14 117.51 120.91 1a4s h ILE 200 Ca 0.00 -0.62 0.07 0.00 -0.39 0.00 0.00 64.86 63.92 1a4s h ILE 200 Cb 0.68 1.21 -0.06 0.00 -3.07 0.00 0.00 36.82 35.58 1a4s h ILE 200 CO 0.00 0.19 0.09 0.25 -0.69 0.00 0.00 178.15 177.99 1a4s h LEU 201 N 0.16 0.01 -0.96 1.44 5.85 -1.25 -0.06 115.31 120.50 1a4s h LEU 201 Ca 0.07 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.79 1a4s h LEU 201 Cb 0.24 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 1a4s h LEU 201 CO -0.00 0.04 0.01 0.00 -0.34 0.00 0.00 178.44 178.14 1a4s h ALA 202 N 1.33 1.14 -0.66 1.25 0.00 -1.16 -1.74 119.26 119.43 1a4s h ALA 202 Ca 0.21 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1a4s h ALA 202 Cb 0.26 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1a4s h ALA 202 CO -0.28 0.55 0.22 0.93 0.00 0.00 0.00 179.25 180.68 1a4s h GLU 203 N 0.71 1.01 -0.48 0.00 5.08 -0.57 -3.06 114.58 117.28 1a4s h GLU 203 Ca 0.14 -0.21 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 1a4s h GLU 203 Cb 0.42 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1a4s h GLU 203 CO 0.02 0.87 0.11 0.82 -1.00 0.00 0.00 179.01 179.83 1a4s h ILE 204 N 0.94 1.21 -0.86 3.13 2.04 -0.54 -0.66 117.51 122.76 1a4s h ILE 204 Ca 0.21 -0.76 -0.01 0.00 1.00 0.00 0.00 64.86 65.30 1a4s h ILE 204 Cb 0.27 0.73 -0.04 0.00 -0.74 0.00 0.00 36.82 37.04 1a4s h ILE 204 CO -0.01 0.28 0.48 -0.26 0.00 0.00 0.00 178.15 178.64 1a4s h PHE 205 N 0.70 1.18 -0.64 1.37 0.04 -1.26 -0.46 116.94 117.87 1a4s h PHE 205 Ca 0.16 -0.02 -0.09 0.00 2.80 0.00 0.00 57.97 60.81 1a4s h PHE 205 Cb 0.27 -0.38 -0.02 0.00 2.20 0.00 0.00 35.95 38.02 1a4s h PHE 205 CO 0.01 0.81 0.04 0.45 -0.60 0.00 0.00 178.31 179.02 1a4s h HIS 206 N 1.21 1.19 -0.81 -0.55 3.86 -1.31 -2.36 115.15 116.37 1a4s h HIS 206 Ca 0.31 -0.19 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 1a4s h HIS 206 Cb 0.01 -0.32 -0.04 0.00 1.06 0.00 0.00 27.41 28.13 1a4s h HIS 206 CO 0.01 1.02 0.51 0.93 0.86 0.00 0.00 177.93 181.26 1a4s h GLU 207 N 1.01 1.09 0.00 2.45 5.08 -0.55 -1.53 114.58 122.12 1a4s h GLU 207 Ca 0.19 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 1a4s h GLU 207 Cb 0.52 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1a4s h GLU 207 CO 0.02 0.74 0.00 0.00 -1.00 0.00 0.00 179.01 178.78 1a4s h ALA 208 N 1.45 1.00 0.00 3.43 0.00 -0.73 -3.47 119.26 120.94 1a4s h ALA 208 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.20 1a4s h ALA 208 Cb -0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1a4s h ALA 208 CO -0.06 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.60 1a4s n GLY 209 N 0.13 1.66 3.77 0.00 0.00 -0.58 -4.73 105.19 105.44 1a4s n GLY 209 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.64 1a4s n GLY 209 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a4s s VAL 210 N -2.00 2.72 0.05 1.61 0.11 -0.96 -4.91 120.40 117.02 1a4s s VAL 210 Ca 0.00 0.65 -0.37 0.00 -2.93 0.00 0.00 61.98 59.34 1a4s s VAL 210 Cb 0.00 -3.38 -0.16 0.00 -1.53 0.00 0.00 36.38 31.31 1a4s s VAL 210 CO 0.00 0.10 1.45 -2.65 -3.33 0.00 0.00 175.10 170.66 1a4s n PRO 211 N 0.21 1.34 -1.64 1.54 -0.02 -1.26 -4.78 135.00 130.39 1a4s n PRO 211 Ca 0.03 0.49 -0.55 0.00 -2.02 0.00 0.00 63.50 61.44 1a4s n PRO 211 Cb 0.44 -2.16 -0.07 0.00 -0.02 0.00 0.00 33.50 31.69 1a4s n PRO 211 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1a4s n VAL 212 N 3.01 0.12 -0.52 -1.45 0.31 -1.26 -1.47 118.33 117.06 1a4s n VAL 212 Ca 0.19 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.50 1a4s n VAL 212 Cb 0.20 -0.90 0.00 0.00 -0.91 0.00 0.00 33.84 32.23 1a4s n VAL 212 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1a4s n GLY 213 N 3.16 0.74 0.23 2.92 0.00 -1.26 -4.31 105.19 106.68 1a4s n GLY 213 Ca 0.22 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.15 1a4s n GLY 213 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1a4s h LEU 214 N 0.00 0.72 -8.14 0.99 5.85 -1.53 -3.20 115.31 110.00 1a4s h LEU 214 Ca 0.00 -0.27 -0.67 0.00 0.84 0.00 0.00 57.88 57.78 1a4s h LEU 214 Cb 0.00 -0.19 -0.32 0.00 0.37 0.00 0.00 40.66 40.51 1a4s h LEU 214 CO 0.00 0.80 -0.78 -0.69 -0.34 0.00 0.00 178.44 177.43 1a4s s VAL 215 N -5.17 2.67 0.18 1.05 1.01 -1.26 -0.42 120.40 118.46 1a4s s VAL 215 Ca -0.13 -0.95 0.11 0.00 0.00 0.00 0.00 61.98 61.01 1a4s s VAL 215 Cb 0.11 -2.28 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 1a4s s VAL 215 CO 0.79 0.32 -0.24 0.20 0.00 0.00 0.00 175.10 176.17 1a4s s ASN 216 N 1.32 3.41 -0.10 3.32 0.01 -0.03 -4.86 114.94 118.02 1a4s s ASN 216 Ca 0.02 -0.85 0.01 0.00 -0.71 0.00 0.00 52.86 51.33 1a4s s ASN 216 Cb -0.15 -0.25 0.02 0.00 0.41 0.00 0.00 41.25 41.28 1a4s s ASN 216 CO -0.07 0.13 -0.11 -0.69 -1.51 0.00 0.00 177.10 174.85 1a4s s VAL 217 N -1.60 1.18 -0.10 1.60 1.01 0.16 -1.15 120.40 121.50 1a4s s VAL 217 Ca 0.20 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 61.78 1a4s s VAL 217 Cb -0.08 -1.12 0.00 0.00 0.00 0.00 0.00 36.38 35.18 1a4s s VAL 217 CO 0.09 0.38 -0.22 0.68 0.00 0.00 0.00 175.10 176.03 1a4s s VAL 218 N 1.19 1.94 0.32 2.92 -7.23 -0.53 -1.53 120.40 117.49 1a4s s VAL 218 Ca -0.04 -0.94 0.00 0.00 -1.81 0.00 0.00 61.98 59.19 1a4s s VAL 218 Cb -0.14 -1.69 -0.03 0.00 0.56 0.00 0.00 36.38 35.07 1a4s s VAL 218 CO -0.03 0.53 0.52 -1.10 -0.31 0.00 0.00 175.10 174.72 1a4s s GLN 219 N 0.45 3.50 0.00 4.82 -1.52 -1.26 -3.92 119.66 121.73 1a4s s GLN 219 Ca -0.17 -0.33 0.00 0.00 -1.95 0.00 0.00 55.36 52.91 1a4s s GLN 219 Cb -0.17 -2.69 0.00 0.00 -0.22 0.00 0.00 33.01 29.93 1a4s s GLN 219 CO 0.07 0.19 0.00 0.41 -0.25 0.00 0.00 175.29 175.71 1a4s n GLY 220 N -1.60 -0.05 0.00 3.09 0.00 -1.26 -1.04 105.19 104.33 1a4s n GLY 220 Ca -0.05 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.26 1a4s n GLY 220 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a4s n GLY 221 N -0.87 3.32 0.19 -0.02 0.00 -1.26 -4.11 105.19 102.44 1a4s n GLY 221 Ca 0.00 -1.69 -0.06 0.00 0.00 0.00 0.00 46.02 44.27 1a4s n GLY 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4s h ALA 222 N -0.14 0.56 -0.97 4.61 0.00 -2.01 -1.13 119.26 120.18 1a4s h ALA 222 Ca 0.00 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.93 1a4s h ALA 222 Cb 0.00 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 1a4s h ALA 222 CO 0.00 -0.08 0.64 1.49 0.00 0.00 0.00 179.25 181.30 1a4s h GLU 223 N 0.50 1.25 -0.47 0.00 4.81 -1.96 0.15 114.58 118.86 1a4s h GLU 223 Ca 0.18 -0.07 -0.13 0.00 -0.13 0.00 0.00 59.36 59.21 1a4s h GLU 223 Cb 0.04 -0.28 -0.01 0.00 0.63 0.00 0.00 28.75 29.12 1a4s h GLU 223 CO -0.09 0.82 -0.21 1.15 -0.73 0.00 0.00 179.01 179.95 1a4s h THR 224 N 1.28 1.27 -0.64 0.32 2.02 -1.60 -1.90 112.91 113.67 1a4s h THR 224 Ca 0.36 -1.37 -0.02 0.00 0.77 0.00 0.00 66.41 66.15 1a4s h THR 224 Cb -0.11 1.16 -0.03 0.00 -1.74 0.00 0.00 68.15 67.43 1a4s h THR 224 CO -0.09 0.47 0.32 1.23 0.37 0.00 0.00 175.52 177.82 1a4s h GLY 225 N 0.81 0.95 1.00 2.16 0.00 -0.68 -2.85 103.07 104.46 1a4s h GLY 225 Ca 0.11 -0.44 -0.12 0.00 0.00 0.00 0.00 47.33 46.88 1a4s h GLY 225 CO 0.07 0.42 -0.25 1.76 0.00 0.00 0.00 176.54 178.53 1a4s h SER 226 N 0.89 0.81 -0.85 0.19 0.02 -0.48 -2.40 113.55 111.73 1a4s h SER 226 Ca 0.22 -0.44 0.06 0.00 -0.84 0.00 0.00 61.79 60.79 1a4s h SER 226 Cb 0.07 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 62.33 1a4s h SER 226 CO -0.03 1.08 0.56 -0.07 -1.14 0.00 0.00 176.83 177.23 1a4s h LEU 227 N 0.55 0.86 -0.35 5.07 3.38 -1.13 -0.62 115.31 123.08 1a4s h LEU 227 Ca 0.07 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1a4s h LEU 227 Cb 0.82 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1a4s h LEU 227 CO 0.07 0.56 0.11 -0.07 0.09 0.00 0.00 178.44 179.20 1a4s h LEU 228 N 0.98 0.50 -1.68 1.67 3.38 -1.38 -1.04 115.31 117.75 1a4s h LEU 228 Ca 0.36 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1a4s h LEU 228 Cb 0.17 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1a4s h LEU 228 CO -0.13 0.57 0.09 0.00 0.09 0.00 0.00 178.44 179.06 1a4s n HIS 230 N -4.45 0.22 -1.86 0.00 8.25 -0.35 -4.24 115.22 112.80 1a4s n HIS 230 Ca 0.00 0.07 -0.42 0.00 -0.26 0.00 0.00 57.72 57.11 1a4s n HIS 230 Cb 0.12 -0.39 -0.03 0.00 1.12 0.00 0.00 29.99 30.81 1a4s n HIS 230 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1a4s s HIS 231 N -3.17 2.97 0.18 4.41 5.04 -0.40 -4.90 115.29 119.41 1a4s s HIS 231 Ca 0.04 0.51 0.35 0.00 -1.54 0.00 0.00 55.06 54.43 1a4s s HIS 231 Cb 0.15 -4.00 1.57 0.00 0.04 0.00 0.00 32.58 30.34 1a4s s HIS 231 CO 0.80 -3.75 2.05 -1.00 -2.34 0.00 0.00 174.74 170.49 1a4s h PRO 232 N 6.90 0.00 -0.31 2.88 0.13 -1.90 -2.96 132.00 136.74 1a4s h PRO 232 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1a4s h PRO 232 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1a4s h PRO 232 CO 0.93 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.79 1a4s n ASN 233 N -3.01 3.97 -4.68 1.44 5.03 -1.26 -4.90 115.26 111.85 1a4s n ASN 233 Ca -0.00 -2.88 -0.37 0.00 0.87 0.00 0.00 54.58 52.19 1a4s n ASN 233 Cb 0.24 -0.52 -0.08 0.00 -1.02 0.00 0.00 39.78 38.40 1a4s n ASN 233 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1a4s s VAL 234 N -2.60 5.26 -0.08 2.41 1.01 -1.12 -4.48 120.40 120.80 1a4s s VAL 234 Ca 0.41 0.55 0.14 0.00 0.00 0.00 0.00 61.98 63.08 1a4s s VAL 234 Cb 0.32 -3.65 -0.08 0.00 0.00 0.00 0.00 36.38 32.97 1a4s s VAL 234 CO 0.11 0.31 1.16 0.00 0.00 0.00 0.00 175.10 176.67 1a4s h ALA 235 N 7.21 0.61 -2.55 5.51 0.00 -1.37 -3.48 119.26 125.19 1a4s h ALA 235 Ca -0.38 -0.75 -0.11 0.00 0.00 0.00 0.00 54.91 53.67 1a4s h ALA 235 Cb 1.16 0.06 -0.22 0.00 0.00 0.00 0.00 17.79 18.80 1a4s h ALA 235 CO 0.72 0.92 -0.20 0.21 0.00 0.00 0.00 179.25 180.90 1a4s s LYS 236 N -2.87 0.63 -0.07 0.00 2.20 -1.23 -2.47 119.74 115.94 1a4s s LYS 236 Ca 0.01 0.22 0.05 0.00 -0.36 0.00 0.00 55.97 55.89 1a4s s LYS 236 Cb 0.08 0.29 -0.01 0.00 -1.51 0.00 0.00 37.83 36.69 1a4s s LYS 236 CO 0.79 -0.14 -0.23 0.08 -0.36 0.00 0.00 175.35 175.49 1a4s s VAL 237 N -0.60 2.24 -0.18 4.02 1.01 -0.01 -0.47 120.40 126.42 1a4s s VAL 237 Ca -0.07 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 60.92 1a4s s VAL 237 Cb -0.04 -1.83 0.01 0.00 0.00 0.00 0.00 36.38 34.52 1a4s s VAL 237 CO 0.03 0.57 -0.17 -0.55 0.00 0.00 0.00 175.10 174.98 1a4s s SER 238 N -0.12 3.39 -0.02 3.32 0.15 0.71 -2.23 113.70 118.90 1a4s s SER 238 Ca -0.04 -0.58 0.05 0.00 0.70 0.00 0.00 55.95 56.08 1a4s s SER 238 Cb -0.14 -1.53 -0.03 0.00 -1.71 0.00 0.00 66.02 62.61 1a4s s SER 238 CO 0.04 0.02 -0.16 0.12 1.20 0.00 0.00 173.24 174.46 1a4s s PHE 239 N 1.18 2.64 -0.04 3.44 5.36 -0.63 -1.28 117.98 128.65 1a4s s PHE 239 Ca 0.02 -0.20 0.04 0.00 -0.96 0.00 0.00 56.93 55.82 1a4s s PHE 239 Cb -0.14 -1.57 -0.00 0.00 -0.34 0.00 0.00 43.02 40.97 1a4s s PHE 239 CO -0.08 0.20 -0.15 0.99 -1.46 0.00 0.00 175.22 174.72 1a4s s THR 240 N -0.79 1.27 -5.00 0.12 2.01 -0.72 -1.76 115.64 110.77 1a4s s THR 240 Ca 0.13 -0.63 0.00 0.00 0.31 0.00 0.00 61.69 61.50 1a4s s THR 240 Cb -0.11 -1.10 0.00 0.00 0.01 0.00 0.00 72.50 71.31 1a4s s THR 240 CO 0.02 0.37 0.00 0.61 -0.69 0.00 0.00 174.62 174.93 1a4s n GLY 241 N 3.19 -0.14 3.86 4.40 0.00 -0.99 -4.33 105.19 111.19 1a4s n GLY 241 Ca -0.18 -1.22 -0.30 0.00 0.00 0.00 0.00 46.02 44.32 1a4s n GLY 241 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1a4s s SER 242 N -4.00 5.07 0.04 1.61 1.04 -1.26 -3.33 113.70 112.87 1a4s s SER 242 Ca 0.00 1.15 -0.25 0.00 0.48 0.00 0.00 55.95 57.33 1a4s s SER 242 Cb 0.00 -1.90 -0.17 0.00 0.10 0.00 0.00 66.02 64.04 1a4s s SER 242 CO 0.00 -1.59 1.50 0.58 0.98 0.00 0.00 173.24 174.71 1a4s h VAL 243 N -0.82 0.92 -0.97 5.02 2.07 -1.95 0.68 116.25 121.20 1a4s h VAL 243 Ca -0.46 -0.40 0.01 0.00 0.82 0.00 0.00 66.70 66.67 1a4s h VAL 243 Cb 1.26 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 32.15 1a4s h VAL 243 CO 0.63 0.09 0.63 -0.65 0.02 0.00 0.00 177.57 178.29 1a4s h PRO 244 N -0.41 1.28 -0.03 1.57 0.11 -1.98 -0.24 132.00 132.31 1a4s h PRO 244 Ca -0.02 -0.08 -0.22 0.00 0.11 0.00 0.00 66.00 65.78 1a4s h PRO 244 Cb 0.32 -0.29 0.00 0.00 0.11 0.00 0.00 31.00 31.15 1a4s h PRO 244 CO 0.04 0.86 -0.90 1.15 -0.21 0.00 0.00 178.00 178.94 1a4s h THR 245 N 1.32 1.38 -0.84 -1.15 2.02 -1.86 -2.93 112.91 110.85 1a4s h THR 245 Ca 0.35 -2.33 0.08 0.00 0.77 0.00 0.00 66.41 65.28 1a4s h THR 245 Cb -0.14 2.32 -0.07 0.00 -1.74 0.00 0.00 68.15 68.53 1a4s h THR 245 CO -0.07 0.70 0.50 1.23 0.37 0.00 0.00 175.52 178.25 1a4s h GLY 246 N 1.13 1.28 0.99 2.16 0.00 0.18 -1.14 103.07 107.66 1a4s h GLY 246 Ca -0.07 -0.35 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 1a4s h GLY 246 CO 0.16 0.20 0.23 0.50 0.00 0.00 0.00 176.54 177.63 1a4s h LYS 247 N 0.88 0.50 -0.65 4.80 1.57 -1.01 -1.18 116.57 121.49 1a4s h LYS 247 Ca 0.38 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 59.09 1a4s h LYS 247 Cb 0.26 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 1a4s h LYS 247 CO -0.21 0.36 0.26 0.87 -0.57 0.00 0.00 179.45 180.17 1a4s h LYS 248 N 0.49 0.96 -0.40 3.15 1.79 -1.16 -2.32 116.57 119.09 1a4s h LYS 248 Ca 0.13 -0.17 0.07 0.00 -2.18 0.00 0.00 60.65 58.50 1a4s h LYS 248 Cb -0.01 -0.16 -0.06 0.00 -1.58 0.00 0.00 32.23 30.42 1a4s h LYS 248 CO -0.03 0.81 0.06 0.28 -1.08 0.00 0.00 179.45 179.49 1a4s h VAL 249 N 0.91 0.77 -0.30 0.50 2.07 -0.77 0.14 116.25 119.56 1a4s h VAL 249 Ca 0.22 -0.06 0.03 0.00 0.82 0.00 0.00 66.70 67.71 1a4s h VAL 249 Cb 0.20 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 1a4s h VAL 249 CO -0.02 0.03 0.11 -0.03 0.02 0.00 0.00 177.57 177.68 1a4s h MET 250 N 0.18 0.24 -0.18 1.57 1.85 -0.94 -0.60 114.93 117.05 1a4s h MET 250 Ca 0.19 -0.01 0.03 0.00 -0.61 0.00 0.00 59.70 59.30 1a4s h MET 250 Cb 0.25 -0.05 -0.03 0.00 0.43 0.00 0.00 31.60 32.19 1a4s h MET 250 CO -0.27 0.16 -0.02 0.93 -0.40 0.00 0.00 176.91 177.31 1a4s h GLU 251 N 0.25 0.03 -0.38 0.39 5.08 -0.97 -1.47 114.58 117.51 1a4s h GLU 251 Ca 0.13 -0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 1a4s h GLU 251 Cb 0.10 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1a4s h GLU 251 CO -0.13 0.02 -0.02 0.52 -1.00 0.00 0.00 179.01 178.40 1a4s h MET 252 N 0.04 0.60 0.00 2.33 2.86 -0.60 -2.40 114.93 117.76 1a4s h MET 252 Ca 0.08 -0.15 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1a4s h MET 252 Cb 0.11 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.69 1a4s h MET 252 CO -0.16 0.64 -0.07 0.77 1.06 0.00 0.00 176.91 179.15 1a4s h SER 253 N 0.57 0.00 0.36 1.22 0.02 -0.49 -2.87 113.55 112.35 1a4s h SER 253 Ca 0.12 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.00 1a4s h SER 253 Cb 0.39 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.92 1a4s h SER 253 CO 0.02 0.07 -0.31 0.00 -1.14 0.00 0.00 176.83 175.47 1a4s h ALA 254 N 1.93 1.42 0.00 3.77 0.00 -0.75 -2.57 119.26 123.06 1a4s h ALA 254 Ca -0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1a4s h ALA 254 Cb 0.48 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1a4s h ALA 254 CO 0.01 0.38 -0.06 0.87 0.00 0.00 0.00 179.25 180.45 1a4s h LYS 255 N 0.00 0.00 -0.10 0.00 1.57 -1.63 -0.81 116.57 115.60 1a4s h LYS 255 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1a4s h LYS 255 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1a4s h LYS 255 CO 0.04 0.06 0.00 2.41 -0.57 0.00 0.00 179.45 181.39 1a4s n THR 256 N -4.38 1.98 -3.99 -0.16 -1.04 -1.14 -5.00 114.28 100.54 1a4s n THR 256 Ca -0.03 -2.07 -0.32 0.00 -2.04 0.00 0.00 64.05 59.60 1a4s n THR 256 Cb 0.14 -0.20 0.01 0.00 -1.82 0.00 0.00 70.33 68.46 1a4s n THR 256 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1a4s n VAL 257 N -1.05 -1.84 -2.09 12.58 0.31 -0.31 -4.94 118.33 120.99 1a4s n VAL 257 Ca 0.17 -0.03 -0.35 0.00 -0.01 0.00 0.00 64.34 64.12 1a4s n VAL 257 Cb 0.71 -2.55 0.02 0.00 -0.91 0.00 0.00 33.84 31.11 1a4s n VAL 257 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1a4s s LYS 258 N -6.69 3.14 0.22 5.55 1.02 -0.99 -5.02 119.74 116.97 1a4s s LYS 258 Ca 0.66 1.62 -0.30 0.00 0.02 0.00 0.00 55.97 57.96 1a4s s LYS 258 Cb -0.34 -1.97 -0.10 0.00 -0.52 0.00 0.00 37.83 34.90 1a4s s LYS 258 CO 0.86 -1.03 1.41 -1.01 -0.92 0.00 0.00 175.35 174.66 1a4s s HIS 259 N -1.85 3.11 -0.03 3.18 3.76 -1.03 -4.88 115.29 117.55 1a4s s HIS 259 Ca 0.73 1.04 0.02 0.00 -0.15 0.00 0.00 55.06 56.70 1a4s s HIS 259 Cb -0.25 -3.76 0.00 0.00 1.11 0.00 0.00 32.58 29.69 1a4s s HIS 259 CO 0.31 -2.49 -0.08 0.08 -0.85 0.00 0.00 174.74 171.72 1a4s s VAL 260 N 0.21 0.71 0.01 -0.90 1.01 -1.26 -0.83 120.40 119.35 1a4s s VAL 260 Ca 0.60 -0.32 0.05 0.00 0.00 0.00 0.00 61.98 62.31 1a4s s VAL 260 Cb -0.40 -0.64 -0.02 0.00 0.00 0.00 0.00 36.38 35.32 1a4s s VAL 260 CO 0.40 0.23 -0.16 0.42 0.00 0.00 0.00 175.10 175.99 1a4s s THR 261 N 0.24 1.25 -0.07 3.92 -4.23 -0.95 -4.88 115.64 110.92 1a4s s THR 261 Ca -0.04 -0.82 0.01 0.00 -1.18 0.00 0.00 61.69 59.66 1a4s s THR 261 Cb -0.09 -1.07 0.02 0.00 1.34 0.00 0.00 72.50 72.70 1a4s s THR 261 CO 0.00 0.24 -0.08 -0.76 -0.54 0.00 0.00 174.62 173.48 1a4s s LEU 262 N -0.68 1.36 -0.36 4.79 1.43 -0.32 -1.61 118.68 123.29 1a4s s LEU 262 Ca 0.05 -0.22 0.04 0.00 -1.03 0.00 0.00 54.13 52.97 1a4s s LEU 262 Cb -0.07 -0.67 0.10 0.00 0.03 0.00 0.00 46.19 45.59 1a4s s LEU 262 CO 0.00 -0.04 0.08 -1.61 0.23 0.00 0.00 176.35 175.01 1a4s s GLU 263 N 1.06 1.53 0.00 1.70 0.41 -0.72 -1.10 118.70 121.58 1a4s s GLU 263 Ca -0.08 -1.96 0.00 0.00 -0.41 0.00 0.00 54.97 52.52 1a4s s GLU 263 Cb -0.14 -3.19 0.00 0.00 -1.78 0.00 0.00 34.13 29.01 1a4s s GLU 263 CO -0.01 -0.96 0.00 1.28 -0.49 0.00 0.00 175.26 175.08 1a4s n LEU 264 N 4.11 0.00 0.00 1.80 4.32 0.46 -2.35 117.00 125.34 1a4s n LEU 264 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.03 1a4s n LEU 264 Cb 0.41 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.21 1a4s n LEU 264 CO 0.23 -0.34 0.00 0.61 -1.22 0.00 0.00 177.39 176.68 1a4s n GLY 265 N 5.00 1.24 3.90 -0.72 0.00 -1.21 -4.85 105.19 108.54 1a4s n GLY 265 Ca 0.00 -1.58 -0.02 0.00 0.00 0.00 0.00 46.02 44.42 1a4s n GLY 265 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1a4s s GLY 266 N 0.00 0.09 -0.37 -0.02 0.00 -1.24 -4.54 107.32 101.22 1a4s s GLY 266 Ca 0.00 -0.29 0.13 0.00 0.00 0.00 0.00 44.72 44.55 1a4s s GLY 266 CO 0.00 2.88 0.93 1.17 0.00 0.00 0.00 173.10 178.09 1a4s n LYS 267 N -0.73 1.06 -1.92 2.90 3.00 -1.26 -4.47 118.16 116.73 1a4s n LYS 267 Ca -0.02 -2.93 -0.40 0.00 -0.00 0.00 0.00 58.31 54.96 1a4s n LYS 267 Cb 0.59 -1.27 0.00 0.00 0.00 0.00 0.00 35.03 34.36 1a4s n LYS 267 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 1a4s s SER 268 N -2.31 6.15 -0.12 3.14 0.01 -1.23 -4.76 113.70 114.58 1a4s s SER 268 Ca 0.31 2.82 -0.07 0.00 1.31 0.00 0.00 55.95 60.32 1a4s s SER 268 Cb 0.38 -2.65 -0.04 0.00 0.21 0.00 0.00 66.02 63.92 1a4s s SER 268 CO -0.04 -0.98 0.13 -2.16 0.41 0.00 0.00 173.24 170.60 1a4s s PRO 269 N -2.29 3.43 -0.17 12.44 0.04 -1.26 -1.94 135.00 145.25 1a4s s PRO 269 Ca 0.58 -0.16 0.01 0.00 0.04 0.00 0.00 61.00 61.47 1a4s s PRO 269 Cb -0.42 -3.16 0.01 0.00 0.04 0.00 0.00 34.50 30.97 1a4s s PRO 269 CO 0.54 0.75 -0.18 -1.17 0.04 0.00 0.00 177.00 176.98 1a4s s LEU 270 N -0.96 2.25 -0.25 -3.56 2.96 -0.40 -1.16 118.68 117.56 1a4s s LEU 270 Ca 0.15 -0.59 -0.05 0.00 -0.22 0.00 0.00 54.13 53.42 1a4s s LEU 270 Cb -0.12 -1.51 -0.00 0.00 0.50 0.00 0.00 46.19 45.06 1a4s s LEU 270 CO 0.04 0.03 0.01 -0.76 -1.32 0.00 0.00 176.35 174.35 1a4s s LEU 271 N 1.14 3.30 -0.32 -0.68 1.43 0.20 -0.90 118.68 122.83 1a4s s LEU 271 Ca 0.01 -0.48 -0.05 0.00 -1.03 0.00 0.00 54.13 52.58 1a4s s LEU 271 Cb -0.14 -1.81 0.04 0.00 0.03 0.00 0.00 46.19 44.31 1a4s s LEU 271 CO -0.08 -0.08 0.07 -0.63 0.23 0.00 0.00 176.35 175.86 1a4s s ILE 272 N 1.50 3.57 0.45 -0.59 1.01 -0.19 0.20 121.20 127.15 1a4s s ILE 272 Ca 0.05 -1.11 -0.02 0.00 0.00 0.00 0.00 60.65 59.56 1a4s s ILE 272 Cb -0.15 -2.99 -0.02 0.00 0.01 0.00 0.00 42.46 39.31 1a4s s ILE 272 CO -0.00 -0.10 0.71 -0.36 0.00 0.00 0.00 174.94 175.19 1a4s s PHE 273 N 1.38 3.43 -0.06 3.97 0.40 -0.51 -1.76 117.98 124.83 1a4s s PHE 273 Ca -0.02 0.53 0.31 0.00 -0.60 0.00 0.00 56.93 57.15 1a4s s PHE 273 Cb -0.19 -2.24 1.22 0.00 0.51 0.00 0.00 43.02 42.32 1a4s s PHE 273 CO 0.01 -0.25 1.91 1.57 0.70 0.00 0.00 175.22 179.16 1a4s h LYS 274 N 0.36 0.00 -0.22 0.44 2.10 -1.89 -0.33 116.57 117.03 1a4s h LYS 274 Ca -0.47 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 1a4s h LYS 274 Cb 1.23 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 1a4s h LYS 274 CO 0.60 0.00 0.00 -0.40 -2.00 0.00 0.00 179.45 177.65 1a4s n ASP 275 N -2.92 1.32 -4.57 7.07 5.75 -1.26 -4.99 116.55 116.95 1a4s n ASP 275 Ca 0.01 -1.90 -0.28 0.00 -0.01 0.00 0.00 54.79 52.60 1a4s n ASP 275 Cb 0.31 -0.15 0.22 0.00 -1.03 0.00 0.00 41.12 40.47 1a4s n ASP 275 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1a4s s GLU 277 N -4.68 3.39 0.20 0.00 2.02 -1.26 -4.96 118.70 113.41 1a4s s GLU 277 Ca 0.67 -0.14 -0.10 0.00 0.02 0.00 0.00 54.97 55.42 1a4s s GLU 277 Cb -0.22 -4.00 0.26 0.00 0.10 0.00 0.00 34.13 30.27 1a4s s GLU 277 CO 0.61 -1.34 1.73 1.25 0.02 0.00 0.00 175.26 177.53 1a4s h LEU 278 N 10.67 0.12 -1.13 1.80 6.46 -1.96 -1.80 115.31 129.46 1a4s h LEU 278 Ca -0.25 0.09 0.00 0.00 -0.12 0.00 0.00 57.88 57.60 1a4s h LEU 278 Cb 1.08 0.10 -0.04 0.00 -0.73 0.00 0.00 40.66 41.06 1a4s h LEU 278 CO 1.04 0.08 0.51 -0.08 -0.62 0.00 0.00 178.44 179.37 1a4s h GLU 279 N 0.33 1.10 -0.51 1.25 4.57 -1.99 0.62 114.58 119.95 1a4s h GLU 279 Ca 0.30 -0.09 -0.11 0.00 -1.18 0.00 0.00 59.36 58.28 1a4s h GLU 279 Cb 0.39 -0.24 -0.02 0.00 -0.16 0.00 0.00 28.75 28.73 1a4s h GLU 279 CO -0.34 0.75 -0.12 -0.91 -1.18 0.00 0.00 179.01 177.22 1a4s h ASN 280 N 1.13 0.99 -0.35 1.04 2.35 -1.86 -1.13 115.58 117.75 1a4s h ASN 280 Ca 0.30 -0.36 -0.05 0.00 -0.55 0.00 0.00 56.30 55.63 1a4s h ASN 280 Cb -0.08 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.00 1a4s h ASN 280 CO -0.06 1.12 0.05 0.00 -1.65 0.00 0.00 177.43 176.89 1a4s h ALA 281 N 0.90 1.27 -0.11 -0.83 0.00 -1.01 0.33 119.26 119.81 1a4s h ALA 281 Ca 0.13 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1a4s h ALA 281 Cb 0.69 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1a4s h ALA 281 CO 0.05 0.50 0.03 0.28 0.00 0.00 0.00 179.25 180.11 1a4s h VAL 282 N 0.65 1.18 -0.49 0.00 2.07 -0.25 -0.60 116.25 118.81 1a4s h VAL 282 Ca 0.14 -0.57 0.08 0.00 0.82 0.00 0.00 66.70 67.18 1a4s h VAL 282 Cb 0.34 1.36 -0.07 0.00 -1.52 0.00 0.00 31.29 31.39 1a4s h VAL 282 CO 0.01 0.17 0.09 0.03 0.02 0.00 0.00 177.57 177.88 1a4s h ARG 283 N -0.02 0.22 -0.09 1.57 3.08 -0.87 -1.20 114.38 117.07 1a4s h ARG 283 Ca 0.04 -0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.11 1a4s h ARG 283 Cb 0.23 -0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.18 1a4s h ARG 283 CO -0.00 0.14 -0.23 0.78 -1.07 0.00 0.00 179.97 179.59 1a4s h GLY 284 N 0.22 -0.27 1.19 0.04 0.00 -0.05 0.71 103.07 104.92 1a4s h GLY 284 Ca 0.25 0.28 -0.03 0.00 0.00 0.00 0.00 47.33 47.83 1a4s h GLY 284 CO -0.33 -0.20 0.33 0.00 0.00 0.00 0.00 176.54 176.35 1a4s h ALA 285 N 0.61 1.21 -0.23 3.60 0.00 -0.64 0.21 119.26 124.02 1a4s h ALA 285 Ca 0.09 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1a4s h ALA 285 Cb 0.45 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1a4s h ALA 285 CO -0.27 0.59 0.06 -0.07 0.00 0.00 0.00 179.25 179.56 1a4s h LEU 286 N 1.03 0.35 -1.33 0.00 -0.00 -0.78 -2.24 115.31 112.35 1a4s h LEU 286 Ca 0.25 -0.22 -0.03 0.00 -0.00 0.00 0.00 57.88 57.88 1a4s h LEU 286 Cb 0.13 -0.09 -0.00 0.00 -0.00 0.00 0.00 40.66 40.70 1a4s h LEU 286 CO -0.03 0.48 -0.14 0.24 -0.00 0.00 0.00 178.44 179.00 1a4s h MET 287 N 0.20 0.00 0.00 1.13 2.86 -0.71 -1.63 114.93 116.78 1a4s h MET 287 Ca 0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.71 1a4s h MET 287 Cb 0.27 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.93 1a4s h MET 287 CO 0.00 0.14 0.00 0.00 1.06 0.00 0.00 176.91 178.11 1a4s n ALA 288 N -2.18 2.26 0.00 6.32 0.00 0.73 -4.38 120.51 123.26 1a4s n ALA 288 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1a4s n ALA 288 Cb 0.36 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.36 1a4s n ALA 288 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1a4s n ASN 289 N -1.72 4.92 -0.20 0.00 3.02 -0.68 -1.52 115.26 119.08 1a4s n ASN 289 Ca 0.06 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.67 1a4s n ASN 289 Cb 0.35 0.50 0.10 0.00 -0.61 0.00 0.00 39.78 40.13 1a4s n ASN 289 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1a4s n PHE 290 N -1.97 0.16 -2.62 3.10 3.72 -0.80 -3.89 117.46 115.17 1a4s n PHE 290 Ca 0.00 -0.74 -0.34 0.00 -0.05 0.00 0.00 57.45 56.31 1a4s n PHE 290 Cb 0.48 -0.12 -0.05 0.00 -0.94 0.00 0.00 39.48 38.86 1a4s n PHE 290 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1a4s s LEU 291 N -1.96 3.93 -1.43 4.37 1.43 -1.26 -3.86 118.68 119.89 1a4s s LEU 291 Ca 0.20 1.88 -0.00 0.00 -1.03 0.00 0.00 54.13 55.18 1a4s s LEU 291 Cb 0.16 -4.48 0.00 0.00 0.03 0.00 0.00 46.19 41.90 1a4s s LEU 291 CO 0.04 -0.61 0.34 0.41 0.23 0.00 0.00 176.35 176.76 1a4s n THR 292 N -0.70 -2.67 -2.51 5.49 -1.04 -1.26 -1.46 114.28 110.13 1a4s n THR 292 Ca 0.08 -0.50 -0.18 0.00 -2.04 0.00 0.00 64.05 61.41 1a4s n THR 292 Cb 0.52 -2.34 -0.00 0.00 -1.82 0.00 0.00 70.33 66.69 1a4s n THR 292 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1a4s n GLN 293 N -4.44 -2.23 -1.04 -2.82 3.00 -1.25 -1.55 117.38 107.06 1a4s n GLN 293 Ca -0.31 0.82 -0.01 0.00 -0.01 0.00 0.00 57.00 57.48 1a4s n GLN 293 Cb 0.69 -5.48 -0.01 0.00 0.00 0.00 0.00 30.24 25.44 1a4s n GLN 293 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1a4s n GLY 294 N -0.98 0.43 2.78 1.08 0.00 -0.54 -2.91 105.19 105.05 1a4s n GLY 294 Ca -0.19 -0.12 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 1a4s n GLY 294 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1a4s n GLN 295 N -1.79 4.77 -3.96 1.61 6.02 -0.59 -2.84 117.38 120.60 1a4s n GLN 295 Ca -0.01 -4.65 -0.20 0.00 -0.01 0.00 0.00 57.00 52.14 1a4s n GLN 295 Cb 0.19 -2.45 -0.17 0.00 1.02 0.00 0.00 30.24 28.83 1a4s n GLN 295 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1a4s s VAL 296 N -3.70 0.34 0.21 5.09 1.01 -1.26 -4.83 120.40 117.26 1a4s s VAL 296 Ca 0.37 0.04 -0.09 0.00 0.00 0.00 0.00 61.98 62.30 1a4s s VAL 296 Cb 0.14 -0.43 0.17 0.00 0.00 0.00 0.00 36.38 36.26 1a4s s VAL 296 CO -0.04 0.20 1.84 0.00 0.00 0.00 0.00 175.10 177.10 1a4s n THR 298 N -4.42 0.02 -1.63 0.00 -2.24 -1.26 -3.73 114.28 101.02 1a4s n THR 298 Ca 0.08 -0.08 -0.46 0.00 -2.27 0.00 0.00 64.05 61.32 1a4s n THR 298 Cb 0.09 -0.18 -0.03 0.00 -2.10 0.00 0.00 70.33 68.11 1a4s n THR 298 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1a4s n ASN 299 N -0.60 2.15 -4.57 3.42 5.03 -0.90 -4.72 115.26 115.06 1a4s n ASN 299 Ca 0.19 1.15 -0.41 0.00 0.87 0.00 0.00 54.58 56.38 1a4s n ASN 299 Cb 0.16 -1.34 -0.01 0.00 -1.02 0.00 0.00 39.78 37.57 1a4s n ASN 299 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1a4s s GLY 300 N 0.11 1.44 0.00 7.41 0.00 -0.58 -3.53 107.32 112.18 1a4s s GLY 300 Ca 0.69 -2.69 0.27 0.00 0.00 0.00 0.00 44.72 42.99 1a4s s GLY 300 CO 0.52 2.78 1.67 -1.30 0.00 0.00 0.00 173.10 176.76 1a4s n THR 301 N 6.62 0.00 -3.99 0.90 -2.24 -0.82 -4.26 114.28 110.50 1a4s n THR 301 Ca 0.45 -0.22 -0.31 0.00 -2.27 0.00 0.00 64.05 61.70 1a4s n THR 301 Cb 0.47 0.50 -0.15 0.00 -2.10 0.00 0.00 70.33 69.06 1a4s n THR 301 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1a4s s ARG 302 N -2.16 1.50 -0.39 -0.78 0.52 -1.13 -2.01 118.95 114.50 1a4s s ARG 302 Ca 0.33 -1.93 -0.17 0.00 -0.52 0.00 0.00 55.73 53.44 1a4s s ARG 302 Cb 0.20 -3.13 0.01 0.00 0.52 0.00 0.00 34.95 32.55 1a4s s ARG 302 CO 0.39 -0.97 0.42 0.08 0.02 0.00 0.00 175.30 175.24 1a4s s VAL 303 N 0.77 5.10 -0.30 3.52 1.01 0.36 -1.27 120.40 129.59 1a4s s VAL 303 Ca 0.12 -0.15 -0.15 0.00 0.00 0.00 0.00 61.98 61.80 1a4s s VAL 303 Cb -0.20 -3.96 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 1a4s s VAL 303 CO -0.08 -0.30 0.38 -0.36 0.00 0.00 0.00 175.10 174.75 1a4s s PHE 304 N 2.13 3.23 -0.11 5.22 0.08 -0.08 -0.76 117.98 127.68 1a4s s PHE 304 Ca 0.13 0.26 0.02 0.00 0.12 0.00 0.00 56.93 57.46 1a4s s PHE 304 Cb -0.17 -2.64 0.01 0.00 -0.57 0.00 0.00 43.02 39.66 1a4s s PHE 304 CO 0.13 -0.32 -0.18 0.08 -0.10 0.00 0.00 175.22 174.83 1a4s s VAL 305 N 2.09 1.72 0.28 -0.44 1.01 0.21 -1.02 120.40 124.24 1a4s s VAL 305 Ca 0.14 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 61.04 1a4s s VAL 305 Cb -0.16 -1.54 -0.11 0.00 0.00 0.00 0.00 36.38 34.58 1a4s s VAL 305 CO 0.11 0.48 1.50 -1.58 0.00 0.00 0.00 175.10 175.61 1a4s s GLN 306 N 0.79 4.20 0.27 2.72 0.74 -0.72 -2.30 119.66 125.35 1a4s s GLN 306 Ca -0.10 2.43 -0.01 0.00 0.05 0.00 0.00 55.36 57.73 1a4s s GLN 306 Cb -0.16 -3.06 0.60 0.00 1.10 0.00 0.00 33.01 31.49 1a4s s GLN 306 CO 0.01 -0.50 1.66 -0.09 -0.55 0.00 0.00 175.29 175.81 1a4s h ARG 307 N 4.73 0.22 -0.49 1.67 2.43 -1.56 -1.58 114.38 119.80 1a4s h ARG 307 Ca -0.47 -0.01 0.08 0.00 -0.81 0.00 0.00 59.98 58.77 1a4s h ARG 307 Cb 1.22 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.69 1a4s h ARG 307 CO 0.77 0.14 0.33 0.93 -1.51 0.00 0.00 179.97 180.63 1a4s h GLU 308 N 0.23 0.30 -0.16 0.20 3.07 -1.89 -2.71 114.58 113.61 1a4s h GLU 308 Ca 0.49 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.34 1a4s h GLU 308 Cb 0.94 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.78 1a4s h GLU 308 CO -0.61 0.20 0.00 0.44 -1.40 0.00 0.00 179.01 177.64 1a4s n ILE 309 N -4.47 0.35 -0.16 3.13 -5.35 -0.60 -4.75 119.36 107.51 1a4s n ILE 309 Ca 0.07 -0.68 -0.02 0.00 -0.27 0.00 0.00 62.75 61.86 1a4s n ILE 309 Cb 0.34 1.00 0.07 0.00 -1.74 0.00 0.00 39.64 39.31 1a4s n ILE 309 CO 0.00 0.00 0.00 -0.03 -1.76 0.00 0.00 176.55 174.76 1a4s h MET 310 N 2.55 0.17 0.12 6.28 4.05 -1.36 -0.69 114.93 126.06 1a4s h MET 310 Ca 0.00 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.41 1a4s h MET 310 Cb 0.63 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.38 1a4s h MET 310 CO 0.00 0.11 -0.13 -1.35 0.23 0.00 0.00 176.91 175.77 1a4s h PRO 311 N 0.18 -0.27 -0.08 0.39 0.11 -1.85 -0.31 132.00 130.16 1a4s h PRO 311 Ca 0.26 0.02 -0.11 0.00 0.11 0.00 0.00 66.00 66.28 1a4s h PRO 311 Cb 0.37 0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 1a4s h PRO 311 CO -0.38 -0.18 -0.43 -0.56 -0.21 0.00 0.00 178.00 176.24 1a4s h GLN 312 N -0.28 0.19 0.36 1.05 -0.00 -1.86 -1.87 115.11 112.69 1a4s h GLN 312 Ca 0.01 -0.09 -0.01 0.00 -0.00 0.00 0.00 58.65 58.55 1a4s h GLN 312 Cb 0.28 -0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 27.75 1a4s h GLN 312 CO -0.04 0.59 -0.19 0.35 -0.00 0.00 0.00 178.83 179.53 1a4s h PHE 313 N 0.16 -0.50 -0.94 0.06 3.57 -0.74 -2.94 116.94 115.60 1a4s h PHE 313 Ca 0.01 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.55 1a4s h PHE 313 Cb 0.83 0.17 -0.06 0.00 2.79 0.00 0.00 35.95 39.68 1a4s h PHE 313 CO 0.01 -0.31 0.61 -0.07 -2.23 0.00 0.00 178.31 176.32 1a4s h LEU 314 N -0.52 0.99 0.35 0.59 4.07 -0.93 0.49 115.31 120.35 1a4s h LEU 314 Ca -0.04 -0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.90 1a4s h LEU 314 Cb 0.41 -0.22 -0.00 0.00 1.08 0.00 0.00 40.66 41.93 1a4s h LEU 314 CO 0.06 0.66 -0.21 -0.08 -1.08 0.00 0.00 178.44 177.79 1a4s h GLU 315 N 1.15 -0.52 -0.23 1.13 4.81 -1.30 -1.05 114.58 118.57 1a4s h GLU 315 Ca 0.39 0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 59.52 1a4s h GLU 315 Cb 0.07 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 1a4s h GLU 315 CO -0.14 -0.35 -0.40 1.49 -0.73 0.00 0.00 179.01 178.88 1a4s h GLU 316 N -0.54 0.53 -0.10 1.92 4.57 -1.33 -2.99 114.58 116.64 1a4s h GLU 316 Ca -0.04 -0.27 -0.15 0.00 -1.18 0.00 0.00 59.36 57.73 1a4s h GLU 316 Cb 0.44 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.03 1a4s h GLU 316 CO 0.04 0.84 -0.58 -0.24 -1.18 0.00 0.00 179.01 177.89 1a4s h VAL 317 N 0.44 1.36 -0.34 0.32 3.04 -0.75 -1.59 116.25 118.73 1a4s h VAL 317 Ca 0.04 -1.90 -0.13 0.00 -1.01 0.00 0.00 66.70 63.70 1a4s h VAL 317 Cb 0.90 1.92 -0.01 0.00 -2.01 0.00 0.00 31.29 32.09 1a4s h VAL 317 CO 0.08 0.57 -0.28 0.58 -1.01 0.00 0.00 177.57 177.51 1a4s h VAL 318 N 0.25 1.29 -0.40 1.51 2.07 -1.21 -1.92 116.25 117.85 1a4s h VAL 318 Ca -0.00 -1.44 -0.04 0.00 0.82 0.00 0.00 66.70 66.03 1a4s h VAL 318 Cb 1.09 1.45 -0.02 0.00 -1.52 0.00 0.00 31.29 32.30 1a4s h VAL 318 CO 0.10 0.47 0.09 0.50 0.02 0.00 0.00 177.57 178.74 1a4s h LYS 319 N 0.57 0.65 -0.81 1.57 3.64 -1.36 -1.80 116.57 119.03 1a4s h LYS 319 Ca 0.06 -0.16 -0.04 0.00 -1.27 0.00 0.00 60.65 59.24 1a4s h LYS 319 Cb 0.85 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.56 1a4s h LYS 319 CO 0.07 0.68 0.34 0.00 -2.27 0.00 0.00 179.45 178.28 1a4s h ARG 320 N 0.51 1.20 -0.44 1.90 2.47 -1.32 -1.31 114.38 117.38 1a4s h ARG 320 Ca 0.12 -0.21 -0.07 0.00 -1.26 0.00 0.00 59.98 58.57 1a4s h ARG 320 Cb 0.33 -0.20 -0.02 0.00 -1.65 0.00 0.00 29.97 28.44 1a4s h ARG 320 CO 0.00 0.96 -0.00 1.15 0.56 0.00 0.00 179.97 182.64 1a4s h THR 321 N 1.18 1.26 -0.24 2.04 2.02 -1.18 -2.72 112.91 115.28 1a4s h THR 321 Ca 0.27 -1.05 -0.01 0.00 0.77 0.00 0.00 66.41 66.40 1a4s h THR 321 Cb 0.19 1.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 1a4s h THR 321 CO -0.03 0.36 0.11 0.11 0.37 0.00 0.00 175.52 176.45 1a4s h LYS 322 N 0.62 0.32 0.00 6.66 1.57 -1.19 -1.94 116.57 122.61 1a4s h LYS 322 Ca 0.12 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 1a4s h LYS 322 Cb 0.50 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.74 1a4s h LYS 322 CO 0.02 0.25 0.00 0.00 -0.57 0.00 0.00 179.45 179.16 1a4s n ALA 323 N -2.50 1.96 -1.68 3.86 0.00 -0.51 -4.84 120.51 116.81 1a4s n ALA 323 Ca 0.01 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.01 1a4s n ALA 323 Cb 0.11 -1.40 -0.04 0.00 0.00 0.00 0.00 19.45 18.12 1a4s n ALA 323 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1a4s n ILE 324 N -2.03 0.55 -2.53 0.00 5.41 -0.73 -4.94 119.36 115.09 1a4s n ILE 324 Ca 0.04 -0.10 -0.43 0.00 1.00 0.00 0.00 62.75 63.26 1a4s n ILE 324 Cb 0.30 -2.09 -0.02 0.00 -0.71 0.00 0.00 39.64 37.12 1a4s n ILE 324 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1a4s s VAL 325 N 3.62 4.42 -0.20 1.39 1.01 -1.26 -4.92 120.40 124.45 1a4s s VAL 325 Ca 0.87 1.68 -0.04 0.00 0.00 0.00 0.00 61.98 64.49 1a4s s VAL 325 Cb -0.53 -4.19 -0.02 0.00 0.00 0.00 0.00 36.38 31.64 1a4s s VAL 325 CO 0.43 -0.26 -0.03 -0.69 0.00 0.00 0.00 175.10 174.55 1a4s s VAL 326 N 3.58 3.66 -0.12 2.92 1.01 -1.26 -0.15 120.40 130.04 1a4s s VAL 326 Ca 0.50 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.07 1a4s s VAL 326 Cb -0.17 -2.65 0.00 0.00 0.00 0.00 0.00 36.38 33.56 1a4s s VAL 326 CO 0.13 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.28 1a4s n GLY 327 N 4.38 -0.88 3.63 4.51 0.00 -0.80 -4.91 105.19 111.13 1a4s n GLY 327 Ca -0.18 -0.11 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 1a4s n GLY 327 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1a4s s ASP 328 N -4.00 6.53 0.58 1.61 2.15 -1.26 -4.50 116.67 117.78 1a4s s ASP 328 Ca 0.00 1.52 0.28 0.00 0.43 0.00 0.00 52.55 54.78 1a4s s ASP 328 Cb 0.00 -2.54 1.73 0.00 -0.30 0.00 0.00 42.92 41.82 1a4s s ASP 328 CO 0.00 -1.14 2.23 1.55 -0.17 0.00 0.00 175.17 177.63 1a4s h PRO 329 N 10.00 0.00 0.00 4.34 0.13 -1.87 -2.16 132.00 142.44 1a4s h PRO 329 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1a4s h PRO 329 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1a4s h PRO 329 CO 1.01 0.01 0.00 1.28 -0.23 0.00 0.00 178.00 180.07 1a4s n LEU 330 N -3.90 0.00 -4.81 1.56 4.32 -1.26 -1.64 117.00 111.27 1a4s n LEU 330 Ca -0.03 0.08 -0.38 0.00 -0.02 0.00 0.00 56.01 55.66 1a4s n LEU 330 Cb 0.10 -0.08 -0.06 0.00 -1.62 0.00 0.00 43.42 41.76 1a4s n LEU 330 CO 0.28 -0.01 0.26 -0.76 -1.22 0.00 0.00 177.39 175.95 1a4s s LEU 331 N -2.16 4.51 0.57 2.23 1.02 -0.81 -4.87 118.68 119.17 1a4s s LEU 331 Ca 0.38 1.24 0.35 0.00 0.02 0.00 0.00 54.13 56.12 1a4s s LEU 331 Cb 0.19 -2.92 1.63 0.00 0.02 0.00 0.00 46.19 45.12 1a4s s LEU 331 CO 0.36 0.26 2.09 0.71 0.02 0.00 0.00 176.35 179.79 1a4s h THR 332 N 3.48 0.14 -0.01 5.49 1.35 -1.88 -2.70 112.91 118.78 1a4s h THR 332 Ca -0.50 -0.43 0.00 0.00 -0.55 0.00 0.00 66.41 64.94 1a4s h THR 332 Cb 1.21 1.37 0.00 0.00 -1.73 0.00 0.00 68.15 69.00 1a4s h THR 332 CO 0.63 0.04 -0.51 -1.84 -0.25 0.00 0.00 175.52 173.59 1a4s n GLU 333 N -3.21 0.76 -2.17 4.72 0.00 -1.26 -4.82 120.64 114.67 1a4s n GLU 333 Ca -0.01 -0.58 -0.37 0.00 0.00 0.00 0.00 57.16 56.20 1a4s n GLU 333 Cb 0.24 -1.49 -0.00 0.00 0.00 0.00 0.00 31.44 30.19 1a4s n GLU 333 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 1a4s s THR 334 N -2.63 2.92 0.00 3.84 2.01 -1.02 -4.75 115.64 116.01 1a4s s THR 334 Ca 0.17 0.69 0.00 0.00 0.31 0.00 0.00 61.69 62.87 1a4s s THR 334 Cb 0.18 -3.35 0.00 0.00 0.01 0.00 0.00 72.50 69.34 1a4s s THR 334 CO 0.62 -0.01 0.20 0.54 -0.69 0.00 0.00 174.62 175.28 1a4s n ARG 335 N -0.57 1.81 -3.70 4.92 5.12 0.79 -4.86 116.66 120.16 1a4s n ARG 335 Ca 0.08 -0.20 -0.12 0.00 -1.93 0.00 0.00 57.85 55.68 1a4s n ARG 335 Cb 0.47 -0.63 -0.09 0.00 -1.16 0.00 0.00 32.46 31.05 1a4s n ARG 335 CO 0.00 0.00 0.00 1.41 -1.93 0.00 0.00 177.63 177.11 1a4s s MET 336 N -0.31 0.53 0.00 5.56 1.75 -0.78 -4.87 119.30 121.18 1a4s s MET 336 Ca 0.00 0.78 0.00 0.00 -1.25 0.00 0.00 55.69 55.22 1a4s s MET 336 Cb 0.00 0.17 0.00 0.00 2.84 0.00 0.00 34.83 37.84 1a4s s MET 336 CO 0.00 -0.11 0.00 0.41 -0.65 0.00 0.00 175.02 174.67 1a4s n GLY 337 N 3.44 4.01 3.86 2.11 0.00 -1.26 -1.90 105.19 115.45 1a4s n GLY 337 Ca -0.17 -1.96 -0.31 0.00 0.00 0.00 0.00 46.02 43.57 1a4s n GLY 337 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1a4s s GLY 338 N -0.33 2.01 0.96 -0.02 0.00 -1.25 -4.81 107.32 103.88 1a4s s GLY 338 Ca 0.00 -0.01 -0.14 0.00 0.00 0.00 0.00 44.72 44.57 1a4s s GLY 338 CO 0.00 0.22 1.18 1.08 0.00 0.00 0.00 173.10 175.59 1a4s s LEU 339 N -3.94 2.03 0.25 0.66 1.43 0.38 -4.68 118.68 114.80 1a4s s LEU 339 Ca 0.55 0.72 -0.00 0.00 -1.03 0.00 0.00 54.13 54.37 1a4s s LEU 339 Cb -0.10 -2.90 0.31 0.00 0.03 0.00 0.00 46.19 43.53 1a4s s LEU 339 CO 0.31 -2.78 1.67 -0.29 0.23 0.00 0.00 176.35 175.49 1a4s h ILE 340 N -1.66 1.27 -3.66 -0.59 -0.00 -1.88 -3.42 117.51 107.57 1a4s h ILE 340 Ca -0.48 -1.35 -0.06 0.00 -0.00 0.00 0.00 64.86 62.97 1a4s h ILE 340 Cb 1.30 1.35 -0.10 0.00 -0.00 0.00 0.00 36.82 39.38 1a4s h ILE 340 CO 0.52 0.43 -0.14 -0.94 -0.00 0.00 0.00 178.15 178.03 1a4s s SER 341 N -6.80 -0.09 0.06 2.19 1.04 -1.26 -4.75 113.70 104.09 1a4s s SER 341 Ca -0.08 -0.88 -0.18 0.00 0.48 0.00 0.00 55.95 55.29 1a4s s SER 341 Cb 0.13 0.56 -0.13 0.00 0.10 0.00 0.00 66.02 66.69 1a4s s SER 341 CO 0.81 -1.09 1.35 0.50 0.98 0.00 0.00 173.24 175.78 1a4s h LYS 342 N 2.29 0.50 -0.49 4.02 1.63 -1.96 -1.90 116.57 120.66 1a4s h LYS 342 Ca -0.27 -0.29 -0.03 0.00 -0.85 0.00 0.00 60.65 59.21 1a4s h LYS 342 Cb 1.25 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.88 1a4s h LYS 342 CO 0.38 0.88 0.18 -1.35 -3.45 0.00 0.00 179.45 176.09 1a4s h PRO 343 N 0.16 0.71 -0.04 1.90 0.11 -1.98 0.13 132.00 132.99 1a4s h PRO 343 Ca 0.02 -0.11 -0.01 0.00 0.11 0.00 0.00 66.00 66.02 1a4s h PRO 343 Cb 0.81 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.79 1a4s h PRO 343 CO 0.06 0.60 -0.01 1.96 -0.21 0.00 0.00 178.00 180.40 1a4s h GLN 344 N 0.70 0.08 -0.65 1.05 1.08 -1.95 -0.45 115.11 114.98 1a4s h GLN 344 Ca 0.17 -0.03 0.07 0.00 -1.45 0.00 0.00 58.65 57.40 1a4s h GLN 344 Cb 0.16 -0.01 -0.06 0.00 -0.05 0.00 0.00 27.48 27.53 1a4s h GLN 344 CO -0.01 0.42 0.34 1.25 -0.95 0.00 0.00 178.83 179.87 1a4s h LEU 345 N -0.25 0.48 -0.94 1.46 5.85 -0.43 -1.00 115.31 120.47 1a4s h LEU 345 Ca 0.01 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 1a4s h LEU 345 Cb 0.38 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 1a4s h LEU 345 CO 0.00 0.30 0.29 0.44 -0.34 0.00 0.00 178.44 179.14 1a4s h ASP 346 N 0.62 0.98 -0.35 1.25 3.32 -0.62 -0.55 116.42 121.07 1a4s h ASP 346 Ca 0.30 -0.14 -0.14 0.00 0.02 0.00 0.00 57.03 57.08 1a4s h ASP 346 Cb 0.23 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1a4s h ASP 346 CO -0.21 0.86 -0.31 0.50 -1.72 0.00 0.00 179.24 178.37 1a4s h LYS 347 N 1.04 0.83 -0.38 3.56 3.64 -0.76 0.15 116.57 124.65 1a4s h LYS 347 Ca 0.24 -0.42 0.00 0.00 -1.27 0.00 0.00 60.65 59.20 1a4s h LYS 347 Cb 0.19 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 1a4s h LYS 347 CO -0.02 1.06 0.25 0.28 -2.27 0.00 0.00 179.45 178.75 1a4s h VAL 348 N 0.62 1.10 -0.72 2.00 2.07 -0.81 -1.40 116.25 119.11 1a4s h VAL 348 Ca 0.06 -0.19 -0.04 0.00 0.82 0.00 0.00 66.70 67.35 1a4s h VAL 348 Cb 0.89 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 1a4s h VAL 348 CO 0.08 0.10 0.29 -0.07 0.02 0.00 0.00 177.57 177.99 1a4s h LEU 349 N 0.52 1.00 -0.61 2.57 3.38 -1.04 -2.76 115.31 118.37 1a4s h LEU 349 Ca 0.14 -0.17 0.12 0.00 0.09 0.00 0.00 57.88 58.05 1a4s h LEU 349 Cb -0.05 -0.26 -0.09 0.00 0.09 0.00 0.00 40.66 40.35 1a4s h LEU 349 CO -0.03 0.90 0.11 1.23 0.09 0.00 0.00 178.44 180.74 1a4s h GLY 350 N 1.04 0.76 0.82 0.83 0.00 -0.35 -1.28 103.07 104.90 1a4s h GLY 350 Ca 0.24 -0.01 0.02 0.00 0.00 0.00 0.00 47.33 47.58 1a4s h GLY 350 CO -0.02 -0.13 0.07 0.74 0.00 0.00 0.00 176.54 177.20 1a4s h PHE 351 N 0.24 0.12 -0.72 5.60 0.04 -0.99 -0.41 116.94 120.81 1a4s h PHE 351 Ca 0.32 0.01 0.02 0.00 2.80 0.00 0.00 57.97 61.12 1a4s h PHE 351 Cb 0.49 -0.02 -0.04 0.00 2.20 0.00 0.00 35.95 38.57 1a4s h PHE 351 CO -0.26 0.05 0.47 0.28 -0.60 0.00 0.00 178.31 178.25 1a4s h VAL 352 N 0.16 1.15 -0.73 -0.55 2.07 -1.22 -0.76 116.25 116.36 1a4s h VAL 352 Ca 0.09 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 1a4s h VAL 352 Cb 0.06 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 29.93 1a4s h VAL 352 CO -0.10 0.17 0.43 0.00 0.02 0.00 0.00 177.57 178.09 1a4s h ALA 353 N 1.28 0.92 -0.61 1.67 0.00 -1.00 -1.92 119.26 119.60 1a4s h ALA 353 Ca 0.27 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 1a4s h ALA 353 Cb -0.05 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 1a4s h ALA 353 CO -0.08 0.40 0.04 0.37 0.00 0.00 0.00 179.25 179.98 1a4s h GLN 354 N 0.99 1.04 -0.83 0.00 4.15 -1.01 -2.57 115.11 116.87 1a4s h GLN 354 Ca 0.26 -0.30 0.01 0.00 0.77 0.00 0.00 58.65 59.39 1a4s h GLN 354 Cb -0.02 -0.11 -0.04 0.00 0.21 0.00 0.00 27.48 27.51 1a4s h GLN 354 CO -0.05 0.99 0.55 0.00 -1.93 0.00 0.00 178.83 178.39 1a4s h ALA 355 N 1.07 1.06 -0.21 3.38 0.00 -0.55 -1.58 119.26 122.42 1a4s h ALA 355 Ca 0.18 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 1a4s h ALA 355 Cb 0.49 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1a4s h ALA 355 CO 0.02 0.46 -0.31 1.57 0.00 0.00 0.00 179.25 180.99 1a4s h LYS 356 N 1.13 0.42 -0.39 0.00 2.10 -1.06 0.47 116.57 119.24 1a4s h LYS 356 Ca 0.31 -0.17 -0.02 0.00 -2.00 0.00 0.00 60.65 58.76 1a4s h LYS 356 Cb -0.12 -0.02 -0.02 0.00 -0.90 0.00 0.00 32.23 31.17 1a4s h LYS 356 CO -0.07 0.69 0.14 0.87 -2.00 0.00 0.00 179.45 179.09 1a4s h LYS 357 N 0.37 0.55 -0.00 0.07 1.57 -1.06 -1.71 116.57 116.36 1a4s h LYS 357 Ca 0.05 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 1a4s h LYS 357 Cb 0.73 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.93 1a4s h LYS 357 CO 0.06 0.47 -0.13 0.39 -0.57 0.00 0.00 179.45 179.67 1a4s n GLU 358 N -4.37 0.05 0.00 3.15 1.02 -0.64 -4.88 120.64 114.96 1a4s n GLU 358 Ca 0.02 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 1a4s n GLU 358 Cb 0.15 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 1a4s n GLU 358 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1a4s n GLY 359 N 1.48 0.60 3.79 0.62 0.00 -0.64 -5.08 105.19 105.95 1a4s n GLY 359 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 1a4s n GLY 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a4s s ALA 360 N -1.50 2.86 -0.33 4.61 0.00 0.11 -4.91 121.76 122.60 1a4s s ALA 360 Ca 0.00 0.69 -0.12 0.00 0.00 0.00 0.00 51.96 52.54 1a4s s ALA 360 Cb 0.00 -3.29 -0.02 0.00 0.00 0.00 0.00 23.12 19.81 1a4s s ALA 360 CO 0.00 -0.44 0.21 0.50 0.00 0.00 0.00 175.76 176.03 1a4s s ARG 361 N -3.13 3.49 -0.56 0.00 3.00 0.19 -4.35 118.95 117.57 1a4s s ARG 361 Ca 0.67 -0.64 -0.28 0.00 -1.00 0.00 0.00 55.73 54.48 1a4s s ARG 361 Cb -0.20 -3.72 0.03 0.00 0.00 0.00 0.00 34.95 31.06 1a4s s ARG 361 CO 0.23 -0.41 1.21 0.08 0.00 0.00 0.00 175.30 176.41 1a4s s VAL 362 N 1.69 4.01 -0.39 7.11 1.01 -1.26 -0.56 120.40 132.01 1a4s s VAL 362 Ca 0.06 0.92 0.23 0.00 0.00 0.00 0.00 61.98 63.19 1a4s s VAL 362 Cb -0.17 -4.68 0.18 0.00 0.00 0.00 0.00 36.38 31.71 1a4s s VAL 362 CO 0.09 -1.28 1.38 -0.07 0.00 0.00 0.00 175.10 175.22 1a4s h LEU 363 N 11.97 0.00 -7.00 3.92 3.38 -1.45 -3.47 115.31 122.66 1a4s h LEU 363 Ca -0.25 -0.02 0.20 0.00 0.09 0.00 0.00 57.88 57.90 1a4s h LEU 363 Cb 1.06 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.63 1a4s h LEU 363 CO 1.18 0.01 0.70 0.00 0.09 0.00 0.00 178.44 180.41 1a4s n GLY 365 N -0.06 0.95 1.05 0.00 0.00 -1.24 -2.54 105.19 103.34 1a4s n GLY 365 Ca -0.03 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.23 1a4s n GLY 365 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a4s n GLY 366 N 0.00 0.69 3.20 -0.02 0.00 -0.63 -4.88 105.19 103.55 1a4s n GLY 366 Ca 0.00 -0.46 -0.14 0.00 0.00 0.00 0.00 46.02 45.42 1a4s n GLY 366 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1a4s s GLU 367 N -0.93 0.93 0.64 1.61 2.02 -1.26 -4.86 118.70 116.84 1a4s s GLU 367 Ca 0.00 -1.29 -0.18 0.00 0.02 0.00 0.00 54.97 53.52 1a4s s GLU 367 Cb 0.00 -0.54 -0.03 0.00 0.10 0.00 0.00 34.13 33.66 1a4s s GLU 367 CO 0.00 0.07 1.03 -2.30 0.02 0.00 0.00 175.26 174.08 1a4s n PRO 368 N 0.21 0.85 -3.80 0.39 -0.02 -1.26 -1.72 135.00 129.64 1a4s n PRO 368 Ca -0.13 0.34 -0.13 0.00 -2.02 0.00 0.00 63.50 61.56 1a4s n PRO 368 Cb 0.59 -2.25 -0.13 0.00 -0.02 0.00 0.00 33.50 31.69 1a4s n PRO 368 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1a4s s LEU 369 N -2.72 1.29 -0.28 2.45 0.20 -0.93 -4.67 118.68 114.02 1a4s s LEU 369 Ca 0.77 0.24 0.02 0.00 0.69 0.00 0.00 54.13 55.86 1a4s s LEU 369 Cb -0.39 0.36 0.07 0.00 -0.43 0.00 0.00 46.19 45.80 1a4s s LEU 369 CO 0.46 -0.08 -0.04 -0.89 -0.29 0.00 0.00 176.35 175.51 1a4s s THR 370 N 0.44 1.92 0.91 3.68 2.01 -1.26 -4.41 115.64 118.93 1a4s s THR 370 Ca -0.03 -1.68 -0.10 0.00 0.31 0.00 0.00 61.69 60.18 1a4s s THR 370 Cb -0.05 -2.20 0.14 0.00 0.01 0.00 0.00 72.50 70.41 1a4s s THR 370 CO -0.02 -0.24 1.15 -2.84 -0.69 0.00 0.00 174.62 171.98 1a4s s PRO 371 N 1.17 1.03 0.13 4.92 0.02 -1.26 -4.96 135.00 136.04 1a4s s PRO 371 Ca -0.02 1.57 -0.19 0.00 0.02 0.00 0.00 61.00 62.39 1a4s s PRO 371 Cb -0.19 -1.73 -0.05 0.00 0.02 0.00 0.00 34.50 32.55 1a4s s PRO 371 CO -0.07 -2.63 1.77 0.77 -0.33 0.00 0.00 177.00 176.50 1a4s h SER 372 N -1.84 0.30 -2.08 2.53 0.02 -1.98 -3.42 113.55 107.08 1a4s h SER 372 Ca -0.43 -0.03 -0.59 0.00 -0.84 0.00 0.00 61.79 59.90 1a4s h SER 372 Cb 1.27 -0.08 0.01 0.00 0.14 0.00 0.00 62.40 63.75 1a4s h SER 372 CO 0.42 0.24 1.22 -0.67 -1.14 0.00 0.00 176.83 176.90 1a4s n ASP 373 N -4.89 3.60 0.20 3.07 -0.08 -1.26 -4.89 116.55 112.29 1a4s n ASP 373 Ca -0.02 0.81 0.15 0.00 -1.51 0.00 0.00 54.79 54.22 1a4s n ASP 373 Cb 0.04 -1.44 0.78 0.00 2.34 0.00 0.00 41.12 42.84 1a4s n ASP 373 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1a4s h PRO 374 N 10.67 0.00 0.00 -0.67 0.11 -2.02 -2.45 132.00 137.64 1a4s h PRO 374 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1a4s h PRO 374 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1a4s h PRO 374 CO 0.95 0.00 0.00 0.36 -0.21 0.00 0.00 178.00 179.10 1a4s n LYS 375 N -4.06 0.31 -0.01 1.05 2.85 -1.26 -3.04 118.16 114.00 1a4s n LYS 375 Ca 0.01 0.02 0.12 0.00 -1.05 0.00 0.00 58.31 57.41 1a4s n LYS 375 Cb 0.28 -1.50 0.14 0.00 -0.65 0.00 0.00 35.03 33.30 1a4s n LYS 375 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1a4s n LEU 376 N -1.34 2.88 -0.24 -5.58 4.32 -0.92 -4.59 117.00 111.53 1a4s n LEU 376 Ca 0.12 -0.97 0.12 0.00 -0.02 0.00 0.00 56.01 55.26 1a4s n LEU 376 Cb 0.25 -0.01 0.40 0.00 -1.62 0.00 0.00 43.42 42.44 1a4s n LEU 376 CO 0.23 0.48 1.22 0.11 -1.22 0.00 0.00 177.39 178.21 1a4s h LYS 377 N 4.49 0.62 -0.72 3.23 6.56 -1.65 -1.89 116.57 127.22 1a4s h LYS 377 Ca 0.00 -0.04 0.00 0.00 -1.06 0.00 0.00 60.65 59.55 1a4s h LYS 377 Cb 0.95 -0.14 0.00 0.00 -0.57 0.00 0.00 32.23 32.47 1a4s h LYS 377 CO 0.00 0.41 0.00 0.09 -2.06 0.00 0.00 179.45 177.89 1a4s n ASN 378 N -4.54 4.35 -4.73 0.86 5.03 -1.26 -4.95 115.26 110.02 1a4s n ASN 378 Ca 0.16 -2.18 -0.30 0.00 0.87 0.00 0.00 54.58 53.13 1a4s n ASN 378 Cb 0.47 -0.54 0.13 0.00 -1.02 0.00 0.00 39.78 38.82 1a4s n ASN 378 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1a4s s GLY 379 N -0.96 1.62 -1.27 7.41 0.00 -0.71 -3.45 107.32 109.97 1a4s s GLY 379 Ca 0.51 -0.06 -0.06 0.00 0.00 0.00 0.00 44.72 45.11 1a4s s GLY 379 CO 0.30 0.41 2.11 -1.72 0.00 0.00 0.00 173.10 174.21 1a4s n TYR 380 N -3.80 2.68 -3.92 1.90 4.01 -0.53 -4.91 117.16 112.60 1a4s n TYR 380 Ca 0.07 -2.77 -0.31 0.00 -0.16 0.00 0.00 57.90 54.73 1a4s n TYR 380 Cb 0.55 -1.78 -0.04 0.00 -0.31 0.00 0.00 39.34 37.76 1a4s n TYR 380 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1a4s s PHE 381 N -1.02 3.52 0.13 -0.72 0.08 -1.26 -0.47 117.98 118.23 1a4s s PHE 381 Ca 0.46 0.24 -0.11 0.00 0.12 0.00 0.00 56.93 57.65 1a4s s PHE 381 Cb 0.15 -1.76 0.00 0.00 -0.57 0.00 0.00 43.02 40.85 1a4s s PHE 381 CO -0.05 0.59 0.28 0.00 -0.10 0.00 0.00 175.22 175.94 1a4s s MET 382 N -2.54 1.02 0.00 0.44 0.23 -1.26 -2.20 119.30 114.99 1a4s s MET 382 Ca 0.35 -0.97 -0.19 0.00 -1.03 0.00 0.00 55.69 53.84 1a4s s MET 382 Cb -0.13 0.39 -0.06 0.00 -1.53 0.00 0.00 34.83 33.50 1a4s s MET 382 CO 0.28 -0.36 0.56 -1.54 -2.03 0.00 0.00 175.02 171.92 1a4s s SER 383 N -2.88 6.94 0.45 -1.18 1.04 -0.70 -4.83 113.70 112.54 1a4s s SER 383 Ca 0.09 1.12 -0.25 0.00 0.48 0.00 0.00 55.95 57.39 1a4s s SER 383 Cb 0.03 -2.34 -0.09 0.00 0.10 0.00 0.00 66.02 63.72 1a4s s SER 383 CO -0.07 0.15 1.26 -0.81 0.98 0.00 0.00 173.24 174.75 1a4s n PRO 384 N 2.51 1.84 -4.90 4.02 -0.04 -1.26 -1.61 135.00 135.56 1a4s n PRO 384 Ca -0.08 0.66 -0.27 0.00 -0.04 0.00 0.00 63.50 63.77 1a4s n PRO 384 Cb 0.51 -2.39 -0.16 0.00 -0.04 0.00 0.00 33.50 31.42 1a4s n PRO 384 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1a4s s VAL 386 N -0.08 2.34 -0.04 0.00 1.01 -1.05 -0.97 120.40 121.61 1a4s s VAL 386 Ca -0.02 -0.90 0.03 0.00 0.00 0.00 0.00 61.98 61.09 1a4s s VAL 386 Cb -0.11 -1.94 -0.03 0.00 0.00 0.00 0.00 36.38 34.30 1a4s s VAL 386 CO 0.02 0.54 -0.12 -0.76 0.00 0.00 0.00 175.10 174.78 1a4s s LEU 387 N 0.58 2.89 0.39 3.92 1.43 0.54 -1.03 118.68 127.40 1a4s s LEU 387 Ca -0.11 -0.16 0.06 0.00 -1.03 0.00 0.00 54.13 52.89 1a4s s LEU 387 Cb -0.16 -1.62 -0.08 0.00 0.03 0.00 0.00 46.19 44.36 1a4s s LEU 387 CO 0.03 0.34 0.02 -0.62 0.23 0.00 0.00 176.35 176.35 1a4s s ASP 388 N -0.88 3.54 -1.33 2.29 2.15 0.28 -1.39 116.67 121.33 1a4s s ASP 388 Ca 0.13 -1.36 -0.08 0.00 0.43 0.00 0.00 52.55 51.66 1a4s s ASP 388 Cb -0.11 -0.33 0.01 0.00 -0.30 0.00 0.00 42.92 42.19 1a4s s ASP 388 CO 0.02 -0.47 1.03 -3.20 -0.17 0.00 0.00 175.17 172.38 1a4s n ASN 389 N -0.90 -6.16 -4.94 -0.34 5.15 -1.26 -0.64 115.26 106.17 1a4s n ASN 389 Ca -0.04 -0.47 -0.26 0.00 -0.60 0.00 0.00 54.58 53.21 1a4s n ASN 389 Cb 0.67 -4.82 -0.03 0.00 -0.53 0.00 0.00 39.78 35.07 1a4s n ASN 389 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1a4s s ARG 391 N -3.47 1.16 0.57 0.00 0.52 -1.26 -4.89 118.95 111.58 1a4s s ARG 391 Ca 0.37 -1.42 0.30 0.00 -0.52 0.00 0.00 55.73 54.46 1a4s s ARG 391 Cb -0.11 -0.96 1.74 0.00 0.52 0.00 0.00 34.95 36.14 1a4s s ARG 391 CO 0.29 0.16 2.19 -0.44 0.02 0.00 0.00 175.30 177.53 1a4s h ASP 392 N 3.00 0.00 0.29 0.23 3.32 -1.99 -0.45 116.42 120.82 1a4s h ASP 392 Ca -0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.66 1a4s h ASP 392 Cb 1.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.75 1a4s h ASP 392 CO 0.57 0.05 -0.37 -0.90 -1.72 0.00 0.00 179.24 176.86 1a4s n ASP 393 N -3.68 0.94 -4.76 6.45 5.75 -1.26 -4.58 116.55 115.41 1a4s n ASP 393 Ca -0.02 -0.75 -0.35 0.00 -0.01 0.00 0.00 54.79 53.65 1a4s n ASP 393 Cb 0.14 0.23 0.03 0.00 -1.03 0.00 0.00 41.12 40.50 1a4s n ASP 393 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 1a4s s MET 394 N -2.67 2.96 0.30 0.11 -1.94 -0.18 -4.93 119.30 112.96 1a4s s MET 394 Ca 0.19 1.71 -0.00 0.00 -1.71 0.00 0.00 55.69 55.88 1a4s s MET 394 Cb 0.19 -1.94 0.47 0.00 2.01 0.00 0.00 34.83 35.55 1a4s s MET 394 CO 0.59 -1.19 1.88 1.15 -0.01 0.00 0.00 175.02 177.44 1a4s h THR 395 N 0.73 1.21 0.00 2.05 2.02 -1.91 -2.15 112.91 114.85 1a4s h THR 395 Ca -0.50 -0.67 -0.02 0.00 0.77 0.00 0.00 66.41 65.99 1a4s h THR 395 Cb 1.28 0.55 -0.00 0.00 -1.74 0.00 0.00 68.15 68.24 1a4s h THR 395 CO 0.55 0.26 -0.11 0.00 0.37 0.00 0.00 175.52 176.59 1a4s h VAL 397 N 0.00 0.41 0.02 0.00 2.07 -1.67 -3.39 116.25 113.68 1a4s h VAL 397 Ca -0.00 -1.73 -0.34 0.00 0.82 0.00 0.00 66.70 65.45 1a4s h VAL 397 Cb 0.76 1.96 -0.06 0.00 -1.52 0.00 0.00 31.29 32.44 1a4s h VAL 397 CO 0.01 0.23 -2.09 0.29 0.02 0.00 0.00 177.57 176.03 1a4s n LYS 398 N -2.90 0.67 -4.13 1.57 5.02 -0.90 -4.98 118.16 112.52 1a4s n LYS 398 Ca -0.05 0.16 -0.34 0.00 -2.02 0.00 0.00 58.31 56.07 1a4s n LYS 398 Cb 0.74 -1.65 -0.07 0.00 -0.02 0.00 0.00 35.03 34.02 1a4s n LYS 398 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1a4s s GLU 399 N -2.54 3.08 -0.17 1.97 0.41 -0.62 -4.96 118.70 115.86 1a4s s GLU 399 Ca -0.13 -0.45 -0.29 0.00 -0.41 0.00 0.00 54.97 53.69 1a4s s GLU 399 Cb 0.07 -2.87 -0.02 0.00 -1.78 0.00 0.00 34.13 29.53 1a4s s GLU 399 CO 0.79 0.67 1.43 -2.00 -0.49 0.00 0.00 175.26 175.65 1a4s s GLU 400 N -1.55 4.09 -0.14 1.61 2.12 -1.26 -4.84 118.70 118.73 1a4s s GLU 400 Ca 0.21 1.72 -0.21 0.00 0.36 0.00 0.00 54.97 57.05 1a4s s GLU 400 Cb -0.12 -3.89 -0.25 0.00 0.26 0.00 0.00 34.13 30.14 1a4s s GLU 400 CO 0.11 -0.92 0.54 0.82 -0.54 0.00 0.00 175.26 175.28 1a4s h ILE 401 N 5.71 1.22 -3.76 -3.70 2.04 -1.91 -3.49 117.51 113.62 1a4s h ILE 401 Ca -0.31 -2.34 -0.22 0.00 1.00 0.00 0.00 64.86 62.99 1a4s h ILE 401 Cb 1.13 2.78 0.08 0.00 -0.74 0.00 0.00 36.82 40.07 1a4s h ILE 401 CO 0.98 0.57 -0.39 0.33 0.00 0.00 0.00 178.15 179.65 1a4s n PHE 402 N -4.25 -1.62 -4.10 1.37 7.35 -1.26 -4.82 117.46 110.13 1a4s n PHE 402 Ca -0.22 0.58 -0.15 0.00 -0.76 0.00 0.00 57.45 56.89 1a4s n PHE 402 Cb 0.73 -3.32 -0.04 0.00 0.35 0.00 0.00 39.48 37.20 1a4s n PHE 402 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 1a4s s GLY 403 N -3.21 1.56 -1.29 7.13 0.00 -1.13 -4.42 107.32 105.96 1a4s s GLY 403 Ca 0.32 -1.57 -0.17 0.00 0.00 0.00 0.00 44.72 43.30 1a4s s GLY 403 CO 0.41 -1.04 1.70 -1.55 0.00 0.00 0.00 173.10 172.62 1a4s n PRO 404 N -0.57 3.23 -3.62 2.90 -0.04 -1.15 -4.56 135.00 131.20 1a4s n PRO 404 Ca 0.01 -3.38 -0.29 0.00 -0.04 0.00 0.00 63.50 59.80 1a4s n PRO 404 Cb 0.62 -3.37 -0.15 0.00 -0.04 0.00 0.00 33.50 30.55 1a4s n PRO 404 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1a4s s VAL 405 N 3.48 0.29 -0.18 0.52 1.01 -1.25 -0.62 120.40 123.65 1a4s s VAL 405 Ca 0.51 -0.94 -0.24 0.00 0.00 0.00 0.00 61.98 61.31 1a4s s VAL 405 Cb 0.03 -1.20 -0.02 0.00 0.00 0.00 0.00 36.38 35.20 1a4s s VAL 405 CO 0.05 -0.66 0.79 -0.32 0.00 0.00 0.00 175.10 174.96 1a4s s MET 406 N 1.92 4.27 -0.28 2.72 1.75 -0.14 -4.92 119.30 124.61 1a4s s MET 406 Ca 0.08 0.93 -0.13 0.00 -1.25 0.00 0.00 55.69 55.33 1a4s s MET 406 Cb -0.16 -3.58 -0.04 0.00 2.84 0.00 0.00 34.83 33.88 1a4s s MET 406 CO -0.30 -0.32 0.26 -1.12 -0.65 0.00 0.00 175.02 172.89 1a4s s SER 407 N 1.18 6.11 -0.13 1.11 0.01 -0.85 -0.34 113.70 120.78 1a4s s SER 407 Ca 0.36 0.05 -0.04 0.00 1.31 0.00 0.00 55.95 57.64 1a4s s SER 407 Cb -0.16 -2.16 -0.03 0.00 0.21 0.00 0.00 66.02 63.88 1a4s s SER 407 CO 0.12 -0.12 -0.01 -0.69 0.41 0.00 0.00 173.24 172.95 1a4s s VAL 408 N 1.88 4.21 0.02 3.43 1.01 -0.49 -0.49 120.40 129.97 1a4s s VAL 408 Ca 0.10 -0.26 0.02 0.00 0.00 0.00 0.00 61.98 61.84 1a4s s VAL 408 Cb -0.16 -2.83 -0.02 0.00 0.00 0.00 0.00 36.38 33.38 1a4s s VAL 408 CO 0.11 0.53 -0.06 -0.76 0.00 0.00 0.00 175.10 174.91 1a4s s LEU 409 N -0.13 2.15 0.49 3.92 1.02 0.06 -4.17 118.68 122.02 1a4s s LEU 409 Ca 0.04 -0.35 -0.06 0.00 0.02 0.00 0.00 54.13 53.78 1a4s s LEU 409 Cb -0.13 -0.20 -0.04 0.00 0.02 0.00 0.00 46.19 45.85 1a4s s LEU 409 CO 0.02 -0.09 0.81 -2.16 0.02 0.00 0.00 176.35 174.95 1a4s s PRO 410 N -0.94 3.57 0.10 1.29 0.04 -1.26 -0.62 135.00 137.17 1a4s s PRO 410 Ca -0.05 0.30 -0.12 0.00 0.04 0.00 0.00 61.00 61.17 1a4s s PRO 410 Cb -0.06 -2.34 0.01 0.00 0.04 0.00 0.00 34.50 32.15 1a4s s PRO 410 CO 0.00 -0.23 0.28 -0.59 0.04 0.00 0.00 177.00 176.50 1a4s s PHE 411 N -2.76 -0.01 -0.14 0.56 -0.12 -0.97 -4.76 117.98 109.77 1a4s s PHE 411 Ca 0.49 -0.35 -0.00 0.00 -0.05 0.00 0.00 56.93 57.02 1a4s s PHE 411 Cb -0.10 0.07 -0.09 0.00 -0.63 0.00 0.00 43.02 42.27 1a4s s PHE 411 CO 0.45 -0.60 -0.14 -0.25 -0.05 0.00 0.00 175.22 174.63 1a4s n ASP 412 N -0.05 2.66 -4.33 1.98 8.00 -1.26 -1.36 116.55 122.19 1a4s n ASP 412 Ca -0.16 -0.04 -0.17 0.00 0.71 0.00 0.00 54.79 55.12 1a4s n ASP 412 Cb 0.63 -0.25 -0.10 0.00 -0.02 0.00 0.00 41.12 41.37 1a4s n ASP 412 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1a4s s THR 413 N -2.28 1.38 0.10 -3.53 -4.23 -1.26 -4.90 115.64 100.92 1a4s s THR 413 Ca -0.19 -2.11 -0.18 0.00 -1.18 0.00 0.00 61.69 58.03 1a4s s THR 413 Cb 0.05 -2.15 -0.06 0.00 1.34 0.00 0.00 72.50 71.68 1a4s s THR 413 CO 0.32 -0.51 1.56 -0.08 -0.54 0.00 0.00 174.62 175.38 1a4s h GLU 414 N 2.54 0.49 -0.85 3.99 4.81 -1.99 -0.12 114.58 123.45 1a4s h GLU 414 Ca -0.38 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 58.70 1a4s h GLU 414 Cb 1.22 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.50 1a4s h GLU 414 CO 0.64 0.61 0.50 1.49 -0.73 0.00 0.00 179.01 181.52 1a4s h GLU 415 N 0.30 1.16 0.64 1.92 4.81 -1.99 -0.48 114.58 120.95 1a4s h GLU 415 Ca 0.09 -0.12 -0.03 0.00 -0.13 0.00 0.00 59.36 59.17 1a4s h GLU 415 Cb 0.36 -0.24 0.01 0.00 0.63 0.00 0.00 28.75 29.51 1a4s h GLU 415 CO 0.01 0.83 -0.31 1.49 -0.73 0.00 0.00 179.01 180.30 1a4s h GLU 416 N 1.17 -0.83 -0.75 1.92 4.81 -1.85 -3.01 114.58 116.04 1a4s h GLU 416 Ca 0.30 0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.62 1a4s h GLU 416 Cb -0.02 0.19 -0.05 0.00 0.63 0.00 0.00 28.75 29.50 1a4s h GLU 416 CO -0.05 -0.53 0.47 0.28 -0.73 0.00 0.00 179.01 178.45 1a4s h VAL 417 N -0.96 1.11 -0.93 0.32 2.07 -0.50 -2.19 116.25 115.16 1a4s h VAL 417 Ca -0.09 -0.32 0.08 0.00 0.82 0.00 0.00 66.70 67.20 1a4s h VAL 417 Cb 0.69 0.10 -0.07 0.00 -1.52 0.00 0.00 31.29 30.49 1a4s h VAL 417 CO 0.15 0.17 0.57 -0.07 0.02 0.00 0.00 177.57 178.41 1a4s h LEU 418 N 0.92 0.88 -0.45 2.57 3.38 -1.17 0.40 115.31 121.85 1a4s h LEU 418 Ca 0.30 0.03 -0.14 0.00 0.09 0.00 0.00 57.88 58.16 1a4s h LEU 418 Cb 0.02 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1a4s h LEU 418 CO -0.11 0.53 -0.27 0.06 0.09 0.00 0.00 178.44 178.74 1a4s h GLN 419 N 1.00 0.98 -0.33 1.13 -0.00 -1.29 -1.87 115.11 114.73 1a4s h GLN 419 Ca 0.42 -0.45 -0.13 0.00 -0.00 0.00 0.00 58.65 58.49 1a4s h GLN 419 Cb 0.28 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.48 27.74 1a4s h GLN 419 CO -0.21 1.12 -0.34 0.00 -0.00 0.00 0.00 178.83 179.40 1a4s h ARG 420 N 0.82 0.74 -0.69 0.06 3.08 -0.97 -2.07 114.38 115.35 1a4s h ARG 420 Ca 0.09 -0.35 -0.00 0.00 0.07 0.00 0.00 59.98 59.79 1a4s h ARG 420 Cb 0.85 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.87 1a4s h ARG 420 CO 0.08 0.97 0.41 0.00 -1.07 0.00 0.00 179.97 180.36 1a4s h ALA 421 N 1.00 0.88 -0.00 0.04 0.00 -0.04 -2.98 119.26 118.16 1a4s h ALA 421 Ca 0.06 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1a4s h ALA 421 Cb 0.87 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1a4s h ALA 421 CO 0.08 0.36 -0.14 0.09 0.00 0.00 0.00 179.25 179.63 1a4s n ASN 422 N -4.54 0.22 -3.68 0.00 3.02 -0.72 -4.60 115.26 104.95 1a4s n ASN 422 Ca 0.06 0.04 -0.42 0.00 -0.03 0.00 0.00 54.58 54.24 1a4s n ASN 422 Cb 0.06 -0.21 -0.00 0.00 -0.61 0.00 0.00 39.78 39.01 1a4s n ASN 422 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1a4s n ASN 423 N -1.37 4.51 -3.68 6.41 4.05 -0.78 -4.81 115.26 119.60 1a4s n ASN 423 Ca 0.09 -2.81 -0.09 0.00 0.45 0.00 0.00 54.58 52.21 1a4s n ASN 423 Cb 0.32 -1.64 -0.03 0.00 1.23 0.00 0.00 39.78 39.66 1a4s n ASN 423 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 177.26 174.49 1a4s s THR 424 N 3.03 0.01 -0.72 -0.44 -1.32 -1.26 -5.04 115.64 109.90 1a4s s THR 424 Ca 0.50 -0.60 0.23 0.00 -1.21 0.00 0.00 61.69 60.61 1a4s s THR 424 Cb 0.14 -1.54 -0.09 0.00 -1.51 0.00 0.00 72.50 69.51 1a4s s THR 424 CO -0.09 -0.03 1.11 1.07 -2.21 0.00 0.00 174.62 174.47 1a4s n THR 425 N -0.40 0.14 -1.84 5.08 5.66 -1.26 -4.86 114.28 116.80 1a4s n THR 425 Ca -0.10 -0.18 -0.30 0.00 -3.05 0.00 0.00 64.05 60.42 1a4s n THR 425 Cb 0.62 0.26 0.06 0.00 -1.55 0.00 0.00 70.33 69.72 1a4s n THR 425 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 1a4s s PHE 426 N -3.14 3.21 -0.22 1.09 0.08 -1.26 -1.09 117.98 116.65 1a4s s PHE 426 Ca 0.06 1.02 0.02 0.00 0.12 0.00 0.00 56.93 58.14 1a4s s PHE 426 Cb 0.15 -3.14 0.06 0.00 -0.57 0.00 0.00 43.02 39.52 1a4s s PHE 426 CO 0.78 -1.34 0.91 0.41 -0.10 0.00 0.00 175.22 175.88 1a4s n GLY 427 N -2.93 -0.66 0.04 4.36 0.00 -1.25 -4.79 105.19 99.95 1a4s n GLY 427 Ca 0.07 -0.02 -0.01 0.00 0.00 0.00 0.00 46.02 46.06 1a4s n GLY 427 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1a4s h LEU 428 N 0.79 -0.03 0.00 0.99 5.85 -1.80 -1.61 115.31 119.50 1a4s h LEU 428 Ca -0.40 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 57.99 1a4s h LEU 428 Cb 1.17 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 42.13 1a4s h LEU 428 CO -0.15 0.21 -0.30 0.00 -0.34 0.00 0.00 178.44 177.87 1a4s n ALA 429 N -2.39 0.41 -3.69 1.25 0.00 -1.26 -2.08 120.51 112.75 1a4s n ALA 429 Ca -0.01 -1.29 0.08 0.00 0.00 0.00 0.00 53.44 52.22 1a4s n ALA 429 Cb 0.02 0.95 0.01 0.00 0.00 0.00 0.00 19.45 20.43 1a4s n ALA 429 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1a4s n SER 430 N -1.92 -1.20 -3.75 0.00 3.41 -0.28 -4.08 113.62 105.80 1a4s n SER 430 Ca 0.00 -1.56 -0.07 0.00 -0.26 0.00 0.00 58.87 56.98 1a4s n SER 430 Cb 0.39 1.94 -0.02 0.00 -0.26 0.00 0.00 64.21 66.26 1a4s n SER 430 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1a4s s GLY 431 N -3.19 -0.23 -0.09 5.00 0.00 -0.31 -1.90 107.32 106.61 1a4s s GLY 431 Ca 0.19 -0.03 -0.06 0.00 0.00 0.00 0.00 44.72 44.82 1a4s s GLY 431 CO 0.03 -0.01 0.21 0.54 0.00 0.00 0.00 173.10 173.87 1a4s s VAL 432 N -3.73 -0.02 -0.25 1.40 0.11 -0.11 -0.63 120.40 117.17 1a4s s VAL 432 Ca 0.09 0.06 -0.05 0.00 -2.93 0.00 0.00 61.98 59.16 1a4s s VAL 432 Cb -0.04 -0.32 -0.00 0.00 -1.53 0.00 0.00 36.38 34.49 1a4s s VAL 432 CO 0.02 0.03 0.02 -0.36 -3.33 0.00 0.00 175.10 171.47 1a4s s PHE 433 N 0.58 3.05 -0.09 1.54 0.40 0.13 -1.21 117.98 122.38 1a4s s PHE 433 Ca -0.04 -0.93 -0.30 0.00 -0.60 0.00 0.00 56.93 55.06 1a4s s PHE 433 Cb -0.05 -2.17 0.12 0.00 0.51 0.00 0.00 43.02 41.42 1a4s s PHE 433 CO -0.03 -0.54 0.98 -0.08 0.70 0.00 0.00 175.22 176.25 1a4s s THR 434 N 1.49 0.00 -0.07 0.64 -1.32 -1.26 -1.43 115.64 113.70 1a4s s THR 434 Ca 0.04 0.00 0.19 0.00 -1.21 0.00 0.00 61.69 60.71 1a4s s THR 434 Cb -0.16 -1.00 -0.28 0.00 -1.51 0.00 0.00 72.50 69.55 1a4s s THR 434 CO -0.00 0.00 0.33 0.54 -2.21 0.00 0.00 174.62 173.28 1a4s n ARG 435 N 0.10 0.71 -2.26 7.08 5.12 -1.26 -4.84 116.66 121.31 1a4s n ARG 435 Ca -0.08 -0.13 -0.42 0.00 -1.93 0.00 0.00 57.85 55.29 1a4s n ARG 435 Cb 0.60 -1.46 -0.03 0.00 -1.16 0.00 0.00 32.46 30.41 1a4s n ARG 435 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1a4s s ASP 436 N -4.48 6.90 0.18 0.55 2.15 -1.26 -4.93 116.67 115.77 1a4s s ASP 436 Ca -0.08 2.14 -0.12 0.00 0.43 0.00 0.00 52.55 54.92 1a4s s ASP 436 Cb 0.11 -2.57 0.09 0.00 -0.30 0.00 0.00 42.92 40.25 1a4s s ASP 436 CO 0.79 -0.65 1.78 -0.29 -0.17 0.00 0.00 175.17 176.63 1a4s h ILE 437 N 4.66 1.21 -0.39 4.11 2.10 -2.00 -1.14 117.51 126.06 1a4s h ILE 437 Ca -0.40 -0.54 -0.09 0.00 1.08 0.00 0.00 64.86 64.91 1a4s h ILE 437 Cb 1.19 0.43 -0.01 0.00 -1.09 0.00 0.00 36.82 37.34 1a4s h ILE 437 CO 0.87 0.23 -0.11 0.28 -1.08 0.00 0.00 178.15 178.34 1a4s h SER 438 N 0.84 0.77 0.05 2.19 0.02 -2.00 -2.46 113.55 112.97 1a4s h SER 438 Ca 0.22 -0.37 -0.00 0.00 -0.84 0.00 0.00 61.79 60.79 1a4s h SER 438 Cb 0.07 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.40 1a4s h SER 438 CO -0.03 0.96 -0.03 -0.09 -1.14 0.00 0.00 176.83 176.51 1a4s h ARG 439 N 0.57 -0.07 -0.54 3.45 2.43 -1.88 -0.74 114.38 117.60 1a4s h ARG 439 Ca 0.10 0.00 0.11 0.00 -0.81 0.00 0.00 59.98 59.38 1a4s h ARG 439 Cb 0.63 0.02 -0.10 0.00 -0.42 0.00 0.00 29.97 30.10 1a4s h ARG 439 CO 0.04 0.04 -0.17 0.00 -1.51 0.00 0.00 179.97 178.38 1a4s h ALA 440 N 0.78 0.29 -0.04 2.80 0.00 -1.14 0.04 119.26 121.99 1a4s h ALA 440 Ca -0.01 0.20 -0.18 0.00 0.00 0.00 0.00 54.91 54.92 1a4s h ALA 440 Cb 0.14 0.47 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1a4s h ALA 440 CO 0.01 -0.48 -0.77 0.45 0.00 0.00 0.00 179.25 178.47 1a4s h HIS 441 N -0.04 0.39 -0.25 0.00 3.86 -1.34 -2.37 115.15 115.41 1a4s h HIS 441 Ca 0.26 -0.19 -0.10 0.00 -1.16 0.00 0.00 60.37 59.18 1a4s h HIS 441 Cb 0.43 -0.06 -0.00 0.00 1.06 0.00 0.00 27.41 28.84 1a4s h HIS 441 CO -0.48 0.94 -0.22 -0.09 0.86 0.00 0.00 177.93 178.94 1a4s h ARG 442 N 0.18 0.60 -0.44 2.45 2.43 -1.00 -1.22 114.38 117.39 1a4s h ARG 442 Ca -0.03 -0.30 -0.02 0.00 -0.81 0.00 0.00 59.98 58.81 1a4s h ARG 442 Cb 1.35 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.88 1a4s h ARG 442 CO 0.12 0.90 0.19 0.28 -1.51 0.00 0.00 179.97 179.95 1a4s h VAL 443 N 0.32 1.19 -0.97 0.20 2.07 -0.94 -1.84 116.25 116.27 1a4s h VAL 443 Ca 0.04 -0.58 0.04 0.00 0.82 0.00 0.00 66.70 67.02 1a4s h VAL 443 Cb 0.77 0.75 -0.06 0.00 -1.52 0.00 0.00 31.29 31.24 1a4s h VAL 443 CO 0.06 0.22 0.64 0.00 0.02 0.00 0.00 177.57 178.50 1a4s h ALA 444 N 1.04 1.29 -0.26 1.67 0.00 -1.39 -1.17 119.26 120.44 1a4s h ALA 444 Ca 0.15 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1a4s h ALA 444 Cb 0.16 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1a4s h ALA 444 CO -0.02 0.52 -0.24 0.00 0.00 0.00 0.00 179.25 179.52 1a4s h ALA 445 N 1.40 1.11 0.00 0.00 0.00 -0.80 -3.14 119.26 117.82 1a4s h ALA 445 Ca 0.39 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1a4s h ALA 445 Cb -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1a4s h ALA 445 CO -0.12 0.56 -0.53 0.09 0.00 0.00 0.00 179.25 179.25 1a4s n ASN 446 N -4.13 0.61 -4.71 0.00 3.02 -0.70 -4.86 115.26 104.49 1a4s n ASN 446 Ca -0.00 0.08 -0.42 0.00 -0.03 0.00 0.00 54.58 54.21 1a4s n ASN 446 Cb 0.40 0.09 -0.03 0.00 -0.61 0.00 0.00 39.78 39.63 1a4s n ASN 446 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1a4s s LEU 447 N -3.87 4.37 -1.21 3.41 1.02 -0.53 -4.96 118.68 116.92 1a4s s LEU 447 Ca 0.08 1.96 -0.11 0.00 0.02 0.00 0.00 54.13 56.08 1a4s s LEU 447 Cb 0.15 -3.58 0.19 0.00 0.02 0.00 0.00 46.19 42.97 1a4s s LEU 447 CO 0.70 -0.43 1.52 -0.62 0.02 0.00 0.00 176.35 177.54 1a4s n GLU 448 N 3.88 3.53 -3.70 1.70 1.02 -1.26 -4.94 120.64 120.86 1a4s n GLU 448 Ca 0.08 -3.88 -0.10 0.00 -0.02 0.00 0.00 57.16 53.24 1a4s n GLU 448 Cb 0.47 -2.92 -0.06 0.00 -0.02 0.00 0.00 31.44 28.92 1a4s n GLU 448 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1a4s s ALA 449 N 0.62 -0.72 0.49 0.62 0.00 -1.26 -4.61 121.76 116.90 1a4s s ALA 449 Ca 0.40 -0.19 0.19 0.00 0.00 0.00 0.00 51.96 52.36 1a4s s ALA 449 Cb 0.00 0.60 1.26 0.00 0.00 0.00 0.00 23.12 24.98 1a4s s ALA 449 CO -0.00 -0.58 2.09 0.78 0.00 0.00 0.00 175.76 178.05 1a4s h GLY 450 N 2.55 0.00 -5.63 0.00 0.00 -0.86 -3.43 103.07 95.69 1a4s h GLY 450 Ca -0.34 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 46.69 1a4s h GLY 450 CO 0.49 0.00 -0.74 -1.59 0.00 0.00 0.00 176.54 174.70 1a4s s THR 451 N -4.71 0.27 -0.05 4.70 2.01 -1.05 -4.79 115.64 112.02 1a4s s THR 451 Ca -0.04 -0.11 0.02 0.00 0.31 0.00 0.00 61.69 61.87 1a4s s THR 451 Cb 0.16 -0.26 0.01 0.00 0.01 0.00 0.00 72.50 72.42 1a4s s THR 451 CO 0.65 0.10 -0.10 0.00 -0.69 0.00 0.00 174.62 174.58 1a4s s TYR 453 N 0.62 3.44 -0.33 0.00 2.02 -0.80 -4.97 117.35 117.33 1a4s s TYR 453 Ca -0.11 0.39 -0.06 0.00 -0.37 0.00 0.00 57.07 56.92 1a4s s TYR 453 Cb -0.14 -2.16 0.04 0.00 -0.40 0.00 0.00 41.96 39.30 1a4s s TYR 453 CO 0.02 0.34 0.09 0.42 -1.57 0.00 0.00 175.55 174.85 1a4s s ILE 454 N 0.19 3.69 -0.80 2.71 1.01 -1.26 -0.93 121.20 125.81 1a4s s ILE 454 Ca 0.10 -1.14 -0.02 0.00 0.00 0.00 0.00 60.65 59.59 1a4s s ILE 454 Cb -0.11 -3.08 0.00 0.00 0.01 0.00 0.00 42.46 39.28 1a4s s ILE 454 CO -0.00 -0.15 0.32 0.59 0.00 0.00 0.00 174.94 175.70 1a4s n ASN 455 N 4.79 -3.91 -2.00 3.58 5.03 -0.35 -4.94 115.26 117.45 1a4s n ASN 455 Ca -0.13 -0.15 0.00 0.00 0.87 0.00 0.00 54.58 55.17 1a4s n ASN 455 Cb 0.45 -2.80 0.01 0.00 -1.02 0.00 0.00 39.78 36.41 1a4s n ASN 455 CO 0.00 0.00 0.00 1.07 -1.83 0.00 0.00 177.26 176.50 1a4s n THR 456 N -3.89 0.00 -3.51 3.41 5.66 -1.26 -4.99 114.28 109.70 1a4s n THR 456 Ca -0.06 -0.13 -0.15 0.00 -3.05 0.00 0.00 64.05 60.66 1a4s n THR 456 Cb 0.56 0.26 -0.05 0.00 -1.55 0.00 0.00 70.33 69.55 1a4s n THR 456 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 1a4s s TYR 457 N -3.50 -0.57 -0.52 1.09 6.14 -1.26 -4.76 117.35 113.97 1a4s s TYR 457 Ca 0.10 0.76 0.00 0.00 0.64 0.00 0.00 57.07 58.57 1a4s s TYR 457 Cb -0.01 0.43 0.00 0.00 0.42 0.00 0.00 41.96 42.81 1a4s s TYR 457 CO 0.01 -0.68 0.00 0.43 0.64 0.00 0.00 175.55 175.95 1a4s n SER 458 N 0.45 -4.03 -4.77 4.32 7.64 -1.26 -4.84 113.62 111.14 1a4s n SER 458 Ca -0.18 0.12 -0.39 0.00 1.01 0.00 0.00 58.87 59.43 1a4s n SER 458 Cb 0.60 -1.96 -0.05 0.00 -1.01 0.00 0.00 64.21 61.80 1a4s n SER 458 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1a4s s ILE 459 N -2.03 3.70 -0.50 0.44 -1.09 -1.26 -5.02 121.20 115.44 1a4s s ILE 459 Ca 0.00 1.57 0.06 0.00 -2.23 0.00 0.00 60.65 60.05 1a4s s ILE 459 Cb 0.00 -3.94 0.22 0.00 -1.58 0.00 0.00 42.46 37.17 1a4s s ILE 459 CO 0.00 0.26 0.55 -1.20 -1.23 0.00 0.00 174.94 173.32 1a4s n SER 460 N 0.82 1.41 -4.73 3.58 7.64 -1.26 -5.11 113.62 115.97 1a4s n SER 460 Ca 0.01 -2.91 -0.41 0.00 1.01 0.00 0.00 58.87 56.57 1a4s n SER 460 Cb 0.47 -0.65 -0.03 0.00 -1.01 0.00 0.00 64.21 62.99 1a4s n SER 460 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1a4s s PRO 461 N -1.34 4.36 0.52 1.43 0.05 -1.26 -4.92 135.00 133.84 1a4s s PRO 461 Ca 0.35 2.09 0.20 0.00 0.05 0.00 0.00 61.00 63.69 1a4s s PRO 461 Cb 0.11 -3.20 1.37 0.00 0.05 0.00 0.00 34.50 32.84 1a4s s PRO 461 CO -0.11 -0.31 2.14 -0.39 0.05 0.00 0.00 177.00 178.38 1a4s h VAL 462 N 3.83 0.87 0.00 -0.36 -1.51 -1.97 -3.26 116.25 113.85 1a4s h VAL 462 Ca -0.44 -0.16 0.00 0.00 -1.23 0.00 0.00 66.70 64.87 1a4s h VAL 462 Cb 1.21 1.09 0.00 0.00 -2.13 0.00 0.00 31.29 31.46 1a4s h VAL 462 CO 0.79 0.04 0.00 -0.33 -1.23 0.00 0.00 177.57 176.85 1a4s h GLU 463 N 0.00 0.00 -6.14 5.19 3.07 -1.95 -0.04 114.58 114.71 1a4s h GLU 463 Ca -0.00 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 58.30 1a4s h GLU 463 Cb 0.09 0.00 -0.19 0.00 -0.84 0.00 0.00 28.75 27.81 1a4s h GLU 463 CO 0.01 0.00 -0.80 0.14 -1.40 0.00 0.00 179.01 176.95 1a4s s VAL 464 N -3.65 1.90 0.64 3.13 -7.23 -1.23 -4.34 120.40 109.62 1a4s s VAL 464 Ca 0.00 -1.84 -0.14 0.00 -1.81 0.00 0.00 61.98 58.20 1a4s s VAL 464 Cb 0.09 -1.83 -0.01 0.00 0.56 0.00 0.00 36.38 35.20 1a4s s VAL 464 CO 0.44 -0.21 1.06 -2.84 -0.31 0.00 0.00 175.10 173.25 1a4s s PRO 465 N -2.53 3.08 -0.06 4.82 0.02 -1.25 -2.86 135.00 136.21 1a4s s PRO 465 Ca 0.14 1.13 -0.02 0.00 0.02 0.00 0.00 61.00 62.27 1a4s s PRO 465 Cb -0.07 -2.00 0.04 0.00 0.02 0.00 0.00 34.50 32.48 1a4s s PRO 465 CO 0.07 -1.00 0.12 0.12 -0.33 0.00 0.00 177.00 175.98 1a4s s PHE 466 N -2.68 -0.10 -0.40 6.54 5.36 0.48 -4.94 117.98 122.24 1a4s s PHE 466 Ca 0.62 0.44 0.00 0.00 -0.96 0.00 0.00 56.93 57.03 1a4s s PHE 466 Cb -0.16 -0.24 0.00 0.00 -0.34 0.00 0.00 43.02 42.28 1a4s s PHE 466 CO 0.45 -0.20 0.00 0.41 -1.46 0.00 0.00 175.22 174.42 1a4s n GLY 467 N 4.81 -1.24 3.97 13.12 0.00 -1.26 -1.72 105.19 122.86 1a4s n GLY 467 Ca -0.15 -0.93 -0.19 0.00 0.00 0.00 0.00 46.02 44.76 1a4s n GLY 467 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1a4s s GLY 468 N 0.00 1.63 0.34 -0.02 0.00 -1.26 -4.04 107.32 103.97 1a4s s GLY 468 Ca 0.00 -1.49 0.08 0.00 0.00 0.00 0.00 44.72 43.31 1a4s s GLY 468 CO 0.00 -1.40 0.21 -0.19 0.00 0.00 0.00 173.10 171.72 1a4s s TYR 469 N -2.19 2.79 0.00 1.90 1.51 -0.66 -4.44 117.35 116.27 1a4s s TYR 469 Ca 0.45 -0.35 0.00 0.00 -1.01 0.00 0.00 57.07 56.15 1a4s s TYR 469 Cb -0.09 -1.73 0.00 0.00 -0.11 0.00 0.00 41.96 40.03 1a4s s TYR 469 CO 0.31 0.26 0.00 1.63 -1.11 0.00 0.00 175.55 176.63 1a4s n LYS 470 N -1.26 0.00 -0.03 -0.62 5.02 -1.26 -1.26 118.16 118.75 1a4s n LYS 470 Ca -0.02 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.28 1a4s n LYS 470 Cb 0.61 0.00 0.04 0.00 -0.02 0.00 0.00 35.03 35.66 1a4s n LYS 470 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1a4s n MET 471 N 14.00 1.16 -0.05 1.97 2.81 -0.25 -2.86 117.12 133.90 1a4s n MET 471 Ca 0.00 -0.24 0.11 0.00 -1.81 0.00 0.00 57.70 55.76 1a4s n MET 471 Cb 0.00 -1.06 0.45 0.00 -0.71 0.00 0.00 33.22 31.90 1a4s n MET 471 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1a4s n SER 472 N -0.31 1.26 0.00 7.83 7.64 -0.39 -4.79 113.62 124.86 1a4s n SER 472 Ca 0.03 -1.59 0.00 0.00 1.01 0.00 0.00 58.87 58.31 1a4s n SER 472 Cb 0.06 -0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.19 1a4s n SER 472 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1a4s n GLY 473 N 1.07 -0.36 3.41 0.23 0.00 -1.14 -0.40 105.19 108.00 1a4s n GLY 473 Ca 0.16 -2.23 -0.10 0.00 0.00 0.00 0.00 46.02 43.86 1a4s n GLY 473 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1a4s s PHE 474 N 0.00 0.15 0.00 1.61 -0.12 -0.26 -3.92 117.98 115.45 1a4s s PHE 474 Ca 0.00 -0.51 0.00 0.00 -0.05 0.00 0.00 56.93 56.37 1a4s s PHE 474 Cb 0.00 0.14 0.00 0.00 -0.63 0.00 0.00 43.02 42.53 1a4s s PHE 474 CO 0.00 -0.79 0.00 0.41 -0.05 0.00 0.00 175.22 174.79 1a4s n GLY 475 N -0.26 0.83 3.40 1.99 0.00 -1.26 -1.17 105.19 108.71 1a4s n GLY 475 Ca -0.09 -1.81 -0.20 0.00 0.00 0.00 0.00 46.02 43.92 1a4s n GLY 475 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1a4s s ARG 476 N -2.66 1.51 0.04 1.61 1.81 -1.26 -4.28 118.95 115.71 1a4s s ARG 476 Ca 0.00 -1.80 0.03 0.00 -1.72 0.00 0.00 55.73 52.24 1a4s s ARG 476 Cb 0.00 -0.83 -0.02 0.00 -0.45 0.00 0.00 34.95 33.65 1a4s s ARG 476 CO 0.00 -0.11 -0.10 -1.21 -0.68 0.00 0.00 175.30 173.21 1a4s s GLU 477 N -3.85 0.64 0.38 3.54 8.01 -0.70 -4.67 118.70 122.06 1a4s s GLU 477 Ca 0.32 -0.69 0.00 0.00 0.01 0.00 0.00 54.97 54.61 1a4s s GLU 477 Cb 0.06 -0.54 0.00 0.00 -4.31 0.00 0.00 34.13 29.35 1a4s s GLU 477 CO 0.12 0.12 0.00 0.09 0.01 0.00 0.00 175.26 175.60 1a4s n ASN 478 N 1.79 -5.44 -0.28 -0.19 3.02 -1.26 -0.38 115.26 112.50 1a4s n ASN 478 Ca -0.20 0.87 0.03 0.00 -0.03 0.00 0.00 54.58 55.25 1a4s n ASN 478 Cb 0.55 -3.24 -0.01 0.00 -0.61 0.00 0.00 39.78 36.48 1a4s n ASN 478 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1a4s n GLY 479 N -3.62 -2.08 0.15 7.41 0.00 -0.03 -3.94 105.19 103.07 1a4s n GLY 479 Ca -0.05 -1.42 0.05 0.00 0.00 0.00 0.00 46.02 44.60 1a4s n GLY 479 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1a4s h GLN 480 N 0.00 0.00 -0.16 1.61 4.20 -1.88 -3.33 115.11 115.55 1a4s h GLN 480 Ca 0.00 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.67 1a4s h GLN 480 Cb 0.20 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 1a4s h GLN 480 CO 0.00 0.30 -0.09 0.00 -0.67 0.00 0.00 178.83 178.37 1a4s h ALA 481 N 1.65 1.55 -0.02 3.87 0.00 -1.97 -2.43 119.26 121.92 1a4s h ALA 481 Ca -0.03 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.71 1a4s h ALA 481 Cb 1.29 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.00 1a4s h ALA 481 CO 0.04 0.32 0.02 1.15 0.00 0.00 0.00 179.25 180.79 1a4s h THR 482 N 0.24 0.58 -0.46 0.00 2.02 -1.68 -2.02 112.91 111.58 1a4s h THR 482 Ca 0.05 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.26 1a4s h THR 482 Cb 0.32 0.98 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 1a4s h THR 482 CO 0.02 0.00 0.31 -0.37 0.37 0.00 0.00 175.52 175.84 1a4s h VAL 483 N 0.00 1.06 0.00 3.16 -1.51 -1.68 -1.32 116.25 115.96 1a4s h VAL 483 Ca 0.01 -0.19 0.00 0.00 -1.23 0.00 0.00 66.70 65.29 1a4s h VAL 483 Cb 0.05 0.47 0.00 0.00 -2.13 0.00 0.00 31.29 29.68 1a4s h VAL 483 CO -0.00 0.10 0.00 0.44 -1.23 0.00 0.00 177.57 176.88 1a4s h ASP 484 N 0.54 0.00 0.18 4.19 3.32 -1.58 -1.86 116.42 121.21 1a4s h ASP 484 Ca 0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1a4s h ASP 484 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 1a4s h ASP 484 CO -0.04 0.00 -0.29 -1.22 -1.72 0.00 0.00 179.24 175.96 1a4s n TYR 485 N -2.42 0.00 -0.61 4.55 4.01 -0.50 -4.09 117.16 118.10 1a4s n TYR 485 Ca 0.01 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.78 1a4s n TYR 485 Cb 0.20 -0.10 0.04 0.00 -0.31 0.00 0.00 39.34 39.18 1a4s n TYR 485 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1a4s n TYR 486 N -0.51 0.00 -3.93 -0.72 4.01 -0.75 -5.03 117.16 110.23 1a4s n TYR 486 Ca 0.12 -0.53 -0.09 0.00 -0.16 0.00 0.00 57.90 57.24 1a4s n TYR 486 Cb 0.37 -0.07 -0.05 0.00 -0.31 0.00 0.00 39.34 39.28 1a4s n TYR 486 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1a4s s SER 487 N -1.39 -0.10 -0.00 7.72 1.04 -0.92 -4.17 113.70 115.87 1a4s s SER 487 Ca 0.09 -0.80 -0.05 0.00 0.48 0.00 0.00 55.95 55.67 1a4s s SER 487 Cb 0.08 0.55 -0.00 0.00 0.10 0.00 0.00 66.02 66.75 1a4s s SER 487 CO 0.01 -1.06 0.09 0.00 0.98 0.00 0.00 173.24 173.26 1a4s s GLN 488 N -3.97 0.36 -0.11 4.02 -2.07 -0.09 -4.76 119.66 113.04 1a4s s GLN 488 Ca 0.18 -0.32 -0.14 0.00 -1.82 0.00 0.00 55.36 53.26 1a4s s GLN 488 Cb 0.00 0.15 -0.05 0.00 -1.09 0.00 0.00 33.01 32.02 1a4s s GLN 488 CO 0.04 -0.08 0.32 -0.51 -1.32 0.00 0.00 175.29 173.75 1a4s s LEU 489 N -1.07 4.32 -0.19 2.60 1.43 -1.26 -0.58 118.68 123.93 1a4s s LEU 489 Ca -0.12 0.64 -0.05 0.00 -1.03 0.00 0.00 54.13 53.57 1a4s s LEU 489 Cb -0.07 -2.43 -0.03 0.00 0.03 0.00 0.00 46.19 43.70 1a4s s LEU 489 CO 0.01 0.17 0.01 -0.75 0.23 0.00 0.00 176.35 176.02 1a4s s LYS 490 N -0.03 3.72 -0.19 1.70 2.20 -0.46 -4.95 119.74 121.72 1a4s s LYS 490 Ca 0.19 -0.48 -0.17 0.00 -0.36 0.00 0.00 55.97 55.16 1a4s s LYS 490 Cb -0.14 -3.08 -0.04 0.00 -1.51 0.00 0.00 37.83 33.06 1a4s s LYS 490 CO 0.07 0.13 0.44 0.99 -0.36 0.00 0.00 175.35 176.62 1a4s s THR 491 N 0.70 5.17 -0.20 3.43 2.01 -1.26 -1.64 115.64 123.86 1a4s s THR 491 Ca 0.00 0.80 0.01 0.00 0.31 0.00 0.00 61.69 62.81 1a4s s THR 491 Cb -0.14 -3.77 0.02 0.00 0.01 0.00 0.00 72.50 68.62 1a4s s THR 491 CO 0.02 0.23 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.33 1a4s s VAL 492 N 1.36 2.25 -0.22 3.82 1.01 0.52 -4.99 120.40 124.16 1a4s s VAL 492 Ca 0.21 -0.96 -0.05 0.00 0.00 0.00 0.00 61.98 61.18 1a4s s VAL 492 Cb -0.15 -2.00 -0.02 0.00 0.00 0.00 0.00 36.38 34.21 1a4s s VAL 492 CO 0.09 0.46 0.00 -0.63 0.00 0.00 0.00 175.10 175.02 1a4s s ILE 493 N 1.30 3.85 -0.23 2.22 1.01 -1.26 -0.96 121.20 127.12 1a4s s ILE 493 Ca 0.04 -0.34 -0.01 0.00 0.00 0.00 0.00 60.65 60.33 1a4s s ILE 493 Cb -0.14 -2.76 0.02 0.00 0.01 0.00 0.00 42.46 39.60 1a4s s ILE 493 CO -0.11 0.41 -0.09 0.54 0.00 0.00 0.00 174.94 175.70 1a4s s VAL 494 N 1.26 2.78 -0.19 2.92 0.11 -0.10 -5.02 120.40 122.17 1a4s s VAL 494 Ca 0.04 -0.94 -0.29 0.00 -2.93 0.00 0.00 61.98 57.85 1a4s s VAL 494 Cb -0.15 -2.36 -0.00 0.00 -1.53 0.00 0.00 36.38 32.35 1a4s s VAL 494 CO 0.01 0.29 1.11 -0.70 -3.33 0.00 0.00 175.10 172.48 1a4s s GLU 495 N 1.34 4.28 0.07 1.54 2.56 -1.26 -2.32 118.70 124.90 1a4s s GLU 495 Ca 0.02 1.47 0.25 0.00 0.00 0.00 0.00 54.97 56.70 1a4s s GLU 495 Cb -0.16 -3.66 0.42 0.00 2.00 0.00 0.00 34.13 32.74 1a4s s GLU 495 CO -0.06 -0.60 1.36 -1.33 -0.56 0.00 0.00 175.26 174.07 1a4s n MET 496 N 6.17 0.18 0.00 4.30 2.81 -1.26 -4.94 117.12 124.39 1a4s n MET 496 Ca 0.12 0.05 0.00 0.00 -1.81 0.00 0.00 57.70 56.06 1a4s n MET 496 Cb 0.46 -1.61 0.00 0.00 -0.71 0.00 0.00 33.22 31.36 1a4s n MET 496 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1a4s n GLY 497 N 1.40 4.84 3.91 3.03 0.00 -1.26 -5.08 105.19 112.03 1a4s n GLY 497 Ca 0.04 -1.19 -0.27 0.00 0.00 0.00 0.00 46.02 44.60 1a4s n GLY 497 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1a4s s ASP 498 N 1.00 6.30 0.09 1.61 1.01 -1.26 -5.06 116.67 120.37 1a4s s ASP 498 Ca 0.00 0.84 -0.30 0.00 0.71 0.00 0.00 52.55 53.80 1a4s s ASP 498 Cb 0.00 -2.20 -0.05 0.00 1.01 0.00 0.00 42.92 41.67 1a4s s ASP 498 CO 0.00 -0.48 1.02 -0.69 0.21 0.00 0.00 175.17 175.23 1a4s s VAL 499 N -2.59 4.40 -0.29 -1.27 1.01 -1.26 -5.02 120.40 115.38 1a4s s VAL 499 Ca 0.46 1.90 -0.29 0.00 0.00 0.00 0.00 61.98 64.05 1a4s s VAL 499 Cb -0.10 -4.21 0.01 0.00 0.00 0.00 0.00 36.38 32.08 1a4s s VAL 499 CO 0.41 0.25 1.13 -1.81 0.00 0.00 0.00 175.10 175.08 1a4s s ASP 500 N 0.34 6.90 0.03 3.32 1.01 -1.26 -5.02 116.67 121.99 1a4s s ASP 500 Ca 0.50 1.17 0.03 0.00 0.71 0.00 0.00 52.55 54.97 1a4s s ASP 500 Cb -0.25 -2.54 -0.02 0.00 1.01 0.00 0.00 42.92 41.12 1a4s s ASP 500 CO 0.30 -0.89 -0.10 -0.55 0.21 0.00 0.00 175.17 174.14 1a4s s SER 501 N 1.87 1.17 0.00 0.27 0.15 -1.26 -5.01 113.70 110.89 1a4s s SER 501 Ca 0.48 -0.38 0.24 0.00 0.70 0.00 0.00 55.95 56.99 1a4s s SER 501 Cb -0.14 -0.06 0.25 0.00 -1.71 0.00 0.00 66.02 64.36 1a4s s SER 501 CO 0.16 -0.02 1.24 0.18 1.20 0.00 0.00 173.24 176.00 1a4s n LEU 502 N 2.08 1.12 0.00 3.45 4.77 -1.26 -5.33 117.00 121.83 1a4s n LEU 502 Ca -0.18 -0.37 0.00 0.00 -0.03 0.00 0.00 56.01 55.43 1a4s n LEU 502 Cb 0.56 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1a4s n LEU 502 CO 0.23 0.23 0.19 0.49 -1.33 0.00 0.00 177.39 177.21