#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2poz s LYS 4 N 0.00 0.15 0.08 3.23 2.20 -1.26 -4.36 119.74 119.78 2poz s LYS 4 Ca 0.00 0.56 -0.31 0.00 -0.36 0.00 0.00 55.97 55.86 2poz s LYS 4 Cb 0.00 -0.13 -0.08 0.00 -1.51 0.00 0.00 37.83 36.12 2poz s LYS 4 CO 0.00 -0.21 1.46 0.42 -0.36 0.00 0.00 175.35 176.66 2poz s ILE 5 N 1.65 3.29 -0.16 5.43 1.01 -0.13 -1.34 121.20 130.95 2poz s ILE 5 Ca -0.05 0.84 0.13 0.00 0.00 0.00 0.00 60.65 61.57 2poz s ILE 5 Cb -0.11 -3.54 -0.18 0.00 0.01 0.00 0.00 42.46 38.63 2poz s ILE 5 CO -0.08 0.04 0.03 0.35 0.00 0.00 0.00 174.94 175.28 2poz n THR 6 N 4.28 1.06 -3.43 2.92 -2.24 0.10 0.90 114.28 117.87 2poz n THR 6 Ca 0.13 -0.63 -0.12 0.00 -2.27 0.00 0.00 64.05 61.15 2poz n THR 6 Cb 0.42 -0.64 -0.02 0.00 -2.10 0.00 0.00 70.33 67.98 2poz n THR 6 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2poz s GLY 7 N -4.98 -0.60 -0.06 3.38 0.00 -1.14 -4.55 107.32 99.37 2poz s GLY 7 Ca -0.09 0.60 -0.00 0.00 0.00 0.00 0.00 44.72 45.23 2poz s GLY 7 CO 0.61 0.24 -0.02 0.14 0.00 0.00 0.00 173.10 174.07 2poz s VAL 8 N -3.48 0.50 -0.16 1.40 1.01 0.00 -0.50 120.40 119.16 2poz s VAL 8 Ca 0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 61.98 61.94 2poz s VAL 8 Cb -0.01 -0.59 -0.02 0.00 0.00 0.00 0.00 36.38 35.76 2poz s VAL 8 CO -0.11 0.25 -0.05 0.20 0.00 0.00 0.00 175.10 175.40 2poz s ASN 9 N 1.51 4.62 -0.15 3.32 0.02 -0.50 -0.46 114.94 123.30 2poz s ASN 9 Ca -0.02 -0.20 -0.04 0.00 -1.02 0.00 0.00 52.86 51.58 2poz s ASN 9 Cb -0.13 -1.76 -0.03 0.00 0.02 0.00 0.00 41.25 39.35 2poz s ASN 9 CO -0.03 0.14 -0.01 -0.63 0.02 0.00 0.00 177.10 176.58 2poz s ILE 10 N 0.55 4.13 -0.11 0.60 1.09 -0.06 -1.18 121.20 126.22 2poz s ILE 10 Ca -0.04 -0.28 0.02 0.00 -1.10 0.00 0.00 60.65 59.25 2poz s ILE 10 Cb -0.15 -2.81 -0.01 0.00 -1.06 0.00 0.00 42.46 38.43 2poz s ILE 10 CO 0.03 0.51 -0.16 -0.31 -0.10 0.00 0.00 174.94 174.91 2poz s TYR 11 N 0.15 2.73 -0.48 3.97 2.02 0.98 -0.16 117.35 126.56 2poz s TYR 11 Ca 0.00 -0.61 0.02 0.00 -0.37 0.00 0.00 57.07 56.12 2poz s TYR 11 Cb -0.13 -1.77 0.13 0.00 -0.40 0.00 0.00 41.96 39.79 2poz s TYR 11 CO 0.02 -0.16 0.23 -1.17 -1.57 0.00 0.00 175.55 172.91 2poz s LEU 12 N 0.10 4.67 0.71 -1.29 2.96 -0.82 -0.59 118.68 124.43 2poz s LEU 12 Ca -0.07 -2.69 -0.11 0.00 -0.22 0.00 0.00 54.13 51.04 2poz s LEU 12 Cb -0.15 -1.69 0.02 0.00 0.50 0.00 0.00 46.19 44.87 2poz s LEU 12 CO 0.05 -0.32 1.09 -0.76 -1.32 0.00 0.00 176.35 175.09 2poz s LEU 13 N 0.17 2.87 -0.54 -0.68 1.02 0.40 -4.81 118.68 117.12 2poz s LEU 13 Ca 0.15 1.17 0.05 0.00 0.02 0.00 0.00 54.13 55.52 2poz s LEU 13 Cb -0.23 -3.96 0.19 0.00 0.02 0.00 0.00 46.19 42.22 2poz s LEU 13 CO -0.03 -1.41 0.48 1.17 0.02 0.00 0.00 176.35 176.58 2poz n LYS 14 N -3.06 1.16 -3.37 1.70 4.81 -1.26 -3.82 118.16 114.32 2poz n LYS 14 Ca 0.07 -3.84 -0.45 0.00 -0.87 0.00 0.00 58.31 53.21 2poz n LYS 14 Cb 0.57 -1.90 -0.05 0.00 0.02 0.00 0.00 35.03 33.68 2poz n LYS 14 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2poz s SER 15 N -1.01 6.29 1.90 3.14 0.15 -0.45 -4.77 113.70 118.96 2poz s SER 15 Ca 0.31 -2.19 0.00 0.00 0.70 0.00 0.00 55.95 54.78 2poz s SER 15 Cb 0.05 -2.17 0.00 0.00 -1.71 0.00 0.00 66.02 62.19 2poz s SER 15 CO -0.15 -0.71 0.00 0.61 1.20 0.00 0.00 173.24 174.19 2poz n GLY 16 N 4.66 3.74 0.07 9.45 0.00 -0.95 -1.30 105.19 120.86 2poz n GLY 16 Ca -0.02 -0.03 0.13 0.00 0.00 0.00 0.00 46.02 46.09 2poz n GLY 16 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2poz n ARG 17 N 13.80 0.21 -3.68 1.61 1.85 -1.26 -4.88 116.66 124.30 2poz n ARG 17 Ca 0.00 0.12 -0.21 0.00 -1.00 0.00 0.00 57.85 56.77 2poz n ARG 17 Cb 0.00 -1.70 -0.01 0.00 -1.05 0.00 0.00 32.46 29.70 2poz n ARG 17 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2poz s LEU 18 N -4.07 4.13 -0.51 2.89 1.43 -0.42 -4.96 118.68 117.18 2poz s LEU 18 Ca 0.10 0.05 0.07 0.00 -1.03 0.00 0.00 54.13 53.32 2poz s LEU 18 Cb 0.14 -2.90 0.25 0.00 0.03 0.00 0.00 46.19 43.71 2poz s LEU 18 CO 0.63 -0.25 0.62 0.00 0.23 0.00 0.00 176.35 177.58 2poz n HIS 19 N -1.57 1.49 -1.71 0.29 1.44 0.18 -1.33 115.22 114.01 2poz n HIS 19 Ca -0.05 -3.84 -0.42 0.00 -2.01 0.00 0.00 57.72 51.40 2poz n HIS 19 Cb 0.57 -0.43 -0.00 0.00 0.12 0.00 0.00 29.99 30.25 2poz n HIS 19 CO 0.00 0.00 0.00 -2.30 -2.81 0.00 0.00 176.34 171.23 2poz n PRO 20 N 1.20 2.14 -3.98 -1.40 -0.02 -1.25 -4.38 135.00 127.31 2poz n PRO 20 Ca 0.25 0.75 -0.34 0.00 -2.02 0.00 0.00 63.50 62.14 2poz n PRO 20 Cb 0.47 -2.38 -0.14 0.00 -0.02 0.00 0.00 33.50 31.43 2poz n PRO 20 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2poz s VAL 21 N -1.12 2.73 0.21 -1.45 1.01 -1.26 -0.45 120.40 120.06 2poz s VAL 21 Ca 0.57 -1.14 0.09 0.00 0.00 0.00 0.00 61.98 61.50 2poz s VAL 21 Cb -0.54 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 2poz s VAL 21 CO 0.61 0.16 -0.07 -0.76 0.00 0.00 0.00 175.10 175.04 2poz s LEU 22 N 1.28 3.04 0.04 3.92 1.43 0.24 -1.46 118.68 127.18 2poz s LEU 22 Ca -0.01 -0.60 0.04 0.00 -1.03 0.00 0.00 54.13 52.53 2poz s LEU 22 Cb -0.17 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.35 2poz s LEU 22 CO -0.05 0.07 -0.12 0.54 0.23 0.00 0.00 176.35 177.03 2poz s VAL 23 N -1.90 0.90 -0.10 -1.59 0.11 0.46 -0.01 120.40 118.26 2poz s VAL 23 Ca 0.27 -1.02 -0.02 0.00 -2.93 0.00 0.00 61.98 58.28 2poz s VAL 23 Cb -0.08 -0.86 0.04 0.00 -1.53 0.00 0.00 36.38 33.95 2poz s VAL 23 CO 0.17 -0.14 0.04 -0.70 -3.33 0.00 0.00 175.10 171.14 2poz s GLU 24 N -1.29 0.30 -0.16 1.54 2.12 -0.32 -1.69 118.70 119.20 2poz s GLU 24 Ca -0.02 0.07 -0.10 0.00 0.36 0.00 0.00 54.97 55.28 2poz s GLU 24 Cb -0.08 -1.17 -0.05 0.00 0.26 0.00 0.00 34.13 33.09 2poz s GLU 24 CO 0.01 -0.43 0.19 0.42 -0.54 0.00 0.00 175.26 174.90 2poz s ILE 25 N 2.05 5.39 0.09 -3.70 1.01 -0.16 -1.41 121.20 124.46 2poz s ILE 25 Ca 0.04 0.32 0.07 0.00 0.00 0.00 0.00 60.65 61.07 2poz s ILE 25 Cb -0.14 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.79 2poz s ILE 25 CO -0.06 0.48 -0.13 -0.44 0.00 0.00 0.00 174.94 174.80 2poz s SER 26 N -0.07 4.20 0.33 3.58 0.01 0.34 -1.19 113.70 120.90 2poz s SER 26 Ca 0.13 -0.41 0.07 0.00 1.31 0.00 0.00 55.95 57.05 2poz s SER 26 Cb -0.12 -0.76 -0.06 0.00 0.21 0.00 0.00 66.02 65.29 2poz s SER 26 CO 0.02 0.20 -0.04 0.42 0.41 0.00 0.00 173.24 174.25 2poz s THR 27 N -1.13 1.83 -1.87 1.44 -4.23 -1.20 0.03 115.64 110.51 2poz s THR 27 Ca 0.19 -2.11 0.18 0.00 -1.18 0.00 0.00 61.69 58.77 2poz s THR 27 Cb -0.11 -2.65 0.48 0.00 1.34 0.00 0.00 72.50 71.56 2poz s THR 27 CO 0.11 -0.18 1.51 -0.90 -0.54 0.00 0.00 174.62 174.62 2poz n ASP 28 N -0.73 0.00 -0.65 3.99 5.75 -0.45 -2.15 116.55 122.31 2poz n ASP 28 Ca -0.05 -0.44 0.07 0.00 -0.01 0.00 0.00 54.79 54.36 2poz n ASP 28 Cb 0.64 -0.07 0.13 0.00 -1.03 0.00 0.00 41.12 40.79 2poz n ASP 28 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2poz n GLU 29 N -1.07 1.97 -0.99 0.11 -0.58 -1.26 -4.96 120.64 113.86 2poz n GLU 29 Ca 0.13 -1.77 0.00 0.00 -0.42 0.00 0.00 57.16 55.09 2poz n GLU 29 Cb 0.08 -1.29 0.00 0.00 -0.57 0.00 0.00 31.44 29.66 2poz n GLU 29 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2poz n GLY 30 N 0.71 0.86 3.56 0.62 0.00 -0.91 -5.00 105.19 105.03 2poz n GLY 30 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 2poz n GLY 30 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2poz s ILE 31 N -3.45 4.82 0.11 -0.61 1.01 -1.26 -4.89 121.20 116.93 2poz s ILE 31 Ca 0.00 0.50 0.05 0.00 0.00 0.00 0.00 60.65 61.20 2poz s ILE 31 Cb 0.00 -4.16 -0.04 0.00 0.01 0.00 0.00 42.46 38.27 2poz s ILE 31 CO 0.00 -0.46 0.04 0.42 0.00 0.00 0.00 174.94 174.94 2poz s THR 32 N 2.88 4.18 0.03 2.92 -4.23 -1.26 -3.22 115.64 116.94 2poz s THR 32 Ca 0.26 -1.00 0.07 0.00 -1.18 0.00 0.00 61.69 59.83 2poz s THR 32 Cb -0.14 -3.03 -0.02 0.00 1.34 0.00 0.00 72.50 70.65 2poz s THR 32 CO 0.17 0.06 -0.19 -0.83 -0.54 0.00 0.00 174.62 173.29 2poz s GLY 33 N -2.53 1.03 0.09 3.99 0.00 -0.34 -4.63 107.32 104.93 2poz s GLY 33 Ca 0.28 -0.97 0.06 0.00 0.00 0.00 0.00 44.72 44.08 2poz s GLY 33 CO 0.20 -0.90 -0.07 0.00 0.00 0.00 0.00 173.10 172.33 2poz s ALA 34 N -0.74 3.04 0.03 3.20 0.00 -1.26 -0.99 121.76 125.04 2poz s ALA 34 Ca 0.06 -1.19 -0.21 0.00 0.00 0.00 0.00 51.96 50.63 2poz s ALA 34 Cb -0.08 -0.99 0.04 0.00 0.00 0.00 0.00 23.12 22.09 2poz s ALA 34 CO 0.01 0.65 0.47 0.20 0.00 0.00 0.00 175.76 177.10 2poz s GLY 35 N -2.16 -0.36 -0.07 0.00 0.00 -0.68 -3.11 107.32 100.95 2poz s GLY 35 Ca 0.22 0.51 0.01 0.00 0.00 0.00 0.00 44.72 45.47 2poz s GLY 35 CO 0.14 0.23 -0.09 1.85 0.00 0.00 0.00 173.10 175.24 2poz s GLU 36 N -2.29 1.42 0.15 2.90 2.12 -1.26 -0.41 118.70 121.33 2poz s GLU 36 Ca -0.06 -0.29 -0.30 0.00 0.36 0.00 0.00 54.97 54.68 2poz s GLU 36 Cb -0.01 -1.29 -0.07 0.00 0.26 0.00 0.00 34.13 33.02 2poz s GLU 36 CO -0.01 -0.07 1.03 0.00 -0.54 0.00 0.00 175.26 175.67 2poz s ALA 37 N 0.98 3.31 0.00 6.30 0.00 -0.54 -4.28 121.76 127.54 2poz s ALA 37 Ca -0.09 0.70 0.00 0.00 0.00 0.00 0.00 51.96 52.57 2poz s ALA 37 Cb -0.15 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.66 2poz s ALA 37 CO 0.00 -0.10 0.89 0.41 0.00 0.00 0.00 175.76 176.96 2poz n GLY 38 N 2.11 1.67 2.79 0.00 0.00 0.89 -4.31 105.19 108.34 2poz n GLY 38 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 2poz n GLY 38 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2poz n ILE 39 N 0.69 4.28 1.10 -0.61 2.08 -1.26 -4.74 119.36 120.90 2poz n ILE 39 Ca 0.00 -5.73 0.12 0.00 0.56 0.00 0.00 62.75 57.70 2poz n ILE 39 Cb 0.40 -1.54 0.30 0.00 -0.75 0.00 0.00 39.64 38.05 2poz n ILE 39 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2poz n ALA 40 N -0.02 3.36 -3.93 -1.39 0.00 -1.26 -4.36 120.51 112.91 2poz n ALA 40 Ca 0.37 -0.37 -0.17 0.00 0.00 0.00 0.00 53.44 53.26 2poz n ALA 40 Cb 0.34 -1.12 -0.05 0.00 0.00 0.00 0.00 19.45 18.61 2poz n ALA 40 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2poz n TYR 41 N -1.14 -0.68 -4.60 0.00 0.18 -1.26 -0.64 117.16 109.01 2poz n TYR 41 Ca 0.08 -2.09 0.00 0.00 1.88 0.00 0.00 57.90 57.77 2poz n TYR 41 Cb 0.34 0.25 0.00 0.00 -0.38 0.00 0.00 39.34 39.55 2poz n TYR 41 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2poz n GLY 42 N -0.48 -0.82 3.40 -7.48 0.00 -1.26 -4.70 105.19 93.86 2poz n GLY 42 Ca 0.05 -1.11 -0.35 0.00 0.00 0.00 0.00 46.02 44.62 2poz n GLY 42 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2poz s VAL 43 N 0.00 3.74 0.00 1.61 1.01 -1.26 -4.70 120.40 120.81 2poz s VAL 43 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.60 2poz s VAL 43 Cb 0.00 -2.69 0.00 0.00 0.00 0.00 0.00 36.38 33.69 2poz s VAL 43 CO 0.00 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.14 2poz n GLY 44 N 4.41 -0.71 0.18 4.51 0.00 -1.26 -5.04 105.19 107.27 2poz n GLY 44 Ca -0.17 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.80 2poz n GLY 44 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2poz h GLY 45 N 0.00 0.55 1.85 -0.02 0.00 -1.84 -0.60 103.07 103.01 2poz h GLY 45 Ca 0.00 -0.06 -0.06 0.00 0.00 0.00 0.00 47.33 47.21 2poz h GLY 45 CO 0.00 -0.01 -0.21 -0.84 0.00 0.00 0.00 176.54 175.48 2poz h THR 46 N 0.28 1.21 -0.49 4.70 2.02 -1.94 -2.12 112.91 116.56 2poz h THR 46 Ca 0.21 -0.96 -0.03 0.00 0.77 0.00 0.00 66.41 66.40 2poz h THR 46 Cb 0.23 1.36 -0.02 0.00 -1.74 0.00 0.00 68.15 67.98 2poz h THR 46 CO -0.24 0.29 0.20 0.00 0.37 0.00 0.00 175.52 176.14 2poz h ALA 47 N 1.61 0.64 -0.85 6.16 0.00 -1.62 -1.42 119.26 123.78 2poz h ALA 47 Ca 0.03 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2poz h ALA 47 Cb 0.48 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2poz h ALA 47 CO 0.03 0.24 0.46 0.00 0.00 0.00 0.00 179.25 179.99 2poz h ALA 48 N 1.04 1.22 -0.14 0.00 0.00 -0.52 -2.70 119.26 118.17 2poz h ALA 48 Ca 0.16 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2poz h ALA 48 Cb 0.19 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2poz h ALA 48 CO -0.01 0.63 0.00 0.00 0.00 0.00 0.00 179.25 179.87 2poz h ALA 49 N 1.32 0.18 0.00 0.00 0.00 -1.20 -1.85 119.26 117.71 2poz h ALA 49 Ca 0.30 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2poz h ALA 49 Cb 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2poz h ALA 49 CO -0.05 -0.13 0.00 0.41 0.00 0.00 0.00 179.25 179.49 2poz n GLY 50 N -0.32 0.00 0.33 0.00 0.00 -0.56 -1.16 105.19 103.49 2poz n GLY 50 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2poz n GLY 50 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2poz n ILE 52 N 0.82 0.00 -0.11 -0.61 5.41 -0.70 -1.20 119.36 122.98 2poz n ILE 52 Ca 0.00 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.63 2poz n ILE 52 Cb 0.00 0.00 -0.03 0.00 -0.71 0.00 0.00 39.64 38.90 2poz n ILE 52 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 2poz h LYS 53 N 0.00 0.65 -0.50 0.38 3.64 -1.41 -0.38 116.57 118.95 2poz h LYS 53 Ca 0.00 -0.27 -0.12 0.00 -1.27 0.00 0.00 60.65 58.98 2poz h LYS 53 Cb 0.00 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 2poz h LYS 53 CO 0.00 0.86 -0.16 -0.44 -2.27 0.00 0.00 179.45 177.43 2poz h ASP 54 N 0.42 1.00 -0.18 4.20 3.32 -1.42 -1.80 116.42 121.96 2poz h ASP 54 Ca 0.07 -0.35 -0.02 0.00 0.02 0.00 0.00 57.03 56.75 2poz h ASP 54 Cb 0.65 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 2poz h ASP 54 CO 0.04 1.14 0.03 -0.07 -1.72 0.00 0.00 179.24 178.66 2poz h LEU 55 N 0.86 0.28 0.13 1.55 3.38 -1.80 -2.44 115.31 117.27 2poz h LEU 55 Ca 0.12 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 57.85 2poz h LEU 55 Cb 0.73 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 2poz h LEU 55 CO 0.06 0.45 -0.17 0.28 0.09 0.00 0.00 178.44 179.15 2poz h SER 56 N 0.09 -0.46 0.14 -0.43 0.02 -0.99 0.16 113.55 112.08 2poz h SER 56 Ca 0.05 0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 61.03 2poz h SER 56 Cb 0.29 0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.00 2poz h SER 56 CO 0.00 -0.25 -0.12 -0.33 -1.14 0.00 0.00 176.83 174.99 2poz h GLU 57 N -0.35 0.00 0.02 3.45 5.08 -1.35 -1.84 114.58 119.59 2poz h GLU 57 Ca 0.01 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.06 2poz h GLU 57 Cb 0.35 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.55 2poz h GLU 57 CO -0.07 0.12 -1.88 -2.13 -1.00 0.00 0.00 179.01 174.05 2poz n ARG 58 N -4.28 0.66 0.00 2.33 3.00 -0.92 -4.76 116.66 112.69 2poz n ARG 58 Ca -0.03 0.24 0.00 0.00 -0.00 0.00 0.00 57.85 58.07 2poz n ARG 58 Cb 0.19 -1.73 0.00 0.00 0.00 0.00 0.00 32.46 30.92 2poz n ARG 58 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 2poz n PHE 59 N -3.09 0.00 -0.02 -0.14 3.72 0.55 -4.99 117.46 113.48 2poz n PHE 59 Ca -0.23 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.16 2poz n PHE 59 Cb 1.06 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.60 2poz n PHE 59 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2poz n LEU 60 N -1.40 0.48 -2.42 4.37 4.77 -0.70 -4.78 117.00 117.32 2poz n LEU 60 Ca 0.00 0.27 -0.35 0.00 -0.03 0.00 0.00 56.01 55.90 2poz n LEU 60 Cb 0.00 -0.59 -0.05 0.00 -2.33 0.00 0.00 43.42 40.45 2poz n LEU 60 CO 0.00 -0.48 0.60 -0.38 -1.33 0.00 0.00 177.39 175.80 2poz n ILE 61 N -2.92 0.00 -0.45 -0.08 -0.00 -1.24 0.09 119.36 114.76 2poz n ILE 61 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.73 2poz n ILE 61 Cb 0.09 -0.26 0.00 0.00 -0.00 0.00 0.00 39.64 39.47 2poz n ILE 61 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2poz n GLY 62 N 2.12 1.33 3.85 7.39 0.00 0.26 -4.96 105.19 115.18 2poz n GLY 62 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 2poz n GLY 62 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2poz s LYS 63 N -0.28 3.98 -0.32 1.61 -0.14 0.11 -4.55 119.74 120.15 2poz s LYS 63 Ca 0.00 0.59 -0.29 0.00 -1.36 0.00 0.00 55.97 54.91 2poz s LYS 63 Cb 0.00 -2.57 0.00 0.00 -1.68 0.00 0.00 37.83 33.58 2poz s LYS 63 CO 0.00 0.24 1.36 0.34 -0.76 0.00 0.00 175.35 176.53 2poz s ASP 64 N -2.19 6.57 0.17 2.83 2.15 -1.26 -0.96 116.67 123.98 2poz s ASP 64 Ca 0.50 1.16 0.18 0.00 0.43 0.00 0.00 52.55 54.82 2poz s ASP 64 Cb -0.11 -2.54 0.80 0.00 -0.30 0.00 0.00 42.92 40.77 2poz s ASP 64 CO 0.19 -1.18 1.55 -0.81 -0.17 0.00 0.00 175.17 174.75 2poz n PRO 65 N 7.52 0.11 0.23 4.34 -0.04 -1.26 -2.88 135.00 143.02 2poz n PRO 65 Ca 0.16 0.43 0.12 0.00 -0.04 0.00 0.00 63.50 64.17 2poz n PRO 65 Cb 0.47 -1.75 0.44 0.00 -0.04 0.00 0.00 33.50 32.63 2poz n PRO 65 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2poz h SER 66 N 0.00 0.00 -1.56 3.54 4.64 -1.90 -3.34 113.55 114.93 2poz h SER 66 Ca 0.00 0.00 -0.76 0.00 -0.47 0.00 0.00 61.79 60.56 2poz h SER 66 Cb 0.22 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 62.15 2poz h SER 66 CO 0.00 0.12 1.88 0.54 -0.87 0.00 0.00 176.83 178.50 2poz n ARG 67 N -3.21 3.62 0.10 4.77 1.74 -1.14 -4.79 116.66 117.75 2poz n ARG 67 Ca 0.01 -3.61 -0.13 0.00 -0.77 0.00 0.00 57.85 53.35 2poz n ARG 67 Cb 0.43 -2.93 -0.08 0.00 -1.02 0.00 0.00 32.46 28.86 2poz n ARG 67 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 2poz h ILE 68 N 3.86 0.91 -0.84 0.55 2.04 -1.86 -2.27 117.51 119.90 2poz h ILE 68 Ca 0.38 -0.59 0.12 0.00 1.00 0.00 0.00 64.86 65.77 2poz h ILE 68 Cb 0.66 1.26 -0.08 0.00 -0.74 0.00 0.00 36.82 37.92 2poz h ILE 68 CO 1.56 0.13 0.46 -0.33 0.00 0.00 0.00 178.15 179.97 2poz h GLU 69 N -0.55 0.69 -0.53 2.37 4.39 -1.95 -0.69 114.58 118.30 2poz h GLU 69 Ca -0.03 -0.04 -0.10 0.00 0.34 0.00 0.00 59.36 59.54 2poz h GLU 69 Cb 0.41 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.89 2poz h GLU 69 CO 0.04 0.45 -0.05 1.49 -1.16 0.00 0.00 179.01 179.79 2poz h GLU 70 N 0.71 0.96 -0.15 2.33 4.81 -1.95 -1.05 114.58 120.24 2poz h GLU 70 Ca 0.43 -0.33 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 2poz h GLU 70 Cb 0.52 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 2poz h GLU 70 CO -0.31 1.00 0.03 -0.07 -0.73 0.00 0.00 179.01 178.93 2poz h LEU 71 N 0.83 0.23 -0.15 1.64 4.07 -0.75 0.17 115.31 121.35 2poz h LEU 71 Ca 0.14 -0.26 0.03 0.00 0.08 0.00 0.00 57.88 57.87 2poz h LEU 71 Cb 0.60 -0.06 -0.03 0.00 1.08 0.00 0.00 40.66 42.25 2poz h LEU 71 CO 0.04 0.43 -0.03 -0.25 -1.08 0.00 0.00 178.44 177.55 2poz h TRP 72 N 0.03 -0.07 -0.91 1.13 7.01 -1.13 -2.39 115.95 119.62 2poz h TRP 72 Ca 0.05 0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.11 2poz h TRP 72 Cb 0.30 0.05 -0.06 0.00 -2.10 0.00 0.00 29.16 27.35 2poz h TRP 72 CO 0.02 -0.06 0.58 1.03 -2.79 0.00 0.00 178.44 177.22 2poz h SER 73 N 0.01 0.94 0.00 2.65 0.87 -1.03 -0.92 113.55 116.06 2poz h SER 73 Ca 0.07 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2poz h SER 73 Cb 0.10 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 61.86 2poz h SER 73 CO -0.15 0.63 0.00 0.41 -0.53 0.00 0.00 176.83 177.19 2poz n THR 74 N -4.55 0.15 0.00 2.23 -1.04 0.56 -0.93 114.28 110.70 2poz n THR 74 Ca 0.12 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.13 2poz n THR 74 Cb 0.13 -0.39 0.00 0.00 -1.82 0.00 0.00 70.33 68.25 2poz n THR 74 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2poz n TYR 76 N 0.58 0.00 -0.15 -1.42 9.36 -0.35 -0.99 117.16 124.19 2poz n TYR 76 Ca 0.00 0.00 -0.06 0.00 3.32 0.00 0.00 57.90 61.16 2poz n TYR 76 Cb 0.11 0.00 0.12 0.00 -0.63 0.00 0.00 39.34 38.94 2poz n TYR 76 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 2poz h ASP 77 N 0.00 0.86 -0.16 2.98 3.32 -1.29 -3.36 116.42 118.76 2poz h ASP 77 Ca 0.00 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 56.84 2poz h ASP 77 Cb 0.00 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.32 2poz h ASP 77 CO 0.00 0.91 0.00 1.41 -1.72 0.00 0.00 179.24 179.84 2poz n HIS 78 N -4.21 0.31 0.11 4.55 8.25 -0.16 -4.39 115.22 119.68 2poz n HIS 78 Ca 0.03 -0.62 0.11 0.00 -0.26 0.00 0.00 57.72 56.98 2poz n HIS 78 Cb 0.31 -0.09 -0.00 0.00 1.12 0.00 0.00 29.99 31.32 2poz n HIS 78 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2poz n SER 79 N -0.27 0.84 0.00 0.41 3.41 -1.26 -4.97 113.62 111.79 2poz n SER 79 Ca 0.10 0.32 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 2poz n SER 79 Cb 0.46 0.47 0.00 0.00 -0.26 0.00 0.00 64.21 64.88 2poz n SER 79 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2poz n PHE 80 N -2.66 0.00 1.61 7.33 7.35 -1.26 -4.64 117.46 125.19 2poz n PHE 80 Ca -0.00 0.00 0.14 0.00 -0.76 0.00 0.00 57.45 56.83 2poz n PHE 80 Cb 0.55 0.00 0.78 0.00 0.35 0.00 0.00 39.48 41.16 2poz n PHE 80 CO 0.00 0.00 0.00 0.91 -0.76 0.00 0.00 176.76 176.91 2poz n TRP 81 N 0.00 0.00 0.12 -5.13 7.02 -1.26 -3.24 117.44 114.95 2poz n TRP 81 Ca 0.00 0.00 0.01 0.00 -1.02 0.00 0.00 57.50 56.49 2poz n TRP 81 Cb 0.00 -0.08 -0.00 0.00 -2.42 0.00 0.00 31.31 28.81 2poz n TRP 81 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2poz h ALA 82 N 3.61 0.62 -1.98 6.99 0.00 -1.82 -3.26 119.26 123.41 2poz h ALA 82 Ca 0.00 -0.54 -0.57 0.00 0.00 0.00 0.00 54.91 53.80 2poz h ALA 82 Cb 0.07 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2poz h ALA 82 CO 0.00 0.73 1.12 0.15 0.00 0.00 0.00 179.25 181.25 2poz s LYS 83 N -2.92 3.74 -1.39 0.00 1.02 -1.20 -0.39 119.74 118.60 2poz s LYS 83 Ca 0.03 1.51 0.00 0.00 0.02 0.00 0.00 55.97 57.54 2poz s LYS 83 Cb 0.08 -4.03 0.00 0.00 -0.52 0.00 0.00 37.83 33.36 2poz s LYS 83 CO 0.76 -1.36 0.00 -1.71 -0.92 0.00 0.00 175.35 172.12 2poz n ASN 84 N 8.59 -4.71 -4.74 2.83 5.15 -1.26 -4.96 115.26 116.16 2poz n ASN 84 Ca 0.19 0.07 -0.32 0.00 -0.60 0.00 0.00 54.58 53.91 2poz n ASN 84 Cb 0.46 -3.78 0.10 0.00 -0.53 0.00 0.00 39.78 36.02 2poz n ASN 84 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 2poz s GLY 85 N -2.41 1.84 0.00 8.20 0.00 0.48 -5.07 107.32 110.36 2poz s GLY 85 Ca 0.00 0.45 0.00 0.00 0.00 0.00 0.00 44.72 45.17 2poz s GLY 85 CO 0.00 0.82 0.00 0.61 0.00 0.00 0.00 173.10 174.53 2poz n GLY 86 N -0.61 2.40 0.32 0.20 0.00 -1.26 -4.91 105.19 101.33 2poz n GLY 86 Ca 0.10 -2.08 0.07 0.00 0.00 0.00 0.00 46.02 44.11 2poz n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2poz h ALA 87 N -0.27 1.83 -0.03 4.61 0.00 -1.96 -2.64 119.26 120.79 2poz h ALA 87 Ca 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 2poz h ALA 87 Cb 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2poz h ALA 87 CO 0.00 0.12 -0.23 0.82 0.00 0.00 0.00 179.25 179.96 2poz h ILE 88 N 0.48 1.48 -0.13 0.00 1.08 -1.95 -1.35 117.51 117.13 2poz h ILE 88 Ca 0.19 -1.74 -0.11 0.00 -0.39 0.00 0.00 64.86 62.80 2poz h ILE 88 Cb 0.14 2.51 -0.01 0.00 -3.07 0.00 0.00 36.82 36.39 2poz h ILE 88 CO -0.05 0.48 -0.40 -0.29 -0.69 0.00 0.00 178.15 177.21 2poz h ILE 89 N -0.37 1.30 0.00 -0.67 2.10 -1.92 -2.31 117.51 115.64 2poz h ILE 89 Ca -0.02 -1.50 0.00 0.00 1.08 0.00 0.00 64.86 64.42 2poz h ILE 89 Cb 0.91 1.65 0.00 0.00 -1.09 0.00 0.00 36.82 38.29 2poz h ILE 89 CO 0.05 0.45 -0.55 -0.26 -1.08 0.00 0.00 178.15 176.76 2poz h PHE 90 N 0.23 0.00 -0.04 2.19 0.05 -1.55 -2.26 116.94 115.56 2poz h PHE 90 Ca 0.02 0.00 -0.23 0.00 3.82 0.00 0.00 57.97 61.58 2poz h PHE 90 Cb 0.81 0.00 0.01 0.00 2.00 0.00 0.00 35.95 38.77 2poz h PHE 90 CO 0.02 0.00 -0.91 0.00 -0.18 0.00 0.00 178.31 177.24 2poz h ALA 91 N 2.07 0.32 -0.07 2.45 0.00 -1.09 0.18 119.26 123.12 2poz h ALA 91 Ca 0.00 -0.67 -0.02 0.00 0.00 0.00 0.00 54.91 54.22 2poz h ALA 91 Cb 0.96 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 2poz h ALA 91 CO 0.00 0.74 -0.03 0.78 0.00 0.00 0.00 179.25 180.75 2poz h GLY 92 N 0.87 0.16 1.13 0.00 0.00 -1.44 -1.36 103.07 102.42 2poz h GLY 92 Ca -0.08 -0.14 -0.00 0.00 0.00 0.00 0.00 47.33 47.11 2poz h GLY 92 CO 0.17 0.13 0.54 -2.22 0.00 0.00 0.00 176.54 175.15 2poz h ILE 93 N -0.21 1.23 -0.46 2.60 2.04 -1.41 -2.43 117.51 118.87 2poz h ILE 93 Ca 0.02 -0.48 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 2poz h ILE 93 Cb 0.45 -0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.51 2poz h ILE 93 CO 0.01 0.24 0.24 0.28 0.00 0.00 0.00 178.15 178.92 2poz h SER 94 N 1.18 0.59 -0.11 1.72 0.02 -0.48 -0.04 113.55 116.43 2poz h SER 94 Ca 0.31 -0.10 0.01 0.00 -0.84 0.00 0.00 61.79 61.17 2poz h SER 94 Cb -0.08 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 2poz h SER 94 CO -0.06 0.53 0.03 0.00 -1.14 0.00 0.00 176.83 176.19 2poz h ALA 95 N 1.09 0.12 -0.18 3.77 0.00 -0.90 -0.98 119.26 122.18 2poz h ALA 95 Ca 0.16 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 2poz h ALA 95 Cb 0.08 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2poz h ALA 95 CO -0.02 -0.42 0.10 0.82 0.00 0.00 0.00 179.25 179.72 2poz h ILE 96 N 0.09 1.10 -0.85 0.00 2.04 -1.29 -2.65 117.51 115.96 2poz h ILE 96 Ca 0.05 -0.28 0.06 0.00 1.00 0.00 0.00 64.86 65.68 2poz h ILE 96 Cb 0.03 0.97 -0.06 0.00 -0.74 0.00 0.00 36.82 37.02 2poz h ILE 96 CO -0.05 0.10 0.52 -0.08 0.00 0.00 0.00 178.15 178.64 2poz h GLU 97 N 0.19 0.93 -0.57 2.37 4.22 -0.77 -1.42 114.58 119.52 2poz h GLU 97 Ca 0.06 -0.06 0.03 0.00 0.08 0.00 0.00 59.36 59.48 2poz h GLU 97 Cb 0.07 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 29.07 2poz h GLU 97 CO -0.01 0.62 0.33 1.96 -2.18 0.00 0.00 179.01 179.73 2poz h GLN 98 N 0.96 0.63 0.00 1.92 4.20 -0.97 -1.94 115.11 119.91 2poz h GLN 98 Ca 0.37 -0.04 -0.07 0.00 0.06 0.00 0.00 58.65 58.98 2poz h GLN 98 Cb 0.16 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 2poz h GLN 98 CO -0.17 0.42 -0.31 0.00 -0.67 0.00 0.00 178.83 178.09 2poz h ALA 99 N 1.27 1.39 -0.12 3.87 0.00 -1.00 -1.58 119.26 123.09 2poz h ALA 99 Ca 0.24 -0.28 -0.18 0.00 0.00 0.00 0.00 54.91 54.69 2poz h ALA 99 Cb 0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2poz h ALA 99 CO -0.12 0.39 -0.66 -0.07 0.00 0.00 0.00 179.25 178.79 2poz h LEU 100 N 0.00 0.54 -0.43 0.00 3.38 -0.55 -2.16 115.31 116.10 2poz h LEU 100 Ca -0.00 -0.33 -0.17 0.00 0.09 0.00 0.00 57.88 57.47 2poz h LEU 100 Cb 0.59 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 2poz h LEU 100 CO 0.04 1.06 -0.79 -0.50 0.09 0.00 0.00 178.44 178.34 2poz h TRP 101 N 0.34 0.03 -0.68 1.13 4.06 -1.10 -1.58 115.95 118.15 2poz h TRP 101 Ca -0.02 -0.02 -0.05 0.00 2.06 0.00 0.00 58.89 60.87 2poz h TRP 101 Cb 1.23 -0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 29.35 2poz h TRP 101 CO 0.05 0.80 0.24 0.22 -3.56 0.00 0.00 178.44 176.19 2poz h ASP 102 N 0.01 0.97 -0.04 -3.49 3.58 -1.18 0.42 116.42 116.70 2poz h ASP 102 Ca -0.01 -0.19 -0.01 0.00 0.42 0.00 0.00 57.03 57.23 2poz h ASP 102 Cb 1.39 -0.25 -0.00 0.00 1.72 0.00 0.00 39.33 42.19 2poz h ASP 102 CO 0.10 0.90 -0.03 0.40 -2.88 0.00 0.00 179.24 177.74 2poz h ILE 103 N 0.99 1.35 -0.69 2.25 2.04 -1.29 -1.89 117.51 120.27 2poz h ILE 103 Ca 0.22 -1.08 0.07 0.00 1.00 0.00 0.00 64.86 65.07 2poz h ILE 103 Cb 0.26 1.99 -0.04 0.00 -0.74 0.00 0.00 36.82 38.29 2poz h ILE 103 CO -0.01 0.29 0.45 0.50 0.00 0.00 0.00 178.15 179.38 2poz h LYS 104 N -0.33 0.64 -0.02 2.37 3.64 -1.10 -1.23 116.57 120.54 2poz h LYS 104 Ca 0.01 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 2poz h LYS 104 Cb 0.48 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.16 2poz h LYS 104 CO 0.01 0.42 -0.01 0.78 -2.27 0.00 0.00 179.45 178.38 2poz h GLY 105 N 0.66 0.04 0.71 5.01 0.00 -0.83 -2.80 103.07 105.86 2poz h GLY 105 Ca 0.30 -0.04 0.07 0.00 0.00 0.00 0.00 47.33 47.66 2poz h GLY 105 CO -0.10 0.04 0.60 0.50 0.00 0.00 0.00 176.54 177.58 2poz h LYS 106 N -0.42 1.04 -0.91 4.80 1.57 -0.85 0.19 116.57 121.99 2poz h LYS 106 Ca 0.00 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2poz h LYS 106 Cb 0.50 -0.24 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 2poz h LYS 106 CO 0.00 0.69 0.56 0.00 -0.57 0.00 0.00 179.45 180.13 2poz n LEU 108 N -4.40 1.57 -3.21 0.00 4.77 -0.67 -4.95 117.00 110.11 2poz n LEU 108 Ca 0.10 -0.57 -0.23 0.00 -0.03 0.00 0.00 56.01 55.28 2poz n LEU 108 Cb 0.05 -0.04 0.04 0.00 -2.33 0.00 0.00 43.42 41.14 2poz n LEU 108 CO 0.38 0.29 0.05 0.61 -1.33 0.00 0.00 177.39 177.38 2poz n GLY 109 N 1.16 -0.53 3.16 -0.72 0.00 0.57 -5.00 105.19 103.83 2poz n GLY 109 Ca 0.18 0.16 -0.10 0.00 0.00 0.00 0.00 46.02 46.26 2poz n GLY 109 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2poz s VAL 110 N -3.19 0.13 0.69 1.61 -7.23 -0.89 -4.78 120.40 106.73 2poz s VAL 110 Ca 0.39 -1.03 -0.17 0.00 -1.81 0.00 0.00 61.98 59.36 2poz s VAL 110 Cb -0.18 -0.98 0.01 0.00 0.56 0.00 0.00 36.38 35.80 2poz s VAL 110 CO 0.48 -0.57 1.24 -2.84 -0.31 0.00 0.00 175.10 173.10 2poz s PRO 111 N -2.79 2.34 0.48 4.82 0.02 -1.25 -1.00 135.00 137.63 2poz s PRO 111 Ca -0.03 1.90 0.13 0.00 0.02 0.00 0.00 61.00 63.01 2poz s PRO 111 Cb -0.00 -1.84 1.10 0.00 0.02 0.00 0.00 34.50 33.78 2poz s PRO 111 CO -0.05 -1.71 2.10 0.28 -0.33 0.00 0.00 177.00 177.29 2poz h VAL 112 N 0.12 1.05 0.00 3.83 2.07 -1.55 -1.59 116.25 120.18 2poz h VAL 112 Ca -0.49 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.89 2poz h VAL 112 Cb 1.31 0.87 -0.00 0.00 -1.52 0.00 0.00 31.29 31.96 2poz h VAL 112 CO 0.51 0.05 -0.04 0.10 0.02 0.00 0.00 177.57 178.22 2poz h TYR 113 N 0.18 0.00 -0.08 1.57 -0.00 -1.86 -1.10 116.97 115.68 2poz h TYR 113 Ca 0.05 0.00 -0.21 0.00 0.00 0.00 0.00 58.73 58.57 2poz h TYR 113 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.75 2poz h TYR 113 CO 0.00 0.04 -0.80 0.93 -0.00 0.00 0.00 178.16 178.33 2poz h GLU 114 N 0.00 0.53 -0.49 0.10 4.39 -1.56 0.99 114.58 118.54 2poz h GLU 114 Ca -0.00 -0.46 -0.09 0.00 0.34 0.00 0.00 59.36 59.15 2poz h GLU 114 Cb 0.32 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 2poz h GLU 114 CO 0.01 1.09 -0.04 -0.07 -1.16 0.00 0.00 179.01 178.83 2poz h LEU 115 N 0.35 0.82 0.00 1.33 3.38 -1.24 -2.64 115.31 117.30 2poz h LEU 115 Ca -0.05 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2poz h LEU 115 Cb 1.40 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2poz h LEU 115 CO 0.15 0.91 0.00 0.49 0.09 0.00 0.00 178.44 180.07 2poz n PHE 116 N -4.19 0.00 0.00 1.13 3.72 -0.67 -4.79 117.46 112.66 2poz n PHE 116 Ca 0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 2poz n PHE 116 Cb 0.33 -0.05 0.00 0.00 -0.94 0.00 0.00 39.48 38.82 2poz n PHE 116 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2poz n GLY 117 N 0.43 1.68 0.00 1.37 0.00 -1.01 -5.07 105.19 102.59 2poz n GLY 117 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2poz n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2poz n GLY 118 N -0.10 -0.05 3.98 -0.02 0.00 0.33 -4.99 105.19 104.34 2poz n GLY 118 Ca 0.00 -1.88 -0.20 0.00 0.00 0.00 0.00 46.02 43.94 2poz n GLY 118 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2poz s LYS 119 N -1.36 3.31 0.00 1.61 -2.85 -1.26 -4.44 119.74 114.74 2poz s LYS 119 Ca 0.00 -0.86 0.00 0.00 -1.00 0.00 0.00 55.97 54.11 2poz s LYS 119 Cb 0.00 -2.86 0.00 0.00 -2.06 0.00 0.00 37.83 32.91 2poz s LYS 119 CO 0.00 0.28 0.00 -0.89 0.10 0.00 0.00 175.35 174.84 2poz n ILE 120 N -1.51 0.00 -3.84 3.79 5.41 -0.02 -4.98 119.36 118.22 2poz n ILE 120 Ca -0.05 0.00 -0.11 0.00 1.00 0.00 0.00 62.75 63.58 2poz n ILE 120 Cb 0.57 0.37 -0.09 0.00 -0.71 0.00 0.00 39.64 39.79 2poz n ILE 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2poz s ARG 121 N -1.71 0.61 0.00 0.38 1.70 -1.24 -5.05 118.95 113.64 2poz s ARG 121 Ca 0.00 -0.48 0.22 0.00 -0.47 0.00 0.00 55.73 55.00 2poz s ARG 121 Cb 0.00 0.26 -0.09 0.00 -0.57 0.00 0.00 34.95 34.55 2poz s ARG 121 CO 0.00 -0.17 1.02 -0.25 -1.08 0.00 0.00 175.30 174.82 2poz n ASP 122 N 1.05 1.62 -3.50 -2.89 8.00 -1.26 -4.84 116.55 114.73 2poz n ASP 122 Ca -0.21 -1.31 -0.11 0.00 0.71 0.00 0.00 54.79 53.87 2poz n ASP 122 Cb 0.57 0.68 -0.02 0.00 -0.02 0.00 0.00 41.12 42.33 2poz n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2poz s ARG 123 N -2.68 1.34 0.02 -1.24 1.70 -1.26 -4.56 118.95 112.26 2poz s ARG 123 Ca 0.14 -0.56 0.02 0.00 -0.47 0.00 0.00 55.73 54.86 2poz s ARG 123 Cb 0.17 0.58 -0.01 0.00 -0.57 0.00 0.00 34.95 35.12 2poz s ARG 123 CO 0.69 -0.59 -0.07 0.14 -1.08 0.00 0.00 175.30 174.40 2poz s VAL 124 N -3.78 0.49 0.47 4.99 -7.23 -0.35 -4.95 120.40 110.04 2poz s VAL 124 Ca 0.03 -0.63 -0.19 0.00 -1.81 0.00 0.00 61.98 59.38 2poz s VAL 124 Cb -0.01 -0.48 -0.09 0.00 0.56 0.00 0.00 36.38 36.35 2poz s VAL 124 CO -0.10 -0.11 0.98 -0.60 -0.31 0.00 0.00 175.10 174.96 2poz s ARG 125 N -0.80 4.06 0.18 4.82 3.52 -1.26 -1.38 118.95 128.09 2poz s ARG 125 Ca -0.03 1.10 0.04 0.00 -0.13 0.00 0.00 55.73 56.71 2poz s ARG 125 Cb -0.06 -2.15 -0.05 0.00 -1.56 0.00 0.00 34.95 31.14 2poz s ARG 125 CO 0.00 -0.18 -0.06 0.00 -0.81 0.00 0.00 175.30 174.25 2poz s ALA 126 N -2.30 1.60 0.13 6.12 0.00 -0.46 -1.02 121.76 125.83 2poz s ALA 126 Ca 0.62 -1.60 0.09 0.00 0.00 0.00 0.00 51.96 51.06 2poz s ALA 126 Cb -0.10 0.23 -0.04 0.00 0.00 0.00 0.00 23.12 23.20 2poz s ALA 126 CO 0.20 -0.16 -0.15 1.52 0.00 0.00 0.00 175.76 177.17 2poz s TYR 127 N -3.36 2.59 -0.01 0.00 -0.85 0.14 -4.51 117.35 111.35 2poz s TYR 127 Ca 0.22 -0.24 -0.16 0.00 -0.52 0.00 0.00 57.07 56.37 2poz s TYR 127 Cb 0.04 -1.35 -0.06 0.00 0.38 0.00 0.00 41.96 40.98 2poz s TYR 127 CO 0.04 0.42 0.45 0.00 -1.52 0.00 0.00 175.55 174.94 2poz s ALA 128 N -1.28 3.63 0.01 9.51 0.00 -0.38 -2.03 121.76 131.23 2poz s ALA 128 Ca 0.20 -0.17 0.01 0.00 0.00 0.00 0.00 51.96 52.00 2poz s ALA 128 Cb -0.10 -2.48 -0.01 0.00 0.00 0.00 0.00 23.12 20.52 2poz s ALA 128 CO 0.12 0.37 -0.04 1.21 0.00 0.00 0.00 175.76 177.41 2poz s ASN 129 N -0.74 0.48 0.00 0.00 3.84 -0.18 -0.99 114.94 117.35 2poz s ASN 129 Ca 0.25 -0.27 0.00 0.00 0.21 0.00 0.00 52.86 53.05 2poz s ASN 129 Cb -0.17 0.01 0.00 0.00 -0.55 0.00 0.00 41.25 40.54 2poz s ASN 129 CO 0.14 -0.09 0.00 0.61 -2.79 0.00 0.00 177.10 174.97 2poz n GLY 130 N 2.33 0.58 0.11 1.21 0.00 -1.26 -4.08 105.19 104.08 2poz n GLY 130 Ca -0.17 -0.33 0.01 0.00 0.00 0.00 0.00 46.02 45.53 2poz n GLY 130 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 2poz h TRP 131 N 0.00 0.00 0.00 1.61 5.08 -1.87 -3.32 115.95 117.44 2poz h TRP 131 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2poz h TRP 131 Cb 0.00 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.16 2poz h TRP 131 CO 0.00 0.52 0.00 0.10 -1.28 0.00 0.00 178.44 177.78 2poz h TYR 132 N 0.00 0.00 0.00 0.12 -0.00 -1.90 -3.47 116.97 111.71 2poz h TYR 132 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.64 2poz h TYR 132 Cb 1.48 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.21 2poz h TYR 132 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 178.57 2poz n GLY 133 N -0.77 3.80 1.63 0.10 0.00 -1.25 -1.37 105.19 107.34 2poz n GLY 133 Ca -0.01 0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.14 2poz n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2poz n ALA 134 N 11.99 3.52 -1.64 4.61 0.00 -1.26 -5.01 120.51 132.71 2poz n ALA 134 Ca 0.00 -1.90 -0.42 0.00 0.00 0.00 0.00 53.44 51.12 2poz n ALA 134 Cb 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.44 2poz n ALA 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2poz n ALA 135 N 0.55 0.55 0.04 0.00 0.00 -0.47 -4.91 120.51 116.27 2poz n ALA 135 Ca 0.26 0.31 0.00 0.00 0.00 0.00 0.00 53.44 54.01 2poz n ALA 135 Cb 1.06 -2.14 0.00 0.00 0.00 0.00 0.00 19.45 18.37 2poz n ALA 135 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2poz n ASP 136 N 0.70 0.10 -4.83 0.00 2.03 -1.26 -4.95 116.55 108.34 2poz n ASP 136 Ca 0.08 0.13 -0.31 0.00 0.52 0.00 0.00 54.79 55.21 2poz n ASP 136 Cb 0.37 0.05 0.05 0.00 -0.72 0.00 0.00 41.12 40.87 2poz n ASP 136 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2poz s THR 137 N -2.00 3.94 0.22 5.18 -4.23 -1.26 -4.91 115.64 112.58 2poz s THR 137 Ca 0.00 0.63 -0.08 0.00 -1.18 0.00 0.00 61.69 61.06 2poz s THR 137 Cb 0.00 -3.42 0.17 0.00 1.34 0.00 0.00 72.50 70.59 2poz s THR 137 CO 0.00 -0.82 1.83 -0.65 -0.54 0.00 0.00 174.62 174.44 2poz h PRO 138 N -0.72 0.79 -0.49 3.99 0.11 -1.89 -2.08 132.00 131.70 2poz h PRO 138 Ca -0.44 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 65.56 2poz h PRO 138 Cb 1.22 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 2poz h PRO 138 CO 0.58 0.52 0.08 0.22 -0.21 0.00 0.00 178.00 179.20 2poz h ASP 139 N 0.82 0.72 0.23 -2.05 3.58 -1.92 -1.68 116.42 116.11 2poz h ASP 139 Ca 0.32 -0.14 -0.07 0.00 0.42 0.00 0.00 57.03 57.56 2poz h ASP 139 Cb 0.15 -0.19 -0.01 0.00 1.72 0.00 0.00 39.33 41.00 2poz h ASP 139 CO -0.16 0.74 -0.29 -0.33 -2.88 0.00 0.00 179.24 176.32 2poz h GLU 140 N 0.74 0.10 -0.20 0.28 5.08 -1.76 -1.57 114.58 117.24 2poz h GLU 140 Ca 0.16 -0.03 -0.20 0.00 -1.00 0.00 0.00 59.36 58.29 2poz h GLU 140 Cb 0.33 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.58 2poz h GLU 140 CO 0.00 0.38 -0.66 0.74 -1.00 0.00 0.00 179.01 178.48 2poz h PHE 141 N 0.09 1.05 -0.31 4.33 0.04 -0.91 -2.68 116.94 118.56 2poz h PHE 141 Ca 0.01 -0.43 0.02 0.00 2.80 0.00 0.00 57.97 60.37 2poz h PHE 141 Cb 0.56 -0.18 -0.02 0.00 2.20 0.00 0.00 35.95 38.51 2poz h PHE 141 CO 0.00 1.26 0.17 0.00 -0.60 0.00 0.00 178.31 179.14 2poz h ALA 142 N 0.59 0.38 -0.52 2.45 0.00 -0.92 -2.47 119.26 118.77 2poz h ALA 142 Ca -0.03 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2poz h ALA 142 Cb 1.28 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 2poz h ALA 142 CO 0.14 -0.21 0.31 0.00 0.00 0.00 0.00 179.25 179.49 2poz h ARG 143 N 0.35 0.69 0.00 0.00 2.47 -1.30 -2.67 114.38 113.93 2poz h ARG 143 Ca 0.12 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 58.79 2poz h ARG 143 Cb 0.02 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 28.19 2poz h ARG 143 CO -0.07 0.49 0.00 0.00 0.56 0.00 0.00 179.97 180.95 2poz h ALA 144 N 1.63 1.00 0.00 0.04 0.00 -1.09 -3.13 119.26 117.72 2poz h ALA 144 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2poz h ALA 144 Cb -0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2poz h ALA 144 CO -0.04 0.00 0.00 -0.39 0.00 0.00 0.00 179.25 178.82 2poz h VAL 145 N 0.00 0.00 0.59 0.00 -1.51 -1.38 -3.34 116.25 110.61 2poz h VAL 145 Ca 0.00 -0.67 -0.02 0.00 -1.23 0.00 0.00 66.70 64.77 2poz h VAL 145 Cb 0.46 1.65 -0.01 0.00 -2.13 0.00 0.00 31.29 31.25 2poz h VAL 145 CO 0.00 0.00 -0.48 -0.33 -1.23 0.00 0.00 177.57 175.53 2poz h GLU 146 N 0.00 -1.00 -0.11 5.19 5.08 -1.71 -2.79 114.58 119.24 2poz h GLU 146 Ca 0.00 0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.45 2poz h GLU 146 Cb 0.72 0.23 -0.04 0.00 0.50 0.00 0.00 28.75 30.15 2poz h GLU 146 CO 0.00 -0.67 -0.33 -0.09 -1.00 0.00 0.00 179.01 176.92 2poz h ARG 147 N -1.04 -0.32 -0.94 2.33 2.43 -1.81 -1.67 114.38 113.36 2poz h ARG 147 Ca -0.08 0.02 0.16 0.00 -0.81 0.00 0.00 59.98 59.27 2poz h ARG 147 Cb 0.87 0.07 -0.08 0.00 -0.42 0.00 0.00 29.97 30.41 2poz h ARG 147 CO 0.00 -0.21 0.60 -1.00 -1.51 0.00 0.00 179.97 177.85 2poz h PRO 148 N -0.33 0.72 -0.35 0.20 0.13 -1.75 -1.17 132.00 129.44 2poz h PRO 148 Ca 0.02 -0.04 -0.10 0.00 -0.87 0.00 0.00 66.00 65.01 2poz h PRO 148 Cb 0.40 -0.16 -0.02 0.00 0.13 0.00 0.00 31.00 31.35 2poz h PRO 148 CO -0.28 0.47 -0.20 -0.07 -0.23 0.00 0.00 178.00 177.69 2poz h LEU 149 N 0.74 0.67 -0.87 1.56 3.38 -1.16 -2.63 115.31 117.00 2poz h LEU 149 Ca 0.49 -0.22 -0.11 0.00 0.09 0.00 0.00 57.88 58.12 2poz h LEU 149 Cb 0.76 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 2poz h LEU 149 CO -0.25 0.87 -0.53 0.11 0.09 0.00 0.00 178.44 178.72 2poz h LYS 150 N 0.59 0.00 0.00 1.13 1.57 -0.31 -2.81 116.57 116.74 2poz h LYS 150 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2poz h LYS 150 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.98 2poz h LYS 150 CO 0.05 0.53 0.00 0.39 -0.57 0.00 0.00 179.45 179.85 2poz n GLU 151 N -3.79 0.74 0.00 3.15 1.02 -0.68 -4.86 120.64 116.21 2poz n GLU 151 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 2poz n GLU 151 Cb 0.56 -1.37 0.00 0.00 -0.02 0.00 0.00 31.44 30.61 2poz n GLU 151 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2poz n GLY 152 N 0.41 0.23 3.75 0.62 0.00 -1.06 -3.75 105.19 105.38 2poz n GLY 152 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 2poz n GLY 152 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2poz s TYR 153 N -2.00 3.22 -0.87 1.61 2.02 -1.02 -3.52 117.35 116.78 2poz s TYR 153 Ca 0.00 1.28 0.09 0.00 -0.37 0.00 0.00 57.07 58.07 2poz s TYR 153 Cb 0.00 -3.61 0.19 0.00 -0.40 0.00 0.00 41.96 38.14 2poz s TYR 153 CO 0.00 -1.84 1.07 0.41 -1.57 0.00 0.00 175.55 173.62 2poz n GLY 154 N 1.94 1.69 3.25 0.71 0.00 -1.26 -4.53 105.19 106.98 2poz n GLY 154 Ca 0.04 -0.29 -0.13 0.00 0.00 0.00 0.00 46.02 45.65 2poz n GLY 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2poz s ALA 155 N -0.92 -0.89 0.06 4.61 0.00 -1.26 -1.70 121.76 121.67 2poz s ALA 155 Ca 0.16 1.01 0.04 0.00 0.00 0.00 0.00 51.96 53.17 2poz s ALA 155 Cb 0.09 -0.58 -0.03 0.00 0.00 0.00 0.00 23.12 22.60 2poz s ALA 155 CO 0.12 -0.17 -0.11 -0.51 0.00 0.00 0.00 175.76 175.09 2poz s LEU 156 N 0.17 2.28 0.02 0.00 1.43 -0.22 -1.26 118.68 121.10 2poz s LEU 156 Ca -0.00 -0.60 0.04 0.00 -1.03 0.00 0.00 54.13 52.54 2poz s LEU 156 Cb -0.03 -0.36 -0.02 0.00 0.03 0.00 0.00 46.19 45.82 2poz s LEU 156 CO 0.01 -0.14 -0.14 -0.75 0.23 0.00 0.00 176.35 175.56 2poz s LYS 157 N -1.74 0.99 0.28 1.70 2.20 -0.16 -4.30 119.74 118.71 2poz s LYS 157 Ca -0.05 -0.63 -0.15 0.00 -0.36 0.00 0.00 55.97 54.78 2poz s LYS 157 Cb -0.10 -0.98 0.01 0.00 -1.51 0.00 0.00 37.83 35.25 2poz s LYS 157 CO 0.01 0.25 0.60 -0.59 -0.36 0.00 0.00 175.35 175.27 2poz s PHE 158 N -0.61 0.20 -0.55 4.03 -0.12 -1.26 -4.41 117.98 115.25 2poz s PHE 158 Ca 0.03 -0.63 0.02 0.00 -0.05 0.00 0.00 56.93 56.30 2poz s PHE 158 Cb -0.07 0.42 0.14 0.00 -0.63 0.00 0.00 43.02 42.88 2poz s PHE 158 CO 0.00 -1.16 0.32 0.71 -0.05 0.00 0.00 175.22 175.04 2poz s TYR 159 N -3.70 3.26 0.06 3.49 1.51 -1.26 -1.51 117.35 119.20 2poz s TYR 159 Ca 0.18 -3.03 0.30 0.00 -1.01 0.00 0.00 57.07 53.52 2poz s TYR 159 Cb -0.03 -2.94 1.57 0.00 -0.11 0.00 0.00 41.96 40.44 2poz s TYR 159 CO 0.10 -0.78 1.92 -1.00 -1.11 0.00 0.00 175.55 174.68 2poz h PRO 160 N 6.67 0.00 0.00 -1.71 0.13 -1.90 -2.54 132.00 132.65 2poz h PRO 160 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2poz h PRO 160 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 2poz h PRO 160 CO 0.69 0.00 -1.41 1.28 -0.23 0.00 0.00 178.00 178.33 2poz n LEU 161 N -2.59 0.48 -4.78 1.56 4.77 -1.26 -4.27 117.00 110.91 2poz n LEU 161 Ca -0.01 -0.12 -0.35 0.00 -0.03 0.00 0.00 56.01 55.50 2poz n LEU 161 Cb 0.10 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.14 2poz n LEU 161 CO 0.16 0.07 0.75 0.00 -1.33 0.00 0.00 177.39 177.04 2poz s ALA 162 N -3.28 2.76 0.00 -1.18 0.00 -0.96 -4.60 121.76 114.50 2poz s ALA 162 Ca -0.00 0.72 0.00 0.00 0.00 0.00 0.00 51.96 52.68 2poz s ALA 162 Cb 0.14 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.95 2poz s ALA 162 CO 0.86 -0.59 0.72 1.04 0.00 0.00 0.00 175.76 177.79 2poz n GLN 163 N -1.21 1.43 -3.43 0.00 1.13 -1.26 -4.99 117.38 109.06 2poz n GLN 163 Ca 0.11 -0.97 -0.39 0.00 -1.94 0.00 0.00 57.00 53.81 2poz n GLN 163 Cb 0.52 -0.79 -0.09 0.00 0.11 0.00 0.00 30.24 29.99 2poz n GLN 163 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2poz s LEU 169 N -0.50 4.07 -0.23 1.08 1.02 -1.26 -5.04 118.68 117.81 2poz s LEU 169 Ca 0.00 0.29 -0.08 0.00 0.02 0.00 0.00 54.13 54.36 2poz s LEU 169 Cb 0.00 -2.39 -0.04 0.00 0.02 0.00 0.00 46.19 43.78 2poz s LEU 169 CO 0.00 -0.13 0.10 -1.58 0.02 0.00 0.00 176.35 174.76 2poz s GLN 170 N 1.79 3.88 0.31 1.70 0.74 -1.26 -5.10 119.66 121.71 2poz s GLN 170 Ca 0.14 -0.37 -0.03 0.00 0.05 0.00 0.00 55.36 55.15 2poz s GLN 170 Cb -0.15 -3.37 0.07 0.00 1.10 0.00 0.00 33.01 30.65 2poz s GLN 170 CO 0.09 0.01 0.42 0.72 -0.55 0.00 0.00 175.29 175.98 2poz n HIS 171 N 4.36 -3.62 -1.73 1.67 8.25 -1.26 -4.52 115.22 118.37 2poz n HIS 171 Ca -0.16 -0.52 -0.42 0.00 -0.26 0.00 0.00 57.72 56.36 2poz n HIS 171 Cb 0.52 -0.31 -0.02 0.00 1.12 0.00 0.00 29.99 31.30 2poz n HIS 171 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2poz n VAL 172 N -2.29 0.95 -3.45 1.59 0.31 -1.26 -4.84 118.33 109.34 2poz n VAL 172 Ca 0.06 -0.24 -0.38 0.00 -0.01 0.00 0.00 64.34 63.77 2poz n VAL 172 Cb 0.21 -1.85 -0.08 0.00 -0.91 0.00 0.00 33.84 31.21 2poz n VAL 172 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2poz s THR 173 N 0.05 5.23 -1.50 2.52 2.01 -1.26 -4.43 115.64 118.26 2poz s THR 173 Ca 0.66 0.58 -0.14 0.00 0.31 0.00 0.00 61.69 63.09 2poz s THR 173 Cb -0.53 -3.67 0.12 0.00 0.01 0.00 0.00 72.50 68.42 2poz s THR 173 CO 0.48 0.27 0.70 0.54 -0.69 0.00 0.00 174.62 175.92 2poz n ARG 174 N 4.49 -3.61 -2.25 4.92 1.74 -1.26 -1.91 116.66 118.78 2poz n ARG 174 Ca -0.10 0.44 -0.10 0.00 -0.77 0.00 0.00 57.85 57.32 2poz n ARG 174 Cb 0.51 -5.19 -0.01 0.00 -1.02 0.00 0.00 32.46 26.75 2poz n ARG 174 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2poz n ARG 175 N -4.16 -2.19 -4.40 5.56 1.74 -1.26 -4.98 116.66 106.97 2poz n ARG 175 Ca 0.04 0.48 -0.21 0.00 -0.77 0.00 0.00 57.85 57.39 2poz n ARG 175 Cb 0.51 -4.99 -0.09 0.00 -1.02 0.00 0.00 32.46 26.87 2poz n ARG 175 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2poz s SER 176 N -1.99 1.99 0.30 0.55 0.01 -0.80 -3.29 113.70 110.46 2poz s SER 176 Ca 0.00 -1.52 0.07 0.00 1.31 0.00 0.00 55.95 55.81 2poz s SER 176 Cb 0.00 0.28 -0.03 0.00 0.21 0.00 0.00 66.02 66.48 2poz s SER 176 CO 0.00 -0.81 0.27 -0.94 0.41 0.00 0.00 173.24 172.17 2poz s SER 178 N -3.45 5.49 0.36 2.44 1.04 -1.26 -4.43 113.70 113.90 2poz s SER 178 Ca 0.33 -0.34 0.04 0.00 0.48 0.00 0.00 55.95 56.46 2poz s SER 178 Cb 0.06 -1.21 0.69 0.00 0.10 0.00 0.00 66.02 65.65 2poz s SER 178 CO 0.16 -0.22 1.97 0.00 0.98 0.00 0.00 173.24 176.12 2poz h ALA 179 N 1.31 1.52 -0.32 5.32 0.00 -2.05 -1.39 119.26 123.65 2poz h ALA 179 Ca -0.47 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.29 2poz h ALA 179 Cb 1.25 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 2poz h ALA 179 CO 0.59 0.38 0.02 0.93 0.00 0.00 0.00 179.25 181.17 2poz h GLU 180 N 0.62 0.55 -0.73 0.00 3.07 -2.05 -0.96 114.58 115.08 2poz h GLU 180 Ca 0.15 -0.17 -0.05 0.00 -0.50 0.00 0.00 59.36 58.80 2poz h GLU 180 Cb 0.09 -0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 27.91 2poz h GLU 180 CO -0.02 0.67 0.26 0.00 -1.40 0.00 0.00 179.01 178.52 2poz h ALA 181 N 0.86 1.09 -0.31 3.43 0.00 -1.85 0.15 119.26 122.64 2poz h ALA 181 Ca 0.09 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.67 2poz h ALA 181 Cb 0.40 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2poz h ALA 181 CO 0.01 0.64 -0.35 0.82 0.00 0.00 0.00 179.25 180.37 2poz h ILE 182 N 1.07 1.29 -0.54 0.00 2.04 -1.14 -0.21 117.51 120.01 2poz h ILE 182 Ca 0.24 -1.50 -0.07 0.00 1.00 0.00 0.00 64.86 64.53 2poz h ILE 182 Cb 0.24 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 2poz h ILE 182 CO -0.02 0.49 0.05 -0.08 0.00 0.00 0.00 178.15 178.59 2poz h GLU 183 N 0.58 0.93 -0.91 2.37 4.57 -0.74 -2.15 114.58 119.22 2poz h GLU 183 Ca 0.06 -0.27 -0.02 0.00 -1.18 0.00 0.00 59.36 57.95 2poz h GLU 183 Cb 0.87 -0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 29.32 2poz h GLU 183 CO 0.08 0.92 0.51 1.25 -1.18 0.00 0.00 179.01 180.59 2poz h LEU 184 N 0.81 1.13 -0.75 1.64 7.12 -0.36 -1.12 115.31 123.78 2poz h LEU 184 Ca 0.16 -0.09 0.00 0.00 0.13 0.00 0.00 57.88 58.08 2poz h LEU 184 Cb 0.47 -0.29 -0.04 0.00 -0.53 0.00 0.00 40.66 40.27 2poz h LEU 184 CO 0.02 0.90 0.48 0.00 -0.13 0.00 0.00 178.44 179.71 2poz h ALA 185 N 1.28 0.96 -0.29 1.25 0.00 -0.72 -0.57 119.26 121.17 2poz h ALA 185 Ca 0.32 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 2poz h ALA 185 Cb 0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 2poz h ALA 185 CO -0.05 0.40 0.08 -0.92 0.00 0.00 0.00 179.25 178.76 2poz h TYR 186 N 1.02 0.47 0.00 0.00 3.20 -0.79 -2.70 116.97 118.17 2poz h TYR 186 Ca 0.27 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 62.07 2poz h TYR 186 Cb -0.08 -0.13 -0.00 0.00 1.54 0.00 0.00 36.73 38.05 2poz h TYR 186 CO -0.02 0.50 -0.09 0.00 -1.64 0.00 0.00 178.16 176.92 2poz h ARG 187 N 0.30 0.00 -0.22 1.82 2.47 -0.80 -1.46 114.38 116.48 2poz h ARG 187 Ca 0.09 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 58.73 2poz h ARG 187 Cb 0.26 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.58 2poz h ARG 187 CO -0.00 0.09 -0.18 0.00 0.56 0.00 0.00 179.97 180.44 2poz h ARG 188 N 0.00 0.52 -0.40 0.04 3.08 -0.83 -0.04 114.38 116.75 2poz h ARG 188 Ca -0.00 -0.26 -0.04 0.00 0.07 0.00 0.00 59.98 59.76 2poz h ARG 188 Cb 0.16 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.20 2poz h ARG 188 CO 0.01 0.83 0.11 0.28 -1.07 0.00 0.00 179.97 180.13 2poz h VAL 189 N 0.21 1.22 -0.68 2.04 2.07 -1.14 -1.57 116.25 118.41 2poz h VAL 189 Ca 0.04 -0.75 -0.00 0.00 0.82 0.00 0.00 66.70 66.81 2poz h VAL 189 Cb 0.71 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 2poz h VAL 189 CO 0.05 0.26 0.42 0.50 0.02 0.00 0.00 177.57 178.82 2poz h LYS 190 N 0.51 0.92 -0.54 1.57 3.64 -1.25 -1.24 116.57 120.18 2poz h LYS 190 Ca 0.13 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 2poz h LYS 190 Cb 0.29 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 31.89 2poz h LYS 190 CO -0.00 0.65 0.34 0.00 -2.27 0.00 0.00 179.45 178.17 2poz h ALA 191 N 1.22 0.69 -0.29 5.00 0.00 -0.74 0.34 119.26 125.48 2poz h ALA 191 Ca 0.25 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2poz h ALA 191 Cb -0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2poz h ALA 191 CO -0.05 0.15 0.11 0.28 0.00 0.00 0.00 179.25 179.75 2poz h VAL 192 N 0.73 1.18 -0.65 0.00 2.07 -0.89 -1.25 116.25 117.44 2poz h VAL 192 Ca 0.20 -0.56 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 2poz h VAL 192 Cb -0.05 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 2poz h VAL 192 CO -0.04 0.19 0.32 -0.09 0.02 0.00 0.00 177.57 177.97 2poz h ARG 193 N 0.32 0.93 -0.62 1.57 9.65 -0.99 0.15 114.38 125.39 2poz h ARG 193 Ca 0.10 -0.13 -0.07 0.00 -1.10 0.00 0.00 59.98 58.78 2poz h ARG 193 Cb 0.19 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.58 2poz h ARG 193 CO -0.01 0.74 0.12 -0.44 2.80 0.00 0.00 179.97 183.18 2poz h ASP 194 N 0.89 0.97 1.00 -3.80 3.32 -0.78 -0.89 116.42 117.12 2poz h ASP 194 Ca 0.22 -0.25 -0.17 0.00 0.02 0.00 0.00 57.03 56.85 2poz h ASP 194 Cb 0.11 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 2poz h ASP 194 CO -0.03 0.97 -0.82 0.00 -1.72 0.00 0.00 179.24 177.64 2poz h ALA 195 N 1.04 0.55 0.02 3.45 0.00 -1.05 -3.29 119.26 119.98 2poz h ALA 195 Ca 0.19 -0.75 -0.24 0.00 0.00 0.00 0.00 54.91 54.12 2poz h ALA 195 Cb 0.40 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2poz h ALA 195 CO 0.01 1.02 -1.19 0.00 0.00 0.00 0.00 179.25 179.10 2poz h ALA 196 N 1.18 0.39 0.00 0.00 0.00 -0.64 -3.48 119.26 116.70 2poz h ALA 196 Ca -0.01 -1.02 0.00 0.00 0.00 0.00 0.00 54.91 53.89 2poz h ALA 196 Cb 1.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.33 2poz h ALA 196 CO 0.11 1.27 0.00 0.41 0.00 0.00 0.00 179.25 181.03 2poz n GLY 197 N 1.43 1.19 0.26 0.00 0.00 -0.35 -4.52 105.19 103.20 2poz n GLY 197 Ca -0.05 -1.91 0.17 0.00 0.00 0.00 0.00 46.02 44.23 2poz n GLY 197 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2poz h PRO 198 N 0.00 0.00 0.00 1.61 0.13 -1.92 -3.26 132.00 128.56 2poz h PRO 198 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2poz h PRO 198 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2poz h PRO 198 CO 0.00 0.00 -0.62 0.39 -0.23 0.00 0.00 178.00 177.54 2poz n GLU 199 N -2.91 0.28 -2.89 0.86 1.02 -1.26 -4.88 120.64 110.87 2poz n GLU 199 Ca 0.00 0.09 -0.40 0.00 -0.02 0.00 0.00 57.16 56.83 2poz n GLU 199 Cb 0.25 -1.68 -0.05 0.00 -0.02 0.00 0.00 31.44 29.93 2poz n GLU 199 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2poz s ILE 200 N -3.16 4.59 0.16 -3.67 -1.09 -1.23 -5.00 121.20 111.80 2poz s ILE 200 Ca 0.06 1.80 -0.29 0.00 -2.23 0.00 0.00 60.65 60.00 2poz s ILE 200 Cb 0.13 -4.19 -0.07 0.00 -1.58 0.00 0.00 42.46 36.75 2poz s ILE 200 CO 0.72 0.37 0.91 -1.61 -1.23 0.00 0.00 174.94 174.10 2poz s GLU 201 N -0.21 4.72 0.28 2.79 2.02 -0.69 -4.97 118.70 122.64 2poz s GLU 201 Ca 0.41 1.39 0.01 0.00 0.02 0.00 0.00 54.97 56.79 2poz s GLU 201 Cb -0.22 -3.32 -0.00 0.00 0.10 0.00 0.00 34.13 30.69 2poz s GLU 201 CO 0.26 0.39 0.03 1.28 0.02 0.00 0.00 175.26 177.23 2poz n LEU 202 N 2.13 0.00 -3.53 1.80 4.77 -1.26 -1.06 117.00 119.85 2poz n LEU 202 Ca -0.01 -1.86 -0.00 0.00 -0.03 0.00 0.00 56.01 54.11 2poz n LEU 202 Cb 0.48 0.34 -0.05 0.00 -2.33 0.00 0.00 43.42 41.86 2poz n LEU 202 CO 0.50 -0.27 0.62 -0.69 -1.33 0.00 0.00 177.39 176.22 2poz s VAL 204 N -2.19 -0.29 -0.25 4.08 1.01 -0.85 -0.41 120.40 121.51 2poz s VAL 204 Ca 0.04 0.00 -0.07 0.00 0.00 0.00 0.00 61.98 61.95 2poz s VAL 204 Cb 0.00 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 2poz s VAL 204 CO 0.03 0.00 0.06 -0.62 0.00 0.00 0.00 175.10 174.56 2poz s ASP 205 N 1.95 5.01 0.00 3.32 -1.08 -0.57 0.28 116.67 125.58 2poz s ASP 205 Ca -0.06 -0.26 0.23 0.00 -0.52 0.00 0.00 52.55 51.95 2poz s ASP 205 Cb -0.05 -1.90 0.16 0.00 -1.46 0.00 0.00 42.92 39.67 2poz s ASP 205 CO -0.16 -0.04 1.17 0.18 0.52 0.00 0.00 175.17 176.84 2poz n LEU 206 N 4.90 0.77 -4.28 -1.34 4.77 -0.30 -4.35 117.00 117.17 2poz n LEU 206 Ca -0.16 -0.25 -0.36 0.00 -0.03 0.00 0.00 56.01 55.20 2poz n LEU 206 Cb 0.51 -0.13 -0.05 0.00 -2.33 0.00 0.00 43.42 41.43 2poz n LEU 206 CO 0.31 0.19 -0.13 -0.24 -1.33 0.00 0.00 177.39 176.19 2poz n SER 207 N -1.45 -2.21 0.00 -1.43 2.88 -1.22 -1.08 113.62 109.11 2poz n SER 207 Ca 0.05 -1.10 0.00 0.00 -1.33 0.00 0.00 58.87 56.50 2poz n SER 207 Cb 0.34 -2.40 0.00 0.00 -0.75 0.00 0.00 64.21 61.40 2poz n SER 207 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2poz n GLY 208 N -1.49 1.04 7.00 0.46 0.00 0.13 -4.87 105.19 107.46 2poz n GLY 208 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2poz n GLY 208 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2poz n GLY 209 N -0.00 1.08 0.00 -0.02 0.00 -0.24 -2.80 105.19 103.22 2poz n GLY 209 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.43 2poz n GLY 209 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2poz n LEU 210 N 0.00 0.00 -4.87 0.99 4.77 -1.26 -4.62 117.00 112.01 2poz n LEU 210 Ca 0.00 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.67 2poz n LEU 210 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2poz n LEU 210 CO 0.00 0.00 0.68 0.42 -1.33 0.00 0.00 177.39 177.16 2poz s THR 211 N 2.70 4.71 0.22 -5.08 -4.23 -1.21 -4.82 115.64 107.93 2poz s THR 211 Ca 0.00 0.85 -0.11 0.00 -1.18 0.00 0.00 61.69 61.25 2poz s THR 211 Cb 0.00 -3.85 0.22 0.00 1.34 0.00 0.00 72.50 70.21 2poz s THR 211 CO 0.00 -1.05 1.65 0.74 -0.54 0.00 0.00 174.62 175.42 2poz h THR 212 N -0.07 0.43 0.17 3.99 2.02 -1.96 -0.93 112.91 116.56 2poz h THR 212 Ca -0.45 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 66.70 2poz h THR 212 Cb 1.19 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.95 2poz h THR 212 CO 0.62 0.01 -0.08 -2.24 0.37 0.00 0.00 175.52 174.20 2poz h ASP 213 N 0.08 -0.20 0.34 4.18 2.03 -2.00 -1.62 116.42 119.22 2poz h ASP 213 Ca 0.33 -0.01 -0.08 0.00 -0.73 0.00 0.00 57.03 56.53 2poz h ASP 213 Cb 0.53 0.05 -0.01 0.00 -0.83 0.00 0.00 39.33 39.07 2poz h ASP 213 CO -0.58 -0.12 -0.37 -0.33 -1.03 0.00 0.00 179.24 176.81 2poz h GLU 214 N -0.26 0.04 -0.38 4.15 4.39 -1.89 -1.89 114.58 118.74 2poz h GLU 214 Ca -0.02 -0.02 -0.06 0.00 0.34 0.00 0.00 59.36 59.60 2poz h GLU 214 Cb 0.20 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.83 2poz h GLU 214 CO 0.04 0.41 -0.01 1.15 -1.16 0.00 0.00 179.01 179.44 2poz h THR 215 N 0.04 1.26 -0.53 1.13 2.02 -0.99 -0.99 112.91 114.86 2poz h THR 215 Ca 0.00 -1.01 -0.00 0.00 0.77 0.00 0.00 66.41 66.17 2poz h THR 215 Cb 0.67 1.16 -0.03 0.00 -1.74 0.00 0.00 68.15 68.21 2poz h THR 215 CO 0.05 0.34 0.32 0.40 0.37 0.00 0.00 175.52 177.00 2poz h ILE 216 N 0.50 1.16 -0.22 3.11 2.04 -0.97 -0.65 117.51 122.47 2poz h ILE 216 Ca 0.11 -0.35 0.02 0.00 1.00 0.00 0.00 64.86 65.65 2poz h ILE 216 Cb 0.48 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 2poz h ILE 216 CO 0.02 0.16 0.06 -0.09 0.00 0.00 0.00 178.15 178.30 2poz h ARG 217 N 0.71 0.15 -0.17 2.37 2.43 -1.15 -1.07 114.38 117.64 2poz h ARG 217 Ca 0.19 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.34 2poz h ARG 217 Cb -0.02 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 2poz h ARG 217 CO -0.04 0.10 0.07 0.35 -1.51 0.00 0.00 179.97 178.94 2poz h PHE 218 N 0.15 0.27 -0.98 2.20 3.57 -0.89 -1.68 116.94 119.58 2poz h PHE 218 Ca 0.10 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.63 2poz h PHE 218 Cb 0.08 -0.08 -0.06 0.00 2.79 0.00 0.00 35.95 38.68 2poz h PHE 218 CO -0.13 0.34 0.63 0.00 -2.23 0.00 0.00 178.31 176.92 2poz h ARG 220 N 1.17 0.85 -0.41 0.00 3.08 -1.05 -2.37 114.38 115.65 2poz h ARG 220 Ca 0.41 -0.31 -0.05 0.00 0.07 0.00 0.00 59.98 60.10 2poz h ARG 220 Cb 0.12 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.09 2poz h ARG 220 CO -0.16 0.95 0.06 -0.22 -1.07 0.00 0.00 179.97 179.53 2poz h LYS 221 N 0.75 0.62 -0.08 0.04 3.64 -0.31 -2.30 116.57 118.93 2poz h LYS 221 Ca 0.12 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2poz h LYS 221 Cb 0.67 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 2poz h LYS 221 CO 0.05 0.60 0.00 0.44 -2.27 0.00 0.00 179.45 178.26 2poz n ILE 222 N -4.29 0.09 -0.33 2.00 -5.35 -0.79 -4.28 119.36 106.41 2poz n ILE 222 Ca 0.02 -0.36 0.06 0.00 -0.27 0.00 0.00 62.75 62.20 2poz n ILE 222 Cb 0.22 0.68 0.24 0.00 -1.74 0.00 0.00 39.64 39.05 2poz n ILE 222 CO 0.00 0.00 0.00 1.23 -1.76 0.00 0.00 176.55 176.02 2poz h GLY 223 N 4.84 1.45 1.89 3.28 0.00 -0.87 0.49 103.07 114.15 2poz h GLY 223 Ca 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.91 2poz h GLY 223 CO 0.00 0.24 0.00 1.18 0.00 0.00 0.00 176.54 177.96 2poz n GLU 224 N -4.54 0.05 -0.12 4.80 4.71 -1.26 -2.37 120.64 121.92 2poz n GLU 224 Ca 0.16 0.24 0.09 0.00 -0.01 0.00 0.00 57.16 57.65 2poz n GLU 224 Cb 0.27 -1.50 0.31 0.00 -1.01 0.00 0.00 31.44 29.51 2poz n GLU 224 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2poz n LEU 225 N -1.44 1.94 -3.12 -4.62 4.77 0.16 -4.98 117.00 109.71 2poz n LEU 225 Ca 0.04 -0.86 -0.04 0.00 -0.03 0.00 0.00 56.01 55.12 2poz n LEU 225 Cb 0.14 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 2poz n LEU 225 CO 0.12 0.43 0.24 -0.67 -1.33 0.00 0.00 177.39 176.18 2poz n ASP 226 N 0.51 -7.49 -4.75 -1.43 2.03 -1.00 -4.97 116.55 99.46 2poz n ASP 226 Ca 0.16 -0.09 -0.38 0.00 0.52 0.00 0.00 54.79 55.00 2poz n ASP 226 Cb 0.35 -4.90 -0.06 0.00 -0.72 0.00 0.00 41.12 35.80 2poz n ASP 226 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2poz s ILE 227 N -2.92 5.09 0.11 5.18 -1.09 -1.26 -4.56 121.20 121.75 2poz s ILE 227 Ca 0.04 1.02 -0.19 0.00 -2.23 0.00 0.00 60.65 59.29 2poz s ILE 227 Cb -0.01 -3.84 -0.06 0.00 -1.58 0.00 0.00 42.46 36.98 2poz s ILE 227 CO 0.77 0.38 1.69 0.00 -1.23 0.00 0.00 174.94 176.56 2poz s PHE 229 N -5.75 -0.23 -0.16 0.00 -0.12 -1.25 -4.44 117.98 106.03 2poz s PHE 229 Ca -0.13 0.16 -0.02 0.00 -0.05 0.00 0.00 56.93 56.89 2poz s PHE 229 Cb 0.08 0.52 -0.02 0.00 -0.63 0.00 0.00 43.02 42.98 2poz s PHE 229 CO 0.71 -0.36 -0.09 0.54 -0.05 0.00 0.00 175.22 175.98 2poz s VAL 230 N -2.66 3.33 -0.09 -2.49 0.11 -0.05 -2.00 120.40 116.54 2poz s VAL 230 Ca 0.07 -0.55 -0.13 0.00 -2.93 0.00 0.00 61.98 58.44 2poz s VAL 230 Cb -0.01 -2.45 -0.05 0.00 -1.53 0.00 0.00 36.38 32.35 2poz s VAL 230 CO -0.06 0.49 0.31 -0.70 -3.33 0.00 0.00 175.10 171.81 2poz s GLU 231 N 0.65 3.95 -1.10 1.54 2.12 0.14 -1.60 118.70 124.39 2poz s GLU 231 Ca -0.05 0.18 -0.24 0.00 0.36 0.00 0.00 54.97 55.22 2poz s GLU 231 Cb -0.15 -3.29 0.03 0.00 0.26 0.00 0.00 34.13 30.97 2poz s GLU 231 CO 0.03 0.53 0.68 0.39 -0.54 0.00 0.00 175.26 176.35 2poz n GLU 232 N 2.55 -0.70 0.00 4.30 1.02 -0.35 -1.15 120.64 126.30 2poz n GLU 232 Ca -0.14 0.32 0.04 0.00 -0.02 0.00 0.00 57.16 57.36 2poz n GLU 232 Cb 0.53 -2.78 0.21 0.00 -0.02 0.00 0.00 31.44 29.37 2poz n GLU 232 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 2poz n PRO 233 N -4.30 0.04 -3.88 3.49 -0.04 -1.26 -0.70 135.00 128.36 2poz n PRO 233 Ca -0.15 0.30 -0.09 0.00 -0.04 0.00 0.00 63.50 63.51 2poz n PRO 233 Cb 0.59 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.50 2poz n PRO 233 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2poz n ASP 235 N -0.29 2.92 0.24 0.00 -0.08 -1.12 -4.32 116.55 113.90 2poz n ASP 235 Ca -0.08 1.06 0.17 0.00 -1.51 0.00 0.00 54.79 54.44 2poz n ASP 235 Cb 0.63 -1.37 0.80 0.00 2.34 0.00 0.00 41.12 43.52 2poz n ASP 235 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2poz h PRO 236 N 6.50 0.00 0.00 -0.67 0.11 -1.94 -0.13 132.00 135.88 2poz h PRO 236 Ca -0.46 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.54 2poz h PRO 236 Cb 1.27 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.37 2poz h PRO 236 CO 0.89 0.00 -0.52 0.35 -0.21 0.00 0.00 178.00 178.51 2poz h PHE 237 N 0.00 0.00 -3.75 0.65 -0.00 -1.94 -3.41 116.94 108.49 2poz h PHE 237 Ca 0.08 0.00 -0.76 0.00 -0.00 0.00 0.00 57.97 57.28 2poz h PHE 237 Cb 0.79 0.00 -0.29 0.00 -0.00 0.00 0.00 35.95 36.46 2poz h PHE 237 CO 0.00 0.52 -0.03 0.34 -0.00 0.00 0.00 178.31 179.14 2poz s ASP 238 N -6.57 6.35 0.46 0.41 -1.08 -0.06 -4.89 116.67 111.28 2poz s ASP 238 Ca 0.00 -2.75 0.26 0.00 -0.52 0.00 0.00 52.55 49.54 2poz s ASP 238 Cb 0.11 -2.11 0.92 0.00 -1.46 0.00 0.00 42.92 40.37 2poz s ASP 238 CO 0.73 -0.51 1.82 0.78 0.52 0.00 0.00 175.17 178.50 2poz h ASN 239 N 7.56 0.00 -0.43 -0.34 2.35 -1.81 -2.97 115.58 119.94 2poz h ASN 239 Ca 0.08 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.76 2poz h ASN 239 Cb 1.02 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.37 2poz h ASN 239 CO 0.74 0.16 0.00 1.23 -1.65 0.00 0.00 177.43 177.92 2poz h GLY 240 N 2.35 0.82 0.99 2.83 0.00 -1.96 -2.23 103.07 105.86 2poz h GLY 240 Ca -0.00 -0.60 -0.04 0.00 0.00 0.00 0.00 47.33 46.69 2poz h GLY 240 CO 0.02 0.55 0.18 0.00 0.00 0.00 0.00 176.54 177.30 2poz h ALA 241 N 0.90 0.71 -0.56 3.60 0.00 -1.93 -1.89 119.26 120.09 2poz h ALA 241 Ca 0.12 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 54.93 2poz h ALA 241 Cb 0.49 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 2poz h ALA 241 CO 0.02 0.36 0.21 1.25 0.00 0.00 0.00 179.25 181.09 2poz h LEU 242 N 0.75 0.21 -0.17 0.00 5.85 -1.36 0.24 115.31 120.83 2poz h LEU 242 Ca 0.18 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.95 2poz h LEU 242 Cb 0.26 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 2poz h LEU 242 CO -0.01 0.14 0.04 0.50 -0.34 0.00 0.00 178.44 178.77 2poz h LYS 243 N 0.39 0.27 -0.63 1.25 3.64 -1.12 -1.35 116.57 119.01 2poz h LYS 243 Ca 0.27 -0.07 0.03 0.00 -1.27 0.00 0.00 60.65 59.62 2poz h LYS 243 Cb 0.31 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.06 2poz h LYS 243 CO -0.28 0.41 0.38 0.28 -2.27 0.00 0.00 179.45 177.98 2poz h VAL 244 N 0.08 1.05 -0.44 2.00 2.07 -0.71 -2.35 116.25 117.96 2poz h VAL 244 Ca 0.05 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 2poz h VAL 244 Cb 0.26 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.26 2poz h VAL 244 CO 0.00 0.13 0.22 0.40 0.02 0.00 0.00 177.57 178.35 2poz h ILE 245 N 0.74 1.17 0.00 4.57 2.04 -0.41 -2.47 117.51 123.14 2poz h ILE 245 Ca 0.26 -0.46 -0.01 0.00 1.00 0.00 0.00 64.86 65.65 2poz h ILE 245 Cb 0.06 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 36.81 2poz h ILE 245 CO -0.12 0.18 -0.03 0.77 0.00 0.00 0.00 178.15 178.96 2poz h SER 246 N 0.57 0.00 1.62 1.72 4.64 -0.79 -0.56 113.55 120.75 2poz h SER 246 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2poz h SER 246 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2poz h SER 246 CO -0.02 0.03 -0.25 -0.33 -0.87 0.00 0.00 176.83 175.39 2poz h GLU 247 N 0.00 0.00 -0.01 4.77 5.08 -1.01 -3.36 114.58 120.05 2poz h GLU 247 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2poz h GLU 247 Cb 0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.31 2poz h GLU 247 CO 0.00 0.00 -0.36 1.04 -1.00 0.00 0.00 179.01 178.69 2poz n GLN 248 N -2.79 1.88 -4.40 2.33 1.13 -0.31 -5.01 117.38 110.21 2poz n GLN 248 Ca 0.03 -0.63 -0.28 0.00 -1.94 0.00 0.00 57.00 54.18 2poz n GLN 248 Cb 0.51 -1.22 -0.12 0.00 0.11 0.00 0.00 30.24 29.52 2poz n GLN 248 CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 2poz s ILE 249 N -1.86 2.37 -2.20 5.09 -4.36 -0.68 -4.95 121.20 114.62 2poz s ILE 249 Ca 0.11 -1.91 0.28 0.00 -0.26 0.00 0.00 60.65 58.87 2poz s ILE 249 Cb 0.12 -2.11 0.69 0.00 1.25 0.00 0.00 42.46 42.41 2poz s ILE 249 CO 0.40 -0.04 1.93 -0.81 0.24 0.00 0.00 174.94 176.66 2poz n PRO 250 N 0.49 1.31 -3.76 0.37 -0.04 -1.26 -4.88 135.00 127.22 2poz n PRO 250 Ca -0.14 -0.45 -0.37 0.00 -0.04 0.00 0.00 63.50 62.50 2poz n PRO 250 Cb 0.55 -1.46 -0.06 0.00 -0.04 0.00 0.00 33.50 32.49 2poz n PRO 250 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2poz s LEU 251 N -1.90 4.41 0.45 1.53 1.43 -1.26 -5.07 118.68 118.26 2poz s LEU 251 Ca 0.40 0.60 -0.23 0.00 -1.03 0.00 0.00 54.13 53.88 2poz s LEU 251 Cb 0.20 -2.22 -0.08 0.00 0.03 0.00 0.00 46.19 44.12 2poz s LEU 251 CO 0.33 0.38 1.15 -2.84 0.23 0.00 0.00 176.35 175.60 2poz s PRO 252 N -0.99 3.81 0.06 1.29 0.02 -1.26 -4.84 135.00 133.09 2poz s PRO 252 Ca 0.17 1.75 0.05 0.00 0.02 0.00 0.00 61.00 63.00 2poz s PRO 252 Cb -0.13 -2.43 -0.04 0.00 0.02 0.00 0.00 34.50 31.92 2poz s PRO 252 CO 0.06 -0.50 -0.08 0.42 -0.33 0.00 0.00 177.00 176.57 2poz s ILE 253 N -1.55 3.50 -0.02 2.83 1.01 -1.26 -0.88 121.20 124.83 2poz s ILE 253 Ca 0.63 -1.05 0.02 0.00 0.00 0.00 0.00 60.65 60.25 2poz s ILE 253 Cb -0.28 -2.59 0.01 0.00 0.01 0.00 0.00 42.46 39.61 2poz s ILE 253 CO 0.34 0.23 -0.07 0.00 0.00 0.00 0.00 174.94 175.45 2poz s ALA 254 N -1.12 0.68 0.26 9.38 0.00 -0.63 -2.35 121.76 127.98 2poz s ALA 254 Ca 0.20 -0.23 -0.06 0.00 0.00 0.00 0.00 51.96 51.87 2poz s ALA 254 Cb -0.11 -0.27 -0.01 0.00 0.00 0.00 0.00 23.12 22.72 2poz s ALA 254 CO 0.11 0.10 0.37 0.14 0.00 0.00 0.00 175.76 176.48 2poz s VAL 255 N 0.25 0.00 0.00 0.00 -7.23 -1.01 -1.22 120.40 111.19 2poz s VAL 255 Ca -0.03 -1.65 0.00 0.00 -1.81 0.00 0.00 61.98 58.49 2poz s VAL 255 Cb -0.08 -2.40 0.00 0.00 0.56 0.00 0.00 36.38 34.46 2poz s VAL 255 CO 0.00 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 2poz n GLY 256 N -0.40 1.26 0.39 2.32 0.00 -1.26 0.31 105.19 107.81 2poz n GLY 256 Ca 0.00 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.22 2poz n GLY 256 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2poz h GLU 257 N 0.00 0.18 -0.60 1.61 4.81 -1.86 -2.45 114.58 116.27 2poz h GLU 257 Ca 0.00 -0.01 -0.44 0.00 -0.13 0.00 0.00 59.36 58.78 2poz h GLU 257 Cb 0.00 -0.04 -0.37 0.00 0.63 0.00 0.00 28.75 28.97 2poz h GLU 257 CO 0.00 0.12 -0.82 0.54 -0.73 0.00 0.00 179.01 178.12 2poz n ARG 258 N -4.41 3.07 -5.05 1.92 1.74 -1.26 -4.81 116.66 107.85 2poz n ARG 258 Ca 0.13 -3.94 -0.28 0.00 -0.77 0.00 0.00 57.85 52.99 2poz n ARG 258 Cb 0.62 -2.07 -0.15 0.00 -1.02 0.00 0.00 32.46 29.83 2poz n ARG 258 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2poz s VAL 259 N -4.24 1.77 -0.06 1.55 1.01 -0.92 -4.99 120.40 114.52 2poz s VAL 259 Ca 0.46 -1.00 0.03 0.00 0.00 0.00 0.00 61.98 61.47 2poz s VAL 259 Cb 0.39 -1.47 0.01 0.00 0.00 0.00 0.00 36.38 35.31 2poz s VAL 259 CO 0.01 0.46 -0.13 -0.31 0.00 0.00 0.00 175.10 175.13 2poz s TYR 260 N -0.56 1.48 0.28 5.22 1.51 -1.26 -4.62 117.35 119.40 2poz s TYR 260 Ca 0.09 -0.50 0.00 0.00 -1.01 0.00 0.00 57.07 55.64 2poz s TYR 260 Cb -0.09 -1.06 0.00 0.00 -0.11 0.00 0.00 41.96 40.71 2poz s TYR 260 CO -0.00 -0.23 0.00 0.25 -1.11 0.00 0.00 175.55 174.45 2poz n THR 261 N 3.58 0.00 -0.33 -0.71 -2.24 -0.50 -1.47 114.28 112.62 2poz n THR 261 Ca -0.21 0.18 -0.01 0.00 -2.27 0.00 0.00 64.05 61.74 2poz n THR 261 Cb 0.52 -0.50 0.16 0.00 -2.10 0.00 0.00 70.33 68.41 2poz n THR 261 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2poz h ARG 262 N -0.91 1.20 -0.81 -0.78 3.08 -1.85 -1.07 114.38 113.24 2poz h ARG 262 Ca -0.02 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 2poz h ARG 262 Cb 0.89 -0.27 -0.04 0.00 0.08 0.00 0.00 29.97 30.63 2poz h ARG 262 CO 0.02 0.79 0.44 0.74 -1.07 0.00 0.00 179.97 180.90 2poz h PHE 263 N 1.24 1.09 -0.07 3.04 0.05 -1.99 0.14 116.94 120.44 2poz h PHE 263 Ca 0.35 -0.02 -0.15 0.00 3.82 0.00 0.00 57.97 61.97 2poz h PHE 263 Cb -0.11 -0.35 0.01 0.00 2.00 0.00 0.00 35.95 37.49 2poz h PHE 263 CO -0.00 0.76 -0.54 0.78 -0.18 0.00 0.00 178.31 179.13 2poz h GLY 264 N 1.15 0.54 2.00 -1.45 0.00 -0.53 -3.26 103.07 101.52 2poz h GLY 264 Ca 0.28 -0.81 -0.02 0.00 0.00 0.00 0.00 47.33 46.79 2poz h GLY 264 CO -0.05 0.72 -0.08 0.74 0.00 0.00 0.00 176.54 177.87 2poz h PHE 265 N 0.05 0.00 -0.91 5.60 -1.00 -1.00 -2.89 116.94 116.79 2poz h PHE 265 Ca -0.05 0.00 0.08 0.00 2.81 0.00 0.00 57.97 60.82 2poz h PHE 265 Cb 1.20 0.00 -0.07 0.00 3.61 0.00 0.00 35.95 40.69 2poz h PHE 265 CO 0.12 0.08 0.56 -0.09 -1.61 0.00 0.00 178.31 177.38 2poz h ARG 266 N 0.00 0.95 -0.39 1.51 2.43 -1.00 0.80 114.38 118.68 2poz h ARG 266 Ca -0.00 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.07 2poz h ARG 266 Cb 0.57 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.88 2poz h ARG 266 CO 0.01 0.63 0.08 0.87 -1.51 0.00 0.00 179.97 180.05 2poz h LYS 267 N 0.98 0.57 -0.02 0.20 1.57 -1.66 -1.43 116.57 116.79 2poz h LYS 267 Ca 0.42 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 59.09 2poz h LYS 267 Cb 0.28 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.50 2poz h LYS 267 CO -0.21 0.54 -0.03 0.82 -0.57 0.00 0.00 179.45 180.00 2poz h ILE 268 N 0.56 1.45 -0.67 1.86 1.08 -1.26 -3.26 117.51 117.27 2poz h ILE 268 Ca 0.13 -1.37 0.08 0.00 -0.39 0.00 0.00 64.86 63.31 2poz h ILE 268 Cb 0.24 2.34 -0.06 0.00 -3.07 0.00 0.00 36.82 36.26 2poz h ILE 268 CO -0.00 0.36 0.33 -0.26 -0.69 0.00 0.00 178.15 177.90 2poz h PHE 269 N -0.51 0.60 0.00 1.37 0.05 -0.67 -1.60 116.94 116.19 2poz h PHE 269 Ca 0.00 0.03 0.00 0.00 3.82 0.00 0.00 57.97 61.82 2poz h PHE 269 Cb 0.61 -0.17 0.00 0.00 2.00 0.00 0.00 35.95 38.38 2poz h PHE 269 CO 0.12 0.24 0.00 0.93 -0.18 0.00 0.00 178.31 179.43 2poz h GLU 270 N 0.59 0.00 0.00 1.51 5.08 -1.35 -2.25 114.58 118.16 2poz h GLU 270 Ca 0.32 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.51 2poz h GLU 270 Cb 0.29 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 2poz h GLU 270 CO -0.24 0.00 -0.78 -0.07 -1.00 0.00 0.00 179.01 176.92 2poz h LEU 271 N 0.00 0.00 -1.83 1.33 3.38 -1.33 -3.47 115.31 113.39 2poz h LEU 271 Ca 0.00 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.46 2poz h LEU 271 Cb 0.26 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.93 2poz h LEU 271 CO 0.00 0.78 -0.88 0.00 0.09 0.00 0.00 178.44 178.43 2poz n GLN 272 N -3.52 -3.21 -0.00 1.13 6.02 -0.85 -4.85 117.38 112.10 2poz n GLN 272 Ca -0.00 0.39 0.03 0.00 -0.01 0.00 0.00 57.00 57.40 2poz n GLN 272 Cb 0.78 -4.55 -0.04 0.00 1.02 0.00 0.00 30.24 27.45 2poz n GLN 272 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2poz n ALA 273 N -4.41 2.43 -2.68 -1.58 0.00 -1.26 -5.03 120.51 107.97 2poz n ALA 273 Ca -0.28 -0.14 -0.25 0.00 0.00 0.00 0.00 53.44 52.78 2poz n ALA 273 Cb 0.67 -0.19 -0.07 0.00 0.00 0.00 0.00 19.45 19.86 2poz n ALA 273 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2poz n GLY 275 N -0.46 0.38 2.89 0.00 0.00 -0.99 -4.99 105.19 102.02 2poz n GLY 275 Ca -0.09 -0.13 -0.13 0.00 0.00 0.00 0.00 46.02 45.67 2poz n GLY 275 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2poz s ILE 276 N -1.64 -0.03 0.11 -0.61 1.01 -1.14 -2.32 121.20 116.58 2poz s ILE 276 Ca 0.01 0.10 0.07 0.00 0.00 0.00 0.00 60.65 60.83 2poz s ILE 276 Cb 0.04 -0.12 -0.04 0.00 0.01 0.00 0.00 42.46 42.34 2poz s ILE 276 CO 0.20 0.04 -0.08 0.27 0.00 0.00 0.00 174.94 175.37 2poz s ILE 277 N 0.57 3.48 -0.47 2.92 -4.36 -0.87 -2.42 121.20 120.05 2poz s ILE 277 Ca -0.04 -1.24 0.09 0.00 -0.26 0.00 0.00 60.65 59.19 2poz s ILE 277 Cb -0.06 -2.64 0.33 0.00 1.25 0.00 0.00 42.46 41.34 2poz s ILE 277 CO -0.02 0.10 0.80 0.00 0.24 0.00 0.00 174.94 176.06 2poz n GLN 278 N 0.63 1.94 -1.49 0.37 6.02 0.15 -1.73 117.38 123.28 2poz n GLN 278 Ca -0.13 -4.03 -0.33 0.00 -0.01 0.00 0.00 57.00 52.50 2poz n GLN 278 Cb 0.52 -1.91 0.08 0.00 1.02 0.00 0.00 30.24 29.95 2poz n GLN 278 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2poz s PRO 279 N -2.75 2.33 -0.19 -1.09 0.04 -1.26 -2.55 135.00 129.52 2poz s PRO 279 Ca 0.43 1.52 -0.01 0.00 0.04 0.00 0.00 61.00 62.98 2poz s PRO 279 Cb 0.30 -1.88 0.01 0.00 0.04 0.00 0.00 34.50 32.96 2poz s PRO 279 CO -0.10 -1.64 -0.13 0.34 0.04 0.00 0.00 177.00 175.51 2poz s ASP 280 N -2.46 3.69 0.25 6.66 -1.08 -1.26 -0.74 116.67 121.72 2poz s ASP 280 Ca 0.69 -0.52 0.17 0.00 -0.52 0.00 0.00 52.55 52.38 2poz s ASP 280 Cb -0.24 -1.60 0.92 0.00 -1.46 0.00 0.00 42.92 40.54 2poz s ASP 280 CO 0.46 0.00 1.53 2.30 0.52 0.00 0.00 175.17 179.98 2poz n ILE 281 N 4.62 1.21 1.18 4.11 -5.35 -1.26 0.30 119.36 124.16 2poz n ILE 281 Ca -0.20 0.65 0.13 0.00 -0.27 0.00 0.00 62.75 63.06 2poz n ILE 281 Cb 0.51 -1.64 0.31 0.00 -1.74 0.00 0.00 39.64 37.08 2poz n ILE 281 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2poz n GLY 282 N -1.22 -0.67 0.00 3.28 0.00 -1.26 -2.80 105.19 102.51 2poz n GLY 282 Ca -0.01 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.59 2poz n GLY 282 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2poz n THR 283 N -0.76 0.00 0.30 2.61 -2.24 -0.32 -0.07 114.28 113.80 2poz n THR 283 Ca 0.11 0.00 0.19 0.00 -2.27 0.00 0.00 64.05 62.07 2poz n THR 283 Cb 0.36 -0.29 0.96 0.00 -2.10 0.00 0.00 70.33 69.25 2poz n THR 283 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2poz h ALA 284 N 0.00 1.09 0.00 6.98 0.00 -0.38 -3.37 119.26 123.58 2poz h ALA 284 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2poz h ALA 284 Cb 0.30 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2poz h ALA 284 CO 0.00 0.03 0.00 0.41 0.00 0.00 0.00 179.25 179.69 2poz n GLY 285 N -0.70 0.35 0.00 0.00 0.00 -1.26 -1.41 105.19 102.17 2poz n GLY 285 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 2poz n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2poz n GLY 286 N 0.00 0.74 0.17 -0.02 0.00 -1.12 -4.21 105.19 100.75 2poz n GLY 286 Ca 0.00 -2.24 0.00 0.00 0.00 0.00 0.00 46.02 43.78 2poz n GLY 286 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2poz n LEU 287 N 0.00 0.11 0.00 0.99 4.77 -1.26 -1.74 117.00 119.87 2poz n LEU 287 Ca 0.00 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 2poz n LEU 287 Cb 0.00 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 2poz n LEU 287 CO 0.00 0.03 0.00 1.21 -1.33 0.00 0.00 177.39 177.30 2poz n GLU 289 N -0.21 0.00 0.03 3.23 4.07 -1.26 -0.69 120.64 125.82 2poz n GLU 289 Ca 0.00 0.00 -0.03 0.00 -0.06 0.00 0.00 57.16 57.07 2poz n GLU 289 Cb 0.03 0.00 0.20 0.00 -0.06 0.00 0.00 31.44 31.61 2poz n GLU 289 CO 0.00 0.00 0.00 1.15 -0.06 0.00 0.00 177.13 178.22 2poz h THR 290 N 0.00 1.28 -0.64 6.31 2.02 -1.64 -0.70 112.91 119.54 2poz h THR 290 Ca 0.00 -1.35 -0.06 0.00 0.77 0.00 0.00 66.41 65.78 2poz h THR 290 Cb 0.00 1.44 -0.03 0.00 -1.74 0.00 0.00 68.15 67.83 2poz h THR 290 CO 0.00 0.42 0.18 0.50 0.37 0.00 0.00 175.52 176.99 2poz h LYS 291 N 0.38 1.00 -0.31 6.66 3.64 -1.16 -0.81 116.57 125.98 2poz h LYS 291 Ca 0.05 -0.23 -0.07 0.00 -1.27 0.00 0.00 60.65 59.13 2poz h LYS 291 Cb 0.72 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.39 2poz h LYS 291 CO 0.06 0.89 -0.11 0.87 -2.27 0.00 0.00 179.45 178.88 2poz h LYS 292 N 0.93 0.52 -0.39 1.90 1.57 -1.70 -1.50 116.57 117.89 2poz h LYS 292 Ca 0.20 -0.15 -0.14 0.00 -1.87 0.00 0.00 60.65 58.70 2poz h LYS 292 Cb 0.32 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 2poz h LYS 292 CO -0.00 0.63 -0.29 0.82 -0.57 0.00 0.00 179.45 180.04 2poz h ILE 293 N 0.48 1.28 -0.22 1.86 2.04 -0.62 -3.07 117.51 119.26 2poz h ILE 293 Ca 0.09 -1.46 -0.10 0.00 1.00 0.00 0.00 64.86 64.40 2poz h ILE 293 Cb 0.49 1.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 2poz h ILE 293 CO 0.03 0.49 -0.28 0.00 0.00 0.00 0.00 178.15 178.39 2poz n ALA 295 N -2.48 1.94 0.00 0.00 0.00 -0.59 -2.14 120.51 117.24 2poz n ALA 295 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2poz n ALA 295 Cb 0.41 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.86 2poz n ALA 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2poz n ALA 297 N 0.65 0.00 0.10 0.00 0.00 -0.10 -3.66 120.51 117.50 2poz n ALA 297 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 2poz n ALA 297 Cb 0.22 0.00 0.43 0.00 0.00 0.00 0.00 19.45 20.10 2poz n ALA 297 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2poz h GLU 298 N 0.00 0.30 0.00 0.00 5.08 -1.71 -0.49 114.58 117.75 2poz h GLU 298 Ca 0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2poz h GLU 298 Cb 0.00 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2poz h GLU 298 CO 0.00 0.33 0.00 0.00 -1.00 0.00 0.00 179.01 178.34 2poz n ALA 299 N -2.49 1.89 -1.35 3.43 0.00 -1.24 -2.54 120.51 118.20 2poz n ALA 299 Ca -0.00 -0.07 0.08 0.00 0.00 0.00 0.00 53.44 53.44 2poz n ALA 299 Cb 0.19 -1.28 0.18 0.00 0.00 0.00 0.00 19.45 18.53 2poz n ALA 299 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2poz n TYR 300 N -1.37 0.01 -3.03 0.00 4.02 -0.20 -5.21 117.16 111.38 2poz n TYR 300 Ca 0.07 -1.27 -0.17 0.00 -0.01 0.00 0.00 57.90 56.53 2poz n TYR 300 Cb 0.16 -0.20 0.02 0.00 -0.02 0.00 0.00 39.34 39.30 2poz n TYR 300 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2poz n ASN 301 N -1.27 -7.28 -3.98 7.72 5.15 -1.05 -5.04 115.26 109.51 2poz n ASN 301 Ca 0.18 0.35 -0.09 0.00 -0.60 0.00 0.00 54.58 54.42 2poz n ASN 301 Cb 0.67 -4.35 -0.05 0.00 -0.53 0.00 0.00 39.78 35.52 2poz n ASN 301 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2poz s ARG 303 N -2.55 1.54 -0.07 1.20 1.70 -0.98 -4.97 118.95 114.82 2poz s ARG 303 Ca 0.29 -1.22 0.04 0.00 -0.47 0.00 0.00 55.73 54.37 2poz s ARG 303 Cb -0.06 0.48 -0.00 0.00 -0.57 0.00 0.00 34.95 34.80 2poz s ARG 303 CO 0.80 -0.64 -0.21 0.08 -1.08 0.00 0.00 175.30 174.25 2poz s VAL 304 N -4.00 1.76 -0.56 4.99 1.01 0.11 -2.06 120.40 121.65 2poz s VAL 304 Ca 0.21 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.36 2poz s VAL 304 Cb -0.01 -1.53 0.16 0.00 0.00 0.00 0.00 36.38 35.01 2poz s VAL 304 CO 0.08 0.50 0.39 0.00 0.00 0.00 0.00 175.10 176.07 2poz s ALA 305 N 0.25 2.82 0.21 5.51 0.00 -0.70 -3.66 121.76 126.19 2poz s ALA 305 Ca -0.12 -3.20 -0.31 0.00 0.00 0.00 0.00 51.96 48.33 2poz s ALA 305 Cb -0.16 -1.96 -0.15 0.00 0.00 0.00 0.00 23.12 20.85 2poz s ALA 305 CO 0.06 -2.05 1.05 -2.30 0.00 0.00 0.00 175.76 172.51 2poz n PRO 306 N 2.56 1.09 -3.26 0.00 -0.02 -1.26 -4.27 135.00 129.84 2poz n PRO 306 Ca 0.20 0.39 -0.38 0.00 -2.02 0.00 0.00 63.50 61.68 2poz n PRO 306 Cb 0.38 -1.79 -0.06 0.00 -0.02 0.00 0.00 33.50 32.01 2poz n PRO 306 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 2poz s HIS 307 N -0.55 3.61 -0.11 6.00 2.46 0.08 -4.27 115.29 122.51 2poz s HIS 307 Ca 0.68 1.06 -0.05 0.00 0.47 0.00 0.00 55.06 57.22 2poz s HIS 307 Cb -0.82 -2.57 0.05 0.00 -0.13 0.00 0.00 32.58 29.11 2poz s HIS 307 CO 0.55 0.28 0.23 0.14 -2.47 0.00 0.00 174.74 173.47 2poz s VAL 308 N 0.14 -0.18 -0.35 0.89 -7.23 -1.26 -4.32 120.40 108.09 2poz s VAL 308 Ca 0.29 0.22 0.07 0.00 -1.81 0.00 0.00 61.98 60.74 2poz s VAL 308 Cb -0.17 -0.37 0.19 0.00 0.56 0.00 0.00 36.38 36.59 2poz s VAL 308 CO 0.14 0.09 0.59 0.00 -0.31 0.00 0.00 175.10 175.61 2poz n GLY 310 N 4.89 1.86 3.55 0.00 0.00 -1.26 -4.53 105.19 109.70 2poz n GLY 310 Ca 0.08 -0.54 -0.30 0.00 0.00 0.00 0.00 46.02 45.26 2poz n GLY 310 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2poz s SER 311 N 2.00 0.49 0.51 1.61 1.04 -1.26 -4.87 113.70 113.21 2poz s SER 311 Ca 0.00 0.60 0.34 0.00 0.48 0.00 0.00 55.95 57.37 2poz s SER 311 Cb 0.00 -0.80 1.68 0.00 0.10 0.00 0.00 66.02 67.00 2poz s SER 311 CO 0.00 -4.39 2.04 0.28 0.98 0.00 0.00 173.24 172.15 2poz h SER 312 N -2.76 0.00 0.40 7.02 0.02 -1.96 -3.15 113.55 113.11 2poz h SER 312 Ca -0.43 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.50 2poz h SER 312 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.84 2poz h SER 312 CO 0.31 0.00 -0.19 0.25 -1.14 0.00 0.00 176.83 176.06 2poz h LEU 313 N 0.00 -0.45 -1.65 5.07 5.85 -1.94 -2.15 115.31 120.05 2poz h LEU 313 Ca 0.00 -0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 2poz h LEU 313 Cb 0.21 0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 2poz h LEU 313 CO 0.00 -0.09 -0.00 -0.29 -0.34 0.00 0.00 178.44 177.71 2poz h ILE 314 N -0.85 1.10 -0.44 4.05 2.10 -1.90 -0.64 117.51 120.93 2poz h ILE 314 Ca -0.05 -0.40 -0.15 0.00 1.08 0.00 0.00 64.86 65.34 2poz h ILE 314 Cb 0.55 1.00 -0.01 0.00 -1.09 0.00 0.00 36.82 37.26 2poz h ILE 314 CO 0.09 0.13 -0.30 -0.08 -1.08 0.00 0.00 178.15 176.92 2poz h GLU 315 N 0.21 0.97 -0.39 2.19 4.81 -1.59 -1.13 114.58 119.66 2poz h GLU 315 Ca 0.05 -0.46 -0.13 0.00 -0.13 0.00 0.00 59.36 58.70 2poz h GLU 315 Cb 0.16 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 2poz h GLU 315 CO 0.00 1.12 -0.25 1.15 -0.73 0.00 0.00 179.01 180.31 2poz h THR 316 N 0.81 1.28 0.00 0.32 2.02 -0.70 -2.50 112.91 114.14 2poz h THR 316 Ca 0.09 -1.40 -0.03 0.00 0.77 0.00 0.00 66.41 65.83 2poz h THR 316 Cb 0.88 1.32 -0.00 0.00 -1.74 0.00 0.00 68.15 68.61 2poz h THR 316 CO 0.08 0.47 -0.16 0.00 0.37 0.00 0.00 175.52 176.28 2poz h ALA 317 N 0.80 1.39 -0.08 6.16 0.00 -1.04 -1.64 119.26 124.85 2poz h ALA 317 Ca 0.08 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.71 2poz h ALA 317 Cb 0.82 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2poz h ALA 317 CO 0.07 0.20 -0.57 1.15 0.00 0.00 0.00 179.25 180.10 2poz h THR 318 N 0.00 1.37 0.00 0.00 2.02 -0.78 -2.69 112.91 112.83 2poz h THR 318 Ca -0.00 -1.90 -0.05 0.00 0.77 0.00 0.00 66.41 65.23 2poz h THR 318 Cb 0.36 1.94 -0.01 0.00 -1.74 0.00 0.00 68.15 68.70 2poz h THR 318 CO 0.02 0.56 -0.24 -0.07 0.37 0.00 0.00 175.52 176.16 2poz h LEU 319 N 0.20 0.00 -0.84 2.58 3.38 -0.95 -1.01 115.31 118.66 2poz h LEU 319 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2poz h LEU 319 Cb 1.06 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 2poz h LEU 319 CO 0.09 0.24 0.53 1.56 0.09 0.00 0.00 178.44 180.95 2poz h GLN 320 N 0.00 1.13 0.09 1.13 1.08 -1.35 -1.31 115.11 115.87 2poz h GLN 320 Ca -0.00 -0.08 -0.00 0.00 -1.45 0.00 0.00 58.65 57.11 2poz h GLN 320 Cb 0.44 -0.25 0.00 0.00 -0.05 0.00 0.00 27.48 27.63 2poz h GLN 320 CO 0.03 0.77 -0.04 1.25 -0.95 0.00 0.00 178.83 179.89 2poz h LEU 321 N 1.15 -0.10 -2.60 1.46 5.85 -1.36 -3.25 115.31 116.46 2poz h LEU 321 Ca 0.31 -0.46 0.01 0.00 0.84 0.00 0.00 57.88 58.58 2poz h LEU 321 Cb -0.09 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 40.96 2poz h LEU 321 CO -0.06 0.45 0.07 -0.33 -0.34 0.00 0.00 178.44 178.22 2poz h GLU 322 N -0.69 0.00 0.00 1.25 5.08 -1.10 -0.32 114.58 118.80 2poz h GLU 322 Ca -0.01 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2poz h GLU 322 Cb 0.55 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 2poz h GLU 322 CO 0.02 0.00 -0.09 0.00 -1.00 0.00 0.00 179.01 177.94 2poz h ALA 323 N 1.90 0.96 0.00 3.43 0.00 -1.27 -3.38 119.26 120.89 2poz h ALA 323 Ca 0.02 -0.08 -0.16 0.00 0.00 0.00 0.00 54.91 54.69 2poz h ALA 323 Cb 0.15 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 2poz h ALA 323 CO -0.00 0.11 -1.70 -1.71 0.00 0.00 0.00 179.25 175.95 2poz n ASN 324 N -3.14 2.34 -4.77 0.00 2.85 -0.19 -0.84 115.26 111.52 2poz n ASN 324 Ca 0.03 0.00 -0.39 0.00 -0.11 0.00 0.00 54.58 54.10 2poz n ASN 324 Cb 0.50 0.91 -0.03 0.00 1.24 0.00 0.00 39.78 42.40 2poz n ASN 324 CO 0.00 0.00 0.00 0.27 -2.11 0.00 0.00 177.26 175.42 2poz s ILE 325 N -2.37 3.27 0.03 -1.44 -4.36 -0.85 -4.76 121.20 110.73 2poz s ILE 325 Ca -0.05 1.18 0.13 0.00 -0.26 0.00 0.00 60.65 61.65 2poz s ILE 325 Cb 0.04 -3.72 -0.02 0.00 1.25 0.00 0.00 42.46 40.01 2poz s ILE 325 CO 0.45 0.21 1.46 0.71 0.24 0.00 0.00 174.94 178.01 2poz h THR 326 N 2.77 1.21 -1.21 8.37 1.35 -1.94 -3.33 112.91 120.13 2poz h THR 326 Ca -0.48 -2.49 -0.68 0.00 -0.55 0.00 0.00 66.41 62.21 2poz h THR 326 Cb 1.22 2.45 -0.31 0.00 -1.73 0.00 0.00 68.15 69.78 2poz h THR 326 CO 0.65 0.64 0.61 -0.46 -0.25 0.00 0.00 175.52 176.71 2poz n ASN 327 N -3.37 7.15 -4.82 5.36 6.94 -1.26 -5.09 115.26 120.17 2poz n ASN 327 Ca 0.01 -3.79 -0.29 0.00 -0.02 0.00 0.00 54.58 50.48 2poz n ASN 327 Cb 0.75 -0.89 0.11 0.00 -2.36 0.00 0.00 39.78 37.40 2poz n ASN 327 CO 0.00 0.00 0.00 0.12 -1.03 0.00 0.00 177.26 176.35 2poz s PHE 328 N -3.84 2.70 0.36 -2.53 5.36 -1.25 0.10 117.98 118.87 2poz s PHE 328 Ca 0.59 0.90 0.03 0.00 -0.96 0.00 0.00 56.93 57.49 2poz s PHE 328 Cb 0.48 -3.34 -0.02 0.00 -0.34 0.00 0.00 43.02 39.80 2poz s PHE 328 CO -0.10 -2.09 0.54 -1.50 -1.46 0.00 0.00 175.22 170.61 2poz s ILE 330 N -3.31 4.49 -0.09 3.12 2.07 -1.24 -4.74 121.20 121.50 2poz s ILE 330 Ca 0.63 -0.70 -0.03 0.00 -1.41 0.00 0.00 60.65 59.14 2poz s ILE 330 Cb -0.14 -3.62 -0.03 0.00 0.13 0.00 0.00 42.46 38.80 2poz s ILE 330 CO 0.53 -0.34 0.03 -2.28 -1.91 0.00 0.00 174.94 170.96 2poz s HIS 331 N -2.30 3.24 -0.18 3.50 5.65 -0.19 -4.15 115.29 120.85 2poz s HIS 331 Ca 0.43 0.25 -0.12 0.00 0.25 0.00 0.00 55.06 55.87 2poz s HIS 331 Cb -0.10 -1.81 -0.05 0.00 -1.18 0.00 0.00 32.58 29.45 2poz s HIS 331 CO 0.34 0.52 0.22 -2.00 -0.65 0.00 0.00 174.74 173.17 2poz s GLU 332 N -0.94 4.22 0.01 2.88 2.12 -1.26 0.25 118.70 125.98 2poz s GLU 332 Ca 0.14 -0.05 0.02 0.00 0.36 0.00 0.00 54.97 55.43 2poz s GLU 332 Cb -0.11 -3.44 -0.01 0.00 0.26 0.00 0.00 34.13 30.83 2poz s GLU 332 CO 0.03 0.24 -0.06 -1.58 -0.54 0.00 0.00 175.26 173.35 2poz s HIS 333 N 0.51 0.48 -0.72 5.30 2.46 -0.86 -4.72 115.29 117.74 2poz s HIS 333 Ca 0.13 -0.24 0.02 0.00 0.47 0.00 0.00 55.06 55.43 2poz s HIS 333 Cb -0.12 -0.30 0.18 0.00 -0.13 0.00 0.00 32.58 32.20 2poz s HIS 333 CO 0.02 -0.04 0.53 0.71 -2.47 0.00 0.00 174.74 173.49 2poz s TYR 334 N -0.61 3.59 0.35 3.88 2.02 -1.26 -1.01 117.35 124.31 2poz s TYR 334 Ca -0.03 -3.16 0.07 0.00 -0.37 0.00 0.00 57.07 53.57 2poz s TYR 334 Cb -0.05 -2.93 0.74 0.00 -0.40 0.00 0.00 41.96 39.32 2poz s TYR 334 CO -0.00 -0.66 1.90 -1.00 -1.57 0.00 0.00 175.55 174.22 2poz h PRO 335 N 5.91 0.75 0.00 -1.71 0.13 -1.92 -2.96 132.00 132.19 2poz h PRO 335 Ca 0.10 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 2poz h PRO 335 Cb 0.81 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.77 2poz h PRO 335 CO 0.75 0.49 0.00 0.00 -0.23 0.00 0.00 178.00 179.02 2poz n ALA 336 N -2.43 2.00 0.23 -0.56 0.00 -1.26 -3.67 120.51 114.81 2poz n ALA 336 Ca 0.15 -0.04 0.08 0.00 0.00 0.00 0.00 53.44 53.63 2poz n ALA 336 Cb 0.35 -1.38 0.54 0.00 0.00 0.00 0.00 19.45 18.95 2poz n ALA 336 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2poz h PHE 337 N 0.00 0.00 0.00 0.00 -1.00 -1.87 -2.03 116.94 112.05 2poz h PHE 337 Ca 0.00 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.68 2poz h PHE 337 Cb 0.44 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.99 2poz h PHE 337 CO 0.00 0.23 -0.49 0.87 -1.61 0.00 0.00 178.31 177.31 2poz h LYS 338 N 0.00 0.00 0.00 1.51 6.56 -1.79 -2.64 116.57 120.21 2poz h LYS 338 Ca -0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2poz h LYS 338 Cb 0.52 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.18 2poz h LYS 338 CO 0.03 0.49 0.00 0.00 -2.06 0.00 0.00 179.45 177.91 2poz n ALA 339 N -2.34 2.46 -1.86 3.86 0.00 -0.77 -4.78 120.51 117.08 2poz n ALA 339 Ca -0.00 -0.14 -0.42 0.00 0.00 0.00 0.00 53.44 52.88 2poz n ALA 339 Cb 0.58 -1.48 -0.02 0.00 0.00 0.00 0.00 19.45 18.52 2poz n ALA 339 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2poz s ASP 340 N -2.57 6.56 -0.04 0.00 1.11 -1.00 -4.92 116.67 115.81 2poz s ASP 340 Ca 0.28 2.72 -0.30 0.00 0.18 0.00 0.00 52.55 55.43 2poz s ASP 340 Cb 0.20 -2.62 -0.06 0.00 1.07 0.00 0.00 42.92 41.51 2poz s ASP 340 CO 0.45 -0.80 1.69 -1.81 1.18 0.00 0.00 175.17 175.88 2poz s ASP 341 N 0.66 6.64 0.00 0.27 1.01 -1.26 -1.31 116.67 122.68 2poz s ASP 341 Ca 0.64 2.29 0.00 0.00 0.71 0.00 0.00 52.55 56.20 2poz s ASP 341 Cb -0.44 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 40.95 2poz s ASP 341 CO 0.40 -0.94 0.00 0.61 0.21 0.00 0.00 175.17 175.46 2poz n GLY 342 N 4.17 0.58 3.74 0.21 0.00 -1.26 -4.28 105.19 108.35 2poz n GLY 342 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 2poz n GLY 342 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2poz n TYR 343 N -1.81 2.81 -3.92 1.61 9.36 -0.43 -2.23 117.16 122.54 2poz n TYR 343 Ca 0.00 0.28 -0.35 0.00 3.32 0.00 0.00 57.90 61.15 2poz n TYR 343 Cb 0.00 -2.58 -0.14 0.00 -0.63 0.00 0.00 39.34 35.99 2poz n TYR 343 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 2poz s VAL 344 N -0.06 2.92 -0.01 2.97 1.01 -1.26 -4.87 120.40 121.09 2poz s VAL 344 Ca 0.64 -1.42 -0.30 0.00 0.00 0.00 0.00 61.98 60.90 2poz s VAL 344 Cb -0.51 -2.69 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 2poz s VAL 344 CO 0.49 -0.11 1.15 -0.70 0.00 0.00 0.00 175.10 175.94 2poz s GLU 345 N 1.24 4.41 -0.01 2.72 2.56 -1.26 -4.89 118.70 123.48 2poz s GLU 345 Ca -0.05 1.65 0.17 0.00 0.00 0.00 0.00 54.97 56.73 2poz s GLU 345 Cb -0.20 -3.47 -0.20 0.00 2.00 0.00 0.00 34.13 32.26 2poz s GLU 345 CO -0.01 -0.31 0.64 1.33 -0.56 0.00 0.00 175.26 176.34 2poz n VAL 346 N 4.27 0.00 -4.73 3.70 0.24 -1.26 -4.79 118.33 115.76 2poz n VAL 346 Ca 0.09 -0.17 -0.30 0.00 -2.04 0.00 0.00 64.34 61.92 2poz n VAL 346 Cb 0.47 0.80 -0.13 0.00 -1.47 0.00 0.00 33.84 33.51 2poz n VAL 346 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2poz s LEU 347 N -3.10 2.45 0.34 1.34 1.43 -1.26 -1.19 118.68 118.69 2poz s LEU 347 Ca 0.04 -0.50 0.07 0.00 -1.03 0.00 0.00 54.13 52.70 2poz s LEU 347 Cb 0.12 -1.43 0.62 0.00 0.03 0.00 0.00 46.19 45.54 2poz s LEU 347 CO 0.69 0.25 1.84 -0.08 0.23 0.00 0.00 176.35 179.29 2poz h GLU 348 N 4.59 0.35 -2.23 1.70 4.57 -1.31 -3.34 114.58 118.92 2poz h GLU 348 Ca -0.47 -0.10 -0.58 0.00 -1.18 0.00 0.00 59.36 57.03 2poz h GLU 348 Cb 1.15 -0.04 -0.40 0.00 -0.16 0.00 0.00 28.75 29.31 2poz h GLU 348 CO 0.46 0.51 -0.92 0.27 -1.18 0.00 0.00 179.01 178.15 2poz n ASN 349 N -4.21 1.00 -4.71 1.04 0.23 -1.26 -5.08 115.26 102.26 2poz n ASN 349 Ca -0.00 -2.81 -0.40 0.00 -0.53 0.00 0.00 54.58 50.84 2poz n ASN 349 Cb 0.32 -0.64 0.03 0.00 -2.08 0.00 0.00 39.78 37.41 2poz n ASN 349 CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 2poz n PRO 350 N 1.70 1.80 -1.65 -0.53 -0.04 -1.25 -4.84 135.00 130.20 2poz n PRO 350 Ca 0.25 0.65 -0.44 0.00 -0.04 0.00 0.00 63.50 63.92 2poz n PRO 350 Cb 0.48 -2.45 -0.03 0.00 -0.04 0.00 0.00 33.50 31.45 2poz n PRO 350 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 2poz n PRO 351 N -0.39 2.54 -3.76 0.54 -0.04 -1.26 -4.96 135.00 127.67 2poz n PRO 351 Ca 0.08 0.89 -0.37 0.00 -0.04 0.00 0.00 63.50 64.07 2poz n PRO 351 Cb 0.42 -2.98 -0.06 0.00 -0.04 0.00 0.00 33.50 30.84 2poz n PRO 351 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2poz s SER 352 N 5.22 6.42 0.75 3.54 1.04 -1.26 -5.10 113.70 124.31 2poz s SER 352 Ca 0.93 0.50 0.00 0.00 0.48 0.00 0.00 55.95 57.86 2poz s SER 352 Cb -0.47 -2.11 0.00 0.00 0.10 0.00 0.00 66.02 63.54 2poz s SER 352 CO 0.43 0.32 0.00 -0.38 0.98 0.00 0.00 173.24 174.59 2poz n ILE 353 N 2.43 0.00 0.00 -1.02 -0.00 -1.26 -4.64 119.36 114.86 2poz n ILE 353 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.58 2poz n ILE 353 Cb 0.54 -0.72 0.00 0.00 -0.00 0.00 0.00 39.64 39.46 2poz n ILE 353 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.55 176.31 2poz n SER 354 N -2.24 0.00 -1.26 4.38 2.88 -1.07 -4.91 113.62 111.40 2poz n SER 354 Ca 0.00 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.41 2poz n SER 354 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 2poz n SER 354 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2poz n SER 355 N 0.00 -4.21 0.00 -3.46 7.64 -1.25 -2.89 113.62 109.46 2poz n SER 355 Ca 0.00 0.12 0.00 0.00 1.01 0.00 0.00 58.87 60.00 2poz n SER 355 Cb 0.00 -3.18 0.00 0.00 -1.01 0.00 0.00 64.21 60.02 2poz n SER 355 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2poz n GLY 356 N -1.17 0.67 3.44 0.23 0.00 -1.23 -4.51 105.19 102.63 2poz n GLY 356 Ca -0.14 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 2poz n GLY 356 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2poz s TYR 357 N -2.27 2.39 -0.12 1.61 2.02 -1.14 -1.35 117.35 118.49 2poz s TYR 357 Ca 0.00 -0.33 0.02 0.00 -0.37 0.00 0.00 57.07 56.39 2poz s TYR 357 Cb 0.00 -1.23 0.01 0.00 -0.40 0.00 0.00 41.96 40.35 2poz s TYR 357 CO 0.00 0.43 -0.17 -0.06 -1.57 0.00 0.00 175.55 174.19 2poz s PHE 358 N -1.40 2.15 0.00 2.71 0.08 -0.48 -2.61 117.98 118.43 2poz s PHE 358 Ca 0.19 -1.05 0.00 0.00 0.12 0.00 0.00 56.93 56.19 2poz s PHE 358 Cb -0.09 -1.53 0.00 0.00 -0.57 0.00 0.00 43.02 40.83 2poz s PHE 358 CO 0.09 -0.53 0.00 0.39 -0.10 0.00 0.00 175.22 175.08 2poz n GLU 359 N 4.22 0.00 -4.65 0.44 -0.58 -1.26 -1.21 120.64 117.60 2poz n GLU 359 Ca -0.19 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.25 2poz n GLU 359 Cb 0.51 0.00 -0.14 0.00 -0.57 0.00 0.00 31.44 31.25 2poz n GLU 359 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 2poz s PRO 361 N 0.00 1.68 0.00 3.49 0.04 -1.26 -4.93 135.00 134.02 2poz s PRO 361 Ca 0.00 -1.19 0.07 0.00 0.04 0.00 0.00 61.00 59.92 2poz s PRO 361 Cb 0.00 -1.98 0.06 0.00 0.04 0.00 0.00 34.50 32.62 2poz s PRO 361 CO 0.00 0.49 0.73 0.09 0.04 0.00 0.00 177.00 178.35 2poz n ASN 362 N 1.37 1.60 -4.81 6.66 4.13 -1.26 -5.00 115.26 117.95 2poz n ASN 362 Ca -0.17 -1.30 -0.30 0.00 1.68 0.00 0.00 54.58 54.48 2poz n ASN 362 Cb 0.52 -0.00 0.08 0.00 -1.54 0.00 0.00 39.78 38.84 2poz n ASN 362 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 2poz s GLY 363 N -0.60 1.63 0.90 7.41 0.00 -1.26 -4.73 107.32 110.68 2poz s GLY 363 Ca 0.08 -0.16 -0.11 0.00 0.00 0.00 0.00 44.72 44.53 2poz s GLY 363 CO 0.09 0.24 1.10 2.56 0.00 0.00 0.00 173.10 177.08 2poz s PRO 364 N -5.15 1.18 7.64 2.90 0.04 -1.26 -3.82 135.00 136.52 2poz s PRO 364 Ca 0.60 1.08 0.00 0.00 0.04 0.00 0.00 61.00 62.72 2poz s PRO 364 Cb -0.14 -1.78 0.00 0.00 0.04 0.00 0.00 34.50 32.62 2poz s PRO 364 CO 0.54 -2.37 0.00 0.41 0.04 0.00 0.00 177.00 175.62 2poz n GLY 365 N -0.60 3.37 0.01 0.56 0.00 -0.17 -1.16 105.19 107.20 2poz n GLY 365 Ca 0.08 -0.16 0.14 0.00 0.00 0.00 0.00 46.02 46.07 2poz n GLY 365 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2poz n LEU 366 N 0.00 0.14 -2.77 0.99 4.77 -1.26 -1.45 117.00 117.41 2poz n LEU 366 Ca 0.00 0.43 -0.15 0.00 -0.03 0.00 0.00 56.01 56.26 2poz n LEU 366 Cb 0.00 -0.45 0.06 0.00 -2.33 0.00 0.00 43.42 40.71 2poz n LEU 366 CO 0.00 0.01 0.13 0.61 -1.33 0.00 0.00 177.39 176.80 2poz n GLY 367 N 1.49 -0.15 2.78 -0.72 0.00 -0.31 -4.67 105.19 103.62 2poz n GLY 367 Ca 0.07 -0.03 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 2poz n GLY 367 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2poz s ALA 368 N -3.25 0.05 -0.33 4.61 0.00 -1.26 -4.68 121.76 116.90 2poz s ALA 368 Ca 0.20 0.35 -0.10 0.00 0.00 0.00 0.00 51.96 52.40 2poz s ALA 368 Cb -0.09 -0.31 0.00 0.00 0.00 0.00 0.00 23.12 22.73 2poz s ALA 368 CO 0.53 -0.15 0.17 0.08 0.00 0.00 0.00 175.76 176.40 2poz s VAL 369 N 1.18 4.65 0.17 0.00 1.01 -1.26 -5.00 120.40 121.15 2poz s VAL 369 Ca -0.08 -0.51 -0.30 0.00 0.00 0.00 0.00 61.98 61.09 2poz s VAL 369 Cb -0.13 -3.43 -0.07 0.00 0.00 0.00 0.00 36.38 32.75 2poz s VAL 369 CO -0.03 -0.01 1.08 -0.76 0.00 0.00 0.00 175.10 175.37 2poz s LEU 370 N 1.61 4.49 -1.19 3.92 1.43 -1.26 -0.81 118.68 126.87 2poz s LEU 370 Ca 0.04 2.04 -0.13 0.00 -1.03 0.00 0.00 54.13 55.05 2poz s LEU 370 Cb -0.18 -3.60 0.19 0.00 0.03 0.00 0.00 46.19 42.63 2poz s LEU 370 CO 0.07 -0.19 1.39 -0.63 0.23 0.00 0.00 176.35 177.21 2poz s ILE 371 N -0.20 5.18 0.60 -0.59 1.01 -0.34 -4.83 121.20 122.03 2poz s ILE 371 Ca 0.49 -2.75 0.30 0.00 0.00 0.00 0.00 60.65 58.69 2poz s ILE 371 Cb -0.28 -4.87 0.42 0.00 0.01 0.00 0.00 42.46 37.74 2poz s ILE 371 CO 0.34 -1.56 1.55 0.11 0.00 0.00 0.00 174.94 175.38 2poz h LYS 372 N 7.08 0.00 -0.67 2.79 1.79 -1.93 0.20 116.57 125.83 2poz h LYS 372 Ca 0.30 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.73 2poz h LYS 372 Cb 0.87 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.49 2poz h LYS 372 CO 1.21 0.00 0.27 -0.09 -1.08 0.00 0.00 179.45 179.76 2poz h ARG 373 N 0.00 1.01 0.00 3.15 2.43 -1.98 -1.24 114.38 117.74 2poz h ARG 373 Ca 0.43 -0.18 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 2poz h ARG 373 Cb 2.36 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 31.75 2poz h ARG 373 CO -0.00 0.84 -0.24 -0.91 -1.51 0.00 0.00 179.97 178.14 2poz h ASN 374 N 0.96 0.00 0.00 -3.80 2.35 -0.91 -3.34 115.58 110.84 2poz h ASN 374 Ca 0.22 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.93 2poz h ASN 374 Cb 0.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.58 2poz h ASN 374 CO -0.02 0.02 -1.31 2.30 -1.65 0.00 0.00 177.43 176.77 2poz n ILE 375 N -2.55 0.00 -0.29 2.81 -5.35 -1.18 -4.54 119.36 108.27 2poz n ILE 375 Ca 0.04 -0.26 0.04 0.00 -0.27 0.00 0.00 62.75 62.29 2poz n ILE 375 Cb 0.48 0.52 0.18 0.00 -1.74 0.00 0.00 39.64 39.07 2poz n ILE 375 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 2poz h GLU 376 N 0.00 0.72 -0.03 6.28 4.57 -1.35 -0.52 114.58 124.25 2poz h GLU 376 Ca 0.00 -0.04 0.01 0.00 -1.18 0.00 0.00 59.36 58.15 2poz h GLU 376 Cb 0.59 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 29.01 2poz h GLU 376 CO 0.00 0.48 0.07 -1.35 -1.18 0.00 0.00 179.01 177.03 2poz h PRO 377 N 0.74 0.00 -0.60 0.92 0.11 -1.80 -1.69 132.00 129.69 2poz h PRO 377 Ca 0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.52 2poz h PRO 377 Cb 0.43 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.54 2poz h PRO 377 CO -0.27 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.18 2poz n TYR 378 N -3.38 1.58 -1.68 0.65 4.01 -0.21 -4.97 117.16 113.16 2poz n TYR 378 Ca -0.02 -0.65 -0.45 0.00 -0.16 0.00 0.00 57.90 56.61 2poz n TYR 378 Cb 0.15 -0.31 -0.04 0.00 -0.31 0.00 0.00 39.34 38.83 2poz n TYR 378 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 2poz n LEU 379 N 0.90 3.57 -0.09 7.72 7.94 -0.64 -1.95 117.00 134.46 2poz n LEU 379 Ca 0.26 1.01 -0.11 0.00 -1.11 0.00 0.00 56.01 56.06 2poz n LEU 379 Cb 0.96 -1.46 -0.10 0.00 0.53 0.00 0.00 43.42 43.35 2poz n LEU 379 CO 0.25 -0.04 -1.08 1.87 -1.11 0.00 0.00 177.39 177.28 2poz n TRP 380 N 5.23 0.00 -3.45 1.96 -0.00 0.77 -4.88 117.44 117.08 2poz n TRP 380 Ca 0.19 0.00 -0.13 0.00 -0.00 0.00 0.00 57.50 57.56 2poz n TRP 380 Cb 0.32 -0.73 -0.03 0.00 -0.00 0.00 0.00 31.31 30.87 2poz n TRP 380 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 2poz s ALA 381 N -2.38 -1.65 -0.01 5.87 0.00 -1.06 -5.00 121.76 117.53 2poz s ALA 381 Ca -0.20 0.68 0.01 0.00 0.00 0.00 0.00 51.96 52.45 2poz s ALA 381 Cb 0.06 0.68 0.01 0.00 0.00 0.00 0.00 23.12 23.87 2poz s ALA 381 CO 0.49 -0.69 -0.02 -1.12 0.00 0.00 0.00 175.76 174.42 2poz s SER 382 N -2.46 0.36 -0.09 0.00 0.01 -1.26 -0.88 113.70 109.38 2poz s SER 382 Ca -0.01 -0.04 0.02 0.00 1.31 0.00 0.00 55.95 57.24 2poz s SER 382 Cb -0.01 -0.10 0.01 0.00 0.21 0.00 0.00 66.02 66.13 2poz s SER 382 CO -0.09 -0.01 -0.16 0.00 0.41 0.00 0.00 173.24 173.39