#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gt3 s ALA 2 N 0.00 0.83 -0.36 0.00 0.00 -1.26 -1.39 121.76 119.58 3gt3 s ALA 2 Ca 0.00 -0.16 -0.07 0.00 0.00 0.00 0.00 51.96 51.72 3gt3 s ALA 2 Cb 0.00 -0.52 0.05 0.00 0.00 0.00 0.00 23.12 22.65 3gt3 s ALA 2 CO 0.00 -0.08 0.15 -1.14 0.00 0.00 0.00 175.76 174.69 3gt3 s GLN 3 N 1.06 2.60 0.58 0.00 0.74 0.58 -4.97 119.66 120.25 3gt3 s GLN 3 Ca -0.09 -1.26 -0.14 0.00 0.05 0.00 0.00 55.36 53.92 3gt3 s GLN 3 Cb -0.14 -3.56 -0.05 0.00 1.10 0.00 0.00 33.01 30.36 3gt3 s GLN 3 CO -0.01 -0.75 1.02 0.95 -0.55 0.00 0.00 175.29 175.96 3gt3 s THR 4 N 1.41 4.32 -1.42 -0.34 -4.23 -1.26 -1.13 115.64 112.99 3gt3 s THR 4 Ca 0.00 0.98 -0.01 0.00 -1.18 0.00 0.00 61.69 61.47 3gt3 s THR 4 Cb -0.20 -3.62 0.01 0.00 1.34 0.00 0.00 72.50 70.02 3gt3 s THR 4 CO 0.03 -0.77 0.47 0.59 -0.54 0.00 0.00 174.62 174.40 3gt3 n ASN 5 N -2.17 -0.62 -4.88 3.99 4.13 -1.01 -4.93 115.26 109.78 3gt3 n ASN 5 Ca 0.07 -0.99 -0.30 0.00 1.68 0.00 0.00 54.58 55.04 3gt3 n ASN 5 Cb 0.54 -3.14 -0.01 0.00 -1.54 0.00 0.00 39.78 35.63 3gt3 n ASN 5 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3gt3 s ALA 6 N -3.89 3.21 0.52 5.41 0.00 0.10 -5.02 121.76 122.08 3gt3 s ALA 6 Ca 0.05 -0.16 -0.22 0.00 0.00 0.00 0.00 51.96 51.63 3gt3 s ALA 6 Cb -0.03 -2.91 -0.07 0.00 0.00 0.00 0.00 23.12 20.11 3gt3 s ALA 6 CO 0.88 -0.43 1.08 -2.30 0.00 0.00 0.00 175.76 174.99 3gt3 n PRO 7 N -2.23 1.29 -0.27 0.00 -0.02 -1.26 -4.79 135.00 127.73 3gt3 n PRO 7 Ca 0.04 0.48 0.07 0.00 -2.02 0.00 0.00 63.50 62.07 3gt3 n PRO 7 Cb 0.54 -2.23 0.31 0.00 -0.02 0.00 0.00 33.50 32.10 3gt3 n PRO 7 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 3gt3 h TRP 8 N 1.15 0.92 -0.46 6.00 5.08 -1.90 -1.96 115.95 124.78 3gt3 h TRP 8 Ca -0.48 0.02 -0.07 0.00 1.08 0.00 0.00 58.89 59.44 3gt3 h TRP 8 Cb 1.34 -0.30 -0.02 0.00 -3.00 0.00 0.00 29.16 27.18 3gt3 h TRP 8 CO 0.42 0.43 -0.01 0.78 -1.28 0.00 0.00 178.44 178.77 3gt3 h GLY 9 N 0.86 0.83 0.88 11.11 0.00 -1.92 0.15 103.07 114.99 3gt3 h GLY 9 Ca 0.40 -0.56 -0.03 0.00 0.00 0.00 0.00 47.33 47.14 3gt3 h GLY 9 CO -0.17 0.52 0.06 1.41 0.00 0.00 0.00 176.54 178.36 3gt3 h LEU 10 N 0.72 0.45 -1.40 3.11 3.38 -1.72 -1.77 115.31 118.08 3gt3 h LEU 10 Ca 0.14 -0.25 0.03 0.00 0.09 0.00 0.00 57.88 57.89 3gt3 h LEU 10 Cb 0.46 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.06 3gt3 h LEU 10 CO 0.02 0.58 0.43 0.00 0.09 0.00 0.00 178.44 179.57 3gt3 h ALA 11 N 0.88 1.63 -0.44 1.53 0.00 -1.16 -2.64 119.26 119.07 3gt3 h ALA 11 Ca 0.09 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 3gt3 h ALA 11 Cb 0.32 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3gt3 h ALA 11 CO 0.00 0.30 -0.09 -0.09 0.00 0.00 0.00 179.25 179.38 3gt3 h ARG 12 N 0.78 0.83 0.00 0.00 9.65 -0.32 -2.73 114.38 122.59 3gt3 h ARG 12 Ca 0.26 -0.31 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 3gt3 h ARG 12 Cb 0.06 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 28.59 3gt3 h ARG 12 CO -0.07 0.94 0.00 0.44 2.80 0.00 0.00 179.97 184.08 3gt3 n ILE 13 N -4.30 0.39 -0.89 1.20 -5.35 -0.70 -1.90 119.36 107.82 3gt3 n ILE 13 Ca -0.00 0.10 0.08 0.00 -0.27 0.00 0.00 62.75 62.66 3gt3 n ILE 13 Cb 0.36 -0.72 0.25 0.00 -1.74 0.00 0.00 39.64 37.80 3gt3 n ILE 13 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3gt3 n SER 14 N -1.39 3.86 -4.25 7.28 3.41 -1.05 -0.19 113.62 121.29 3gt3 n SER 14 Ca 0.08 -2.88 -0.24 0.00 -0.26 0.00 0.00 58.87 55.56 3gt3 n SER 14 Cb 0.22 -0.51 -0.13 0.00 -0.26 0.00 0.00 64.21 63.52 3gt3 n SER 14 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3gt3 s SER 15 N -1.76 2.42 0.00 4.04 0.15 -0.80 -4.78 113.70 112.98 3gt3 s SER 15 Ca 0.41 -0.57 0.30 0.00 0.70 0.00 0.00 55.95 56.79 3gt3 s SER 15 Cb 0.32 -0.17 1.57 0.00 -1.71 0.00 0.00 66.02 66.02 3gt3 s SER 15 CO 0.10 0.12 2.07 0.35 1.20 0.00 0.00 173.24 177.07 3gt3 n THR 16 N 1.61 0.00 -3.92 6.45 -2.24 -1.26 -4.87 114.28 110.05 3gt3 n THR 16 Ca -0.18 -0.01 -0.11 0.00 -2.27 0.00 0.00 64.05 61.48 3gt3 n THR 16 Cb 0.53 -0.42 -0.12 0.00 -2.10 0.00 0.00 70.33 68.22 3gt3 n THR 16 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3gt3 s SER 17 N -2.40 0.10 0.85 3.42 0.01 -1.26 -5.12 113.70 109.30 3gt3 s SER 17 Ca 0.34 -0.24 -0.12 0.00 1.31 0.00 0.00 55.95 57.24 3gt3 s SER 17 Cb 0.21 0.10 0.10 0.00 0.21 0.00 0.00 66.02 66.64 3gt3 s SER 17 CO 0.44 -0.19 1.11 -2.16 0.41 0.00 0.00 173.24 172.84 3gt3 s PRO 18 N -0.85 1.65 0.00 12.44 0.04 -1.26 -4.48 135.00 142.53 3gt3 s PRO 18 Ca -0.09 0.58 0.00 0.00 0.04 0.00 0.00 61.00 61.53 3gt3 s PRO 18 Cb -0.06 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.61 3gt3 s PRO 18 CO -0.00 -1.91 0.00 0.41 0.04 0.00 0.00 177.00 175.54 3gt3 n GLY 19 N -1.92 0.68 3.74 0.56 0.00 -1.26 -5.07 105.19 101.92 3gt3 n GLY 19 Ca 0.07 -0.48 -0.25 0.00 0.00 0.00 0.00 46.02 45.36 3gt3 n GLY 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gt3 s THR 20 N -2.00 2.26 -0.01 2.61 -4.23 -1.26 -5.07 115.64 107.94 3gt3 s THR 20 Ca 0.00 -1.70 0.01 0.00 -1.18 0.00 0.00 61.69 58.82 3gt3 s THR 20 Cb 0.00 -2.97 0.02 0.00 1.34 0.00 0.00 72.50 70.89 3gt3 s THR 20 CO 0.00 0.00 0.76 -1.54 -0.54 0.00 0.00 174.62 173.30 3gt3 n SER 21 N -1.25 0.36 -4.43 3.99 3.41 -1.26 -4.74 113.62 109.71 3gt3 n SER 21 Ca -0.01 -1.57 -0.33 0.00 -0.26 0.00 0.00 58.87 56.69 3gt3 n SER 21 Cb 0.65 -0.10 -0.13 0.00 -0.26 0.00 0.00 64.21 64.37 3gt3 n SER 21 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3gt3 s THR 22 N -0.29 3.39 -0.19 6.66 2.01 -1.26 -0.72 115.64 125.23 3gt3 s THR 22 Ca 0.02 -0.54 -0.14 0.00 0.31 0.00 0.00 61.69 61.33 3gt3 s THR 22 Cb 0.02 -2.44 -0.04 0.00 0.01 0.00 0.00 72.50 70.04 3gt3 s THR 22 CO 0.00 0.52 0.33 -0.47 -0.69 0.00 0.00 174.62 174.31 3gt3 s TYR 23 N 0.27 3.39 -0.13 4.92 5.04 -0.29 -4.47 117.35 126.09 3gt3 s TYR 23 Ca -0.07 0.56 -0.00 0.00 -2.44 0.00 0.00 57.07 55.11 3gt3 s TYR 23 Cb -0.15 -2.43 -0.02 0.00 0.35 0.00 0.00 41.96 39.71 3gt3 s TYR 23 CO 0.04 0.08 -0.12 0.71 -1.34 0.00 0.00 175.55 174.92 3gt3 s TYR 24 N 1.01 2.83 0.02 4.97 2.02 -1.26 -0.31 117.35 126.63 3gt3 s TYR 24 Ca 0.17 -0.59 -0.26 0.00 -0.37 0.00 0.00 57.07 56.02 3gt3 s TYR 24 Cb -0.14 -1.84 0.06 0.00 -0.40 0.00 0.00 41.96 39.64 3gt3 s TYR 24 CO 0.06 -0.18 0.59 1.52 -1.57 0.00 0.00 175.55 175.98 3gt3 s TYR 25 N 0.30 -0.53 0.25 2.71 -0.85 -0.48 -4.73 117.35 114.01 3gt3 s TYR 25 Ca -0.09 0.73 -0.30 0.00 -0.52 0.00 0.00 57.07 56.88 3gt3 s TYR 25 Cb -0.16 0.40 -0.11 0.00 0.38 0.00 0.00 41.96 42.48 3gt3 s TYR 25 CO 0.05 -0.65 1.51 0.34 -1.52 0.00 0.00 175.55 175.28 3gt3 s ASP 26 N -1.73 6.55 0.67 -0.18 2.15 -1.26 -0.40 116.67 122.46 3gt3 s ASP 26 Ca -0.07 2.76 0.43 0.00 0.43 0.00 0.00 52.55 56.10 3gt3 s ASP 26 Cb -0.01 -2.62 2.36 0.00 -0.30 0.00 0.00 42.92 42.35 3gt3 s ASP 26 CO 0.02 -0.79 2.33 1.05 -0.17 0.00 0.00 175.17 177.61 3gt3 h GLU 27 N 5.18 0.00 -0.74 4.34 9.09 -2.01 -1.40 114.58 129.05 3gt3 h GLU 27 Ca -0.46 0.00 0.06 0.00 0.05 0.00 0.00 59.36 59.01 3gt3 h GLU 27 Cb 1.22 0.00 -0.05 0.00 -1.65 0.00 0.00 28.75 28.27 3gt3 h GLU 27 CO 0.80 0.00 0.49 0.66 0.05 0.00 0.00 179.01 181.01 3gt3 h SER 28 N 0.00 0.69 -4.90 3.06 4.64 -1.99 -3.46 113.55 111.59 3gt3 h SER 28 Ca 0.00 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.94 3gt3 h SER 28 Cb 0.07 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 62.00 3gt3 h SER 28 CO -0.00 0.45 -0.57 0.00 -0.87 0.00 0.00 176.83 175.84 3gt3 n ALA 29 N -2.44 -1.00 -1.01 5.18 0.00 -0.53 -1.00 120.51 119.71 3gt3 n ALA 29 Ca 0.11 0.18 -0.00 0.00 0.00 0.00 0.00 53.44 53.72 3gt3 n ALA 29 Cb 0.21 -3.22 -0.00 0.00 0.00 0.00 0.00 19.45 16.45 3gt3 n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gt3 n GLY 30 N -1.31 0.46 3.70 0.00 0.00 -1.26 -0.15 105.19 106.63 3gt3 n GLY 30 Ca -0.07 -0.11 -0.43 0.00 0.00 0.00 0.00 46.02 45.40 3gt3 n GLY 30 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3gt3 n GLN 31 N -2.69 2.26 -0.10 1.61 7.27 -0.17 -1.89 117.38 123.67 3gt3 n GLN 31 Ca -0.00 0.80 0.00 0.00 0.07 0.00 0.00 57.00 57.87 3gt3 n GLN 31 Cb 0.04 -2.49 0.00 0.00 2.41 0.00 0.00 30.24 30.20 3gt3 n GLN 31 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3gt3 n GLY 32 N 1.95 1.35 4.01 1.69 0.00 -1.26 -4.83 105.19 108.10 3gt3 n GLY 32 Ca 0.10 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.94 3gt3 n GLY 32 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3gt3 s SER 33 N -3.00 5.60 -0.01 1.61 1.04 -0.79 -1.04 113.70 117.11 3gt3 s SER 33 Ca 0.00 -0.46 0.00 0.00 0.48 0.00 0.00 55.95 55.97 3gt3 s SER 33 Cb 0.00 -0.57 0.01 0.00 0.10 0.00 0.00 66.02 65.57 3gt3 s SER 33 CO 0.00 -0.82 -0.00 0.00 0.98 0.00 0.00 173.24 173.40 3gt3 s VAL 35 N 0.42 1.58 -0.05 0.00 1.01 0.25 -0.77 120.40 122.84 3gt3 s VAL 35 Ca -0.04 -0.66 -0.23 0.00 0.00 0.00 0.00 61.98 61.05 3gt3 s VAL 35 Cb -0.06 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.82 3gt3 s VAL 35 CO -0.01 0.46 0.70 -0.31 0.00 0.00 0.00 175.10 175.94 3gt3 s TYR 36 N 1.25 3.61 -0.36 5.22 2.02 0.36 -1.02 117.35 128.42 3gt3 s TYR 36 Ca -0.00 1.27 -0.07 0.00 -0.37 0.00 0.00 57.07 57.90 3gt3 s TYR 36 Cb -0.14 -2.79 0.05 0.00 -0.40 0.00 0.00 41.96 38.68 3gt3 s TYR 36 CO -0.07 0.14 0.15 0.08 -1.57 0.00 0.00 175.55 174.27 3gt3 s VAL 37 N 0.60 3.86 -0.47 0.71 1.01 -0.09 -0.18 120.40 125.84 3gt3 s VAL 37 Ca 0.37 -1.24 -0.14 0.00 0.00 0.00 0.00 61.98 60.97 3gt3 s VAL 37 Cb -0.18 -3.25 0.08 0.00 0.00 0.00 0.00 36.38 33.03 3gt3 s VAL 37 CO 0.19 -0.28 0.39 -0.63 0.00 0.00 0.00 175.10 174.76 3gt3 s ILE 38 N 1.39 5.03 0.00 2.22 1.01 -0.79 -1.89 121.20 128.18 3gt3 s ILE 38 Ca 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 60.65 59.44 3gt3 s ILE 38 Cb -0.20 -4.06 0.00 0.00 0.01 0.00 0.00 42.46 38.21 3gt3 s ILE 38 CO 0.02 -0.62 0.00 -0.67 0.00 0.00 0.00 174.94 173.68 3gt3 n ASP 39 N 5.15 0.18 -0.19 3.58 -0.08 -0.43 -4.30 116.55 120.46 3gt3 n ASP 39 Ca -0.12 0.00 0.12 0.00 -1.51 0.00 0.00 54.79 53.28 3gt3 n ASP 39 Cb 0.43 0.00 0.60 0.00 2.34 0.00 0.00 41.12 44.49 3gt3 n ASP 39 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 3gt3 n THR 40 N 0.00 0.05 0.00 5.18 -2.24 -1.26 -1.35 114.28 114.66 3gt3 n THR 40 Ca 0.00 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 3gt3 n THR 40 Cb 0.00 -0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.15 3gt3 n THR 40 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gt3 n GLY 41 N 0.97 -0.53 2.87 3.38 0.00 -1.26 -4.06 105.19 106.57 3gt3 n GLY 41 Ca 0.18 -2.26 -0.15 0.00 0.00 0.00 0.00 46.02 43.79 3gt3 n GLY 41 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gt3 s ILE 42 N -0.59 -0.09 -1.09 -0.61 1.01 -1.26 -2.85 121.20 115.71 3gt3 s ILE 42 Ca 0.00 0.23 -0.22 0.00 0.00 0.00 0.00 60.65 60.66 3gt3 s ILE 42 Cb 0.00 -0.22 0.04 0.00 0.01 0.00 0.00 42.46 42.28 3gt3 s ILE 42 CO 0.00 0.09 1.60 -0.70 0.00 0.00 0.00 174.94 175.93 3gt3 s GLU 43 N 1.42 3.54 0.47 2.79 2.12 -1.26 -4.43 118.70 123.35 3gt3 s GLU 43 Ca -0.06 -1.27 0.22 0.00 0.36 0.00 0.00 54.97 54.22 3gt3 s GLU 43 Cb -0.12 -5.37 1.19 0.00 0.26 0.00 0.00 34.13 30.09 3gt3 s GLU 43 CO -0.05 -2.43 2.00 0.00 -0.54 0.00 0.00 175.26 174.24 3gt3 h ALA 44 N 9.37 1.38 0.00 6.30 0.00 -1.97 -1.37 119.26 132.97 3gt3 h ALA 44 Ca 0.26 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3gt3 h ALA 44 Cb 0.97 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3gt3 h ALA 44 CO 1.41 0.23 0.00 -1.13 0.00 0.00 0.00 179.25 179.76 3gt3 n SER 45 N -3.86 0.00 -4.69 0.00 3.41 -1.26 -4.63 113.62 102.59 3gt3 n SER 45 Ca -0.02 0.26 -0.45 0.00 -0.26 0.00 0.00 58.87 58.40 3gt3 n SER 45 Cb 0.28 -0.39 -0.04 0.00 -0.26 0.00 0.00 64.21 63.80 3gt3 n SER 45 CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 175.04 176.45 3gt3 n HIS 46 N -1.39 2.44 -0.08 7.33 -0.00 -0.52 -4.84 115.22 118.17 3gt3 n HIS 46 Ca 0.06 0.21 0.24 0.00 0.46 0.00 0.00 57.72 58.69 3gt3 n HIS 46 Cb 0.17 -2.58 0.71 0.00 -0.12 0.00 0.00 29.99 28.17 3gt3 n HIS 46 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 3gt3 h PRO 47 N 6.04 0.00 0.00 1.57 0.11 -1.91 -0.70 132.00 137.12 3gt3 h PRO 47 Ca -0.44 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.66 3gt3 h PRO 47 Cb 1.24 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 3gt3 h PRO 47 CO 0.90 0.00 -0.01 0.93 -0.21 0.00 0.00 178.00 179.61 3gt3 h GLU 48 N 0.00 0.00 0.00 1.05 4.39 -1.94 -2.42 114.58 115.66 3gt3 h GLU 48 Ca 0.33 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.03 3gt3 h GLU 48 Cb 1.37 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.02 3gt3 h GLU 48 CO -0.00 0.01 -0.72 1.19 -1.16 0.00 0.00 179.01 178.33 3gt3 n PHE 49 N -3.23 0.31 -2.11 4.33 3.72 -0.27 -1.50 117.46 118.71 3gt3 n PHE 49 Ca -0.02 0.09 -0.21 0.00 -0.05 0.00 0.00 57.45 57.26 3gt3 n PHE 49 Cb 0.13 -0.47 -0.04 0.00 -0.94 0.00 0.00 39.48 38.16 3gt3 n PHE 49 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3gt3 n GLU 50 N -1.89 -1.59 -0.76 -1.08 1.02 -0.91 -0.75 120.64 114.67 3gt3 n GLU 50 Ca 0.03 1.10 0.00 0.00 -0.02 0.00 0.00 57.16 58.27 3gt3 n GLU 50 Cb 0.41 -5.66 0.00 0.00 -0.02 0.00 0.00 31.44 26.17 3gt3 n GLU 50 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gt3 n GLY 51 N -0.79 0.87 0.37 0.62 0.00 -1.26 -4.91 105.19 100.08 3gt3 n GLY 51 Ca -0.23 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.92 3gt3 n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gt3 n ARG 52 N -2.04 1.24 -4.18 1.61 1.74 0.07 -4.88 116.66 110.22 3gt3 n ARG 52 Ca 0.00 -0.75 -0.31 0.00 -0.77 0.00 0.00 57.85 56.02 3gt3 n ARG 52 Cb 0.00 -1.48 -0.08 0.00 -1.02 0.00 0.00 32.46 29.88 3gt3 n ARG 52 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3gt3 s ALA 53 N -2.28 3.34 -0.06 7.54 0.00 -1.26 -1.36 121.76 127.68 3gt3 s ALA 53 Ca 0.30 -1.02 -0.24 0.00 0.00 0.00 0.00 51.96 51.00 3gt3 s ALA 53 Cb 0.20 -1.31 0.05 0.00 0.00 0.00 0.00 23.12 22.06 3gt3 s ALA 53 CO 0.44 0.69 0.53 1.14 0.00 0.00 0.00 175.76 178.56 3gt3 s GLN 54 N -1.98 0.86 0.07 0.00 -2.07 -0.69 -4.84 119.66 111.01 3gt3 s GLN 54 Ca 0.24 0.18 -0.28 0.00 -1.82 0.00 0.00 55.36 53.67 3gt3 s GLN 54 Cb -0.12 0.40 -0.05 0.00 -1.09 0.00 0.00 33.01 32.15 3gt3 s GLN 54 CO 0.15 -0.24 0.90 -1.64 -1.32 0.00 0.00 175.29 173.14 3gt3 s MET 55 N -1.02 4.61 -0.00 9.60 -1.94 -1.26 -0.31 119.30 128.98 3gt3 s MET 55 Ca -0.10 1.31 0.02 0.00 -1.71 0.00 0.00 55.69 55.21 3gt3 s MET 55 Cb -0.02 -3.38 -0.02 0.00 2.01 0.00 0.00 34.83 33.41 3gt3 s MET 55 CO 0.07 0.20 0.05 1.33 -0.01 0.00 0.00 175.02 176.66 3gt3 n VAL 56 N 2.94 0.00 -3.62 -6.03 0.24 -0.05 -4.84 118.33 106.97 3gt3 n VAL 56 Ca 0.01 -0.21 -0.14 0.00 -2.04 0.00 0.00 64.34 61.96 3gt3 n VAL 56 Cb 0.50 0.68 -0.07 0.00 -1.47 0.00 0.00 33.84 33.48 3gt3 n VAL 56 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 3gt3 s LYS 57 N -1.73 0.85 0.04 7.34 2.47 -1.10 -5.04 119.74 122.57 3gt3 s LYS 57 Ca -0.00 0.89 0.01 0.00 -1.56 0.00 0.00 55.97 55.31 3gt3 s LYS 57 Cb 0.01 0.41 -0.03 0.00 -1.46 0.00 0.00 37.83 36.77 3gt3 s LYS 57 CO 0.07 -0.13 -0.05 -0.08 0.16 0.00 0.00 175.35 175.33 3gt3 s THR 58 N 0.18 0.33 -1.30 3.43 -1.32 -1.26 -0.76 115.64 114.94 3gt3 s THR 58 Ca -0.01 -1.20 0.14 0.00 -1.21 0.00 0.00 61.69 59.40 3gt3 s THR 58 Cb -0.04 -0.71 0.36 0.00 -1.51 0.00 0.00 72.50 70.60 3gt3 s THR 58 CO 0.02 -0.57 1.28 -1.22 -2.21 0.00 0.00 174.62 171.92 3gt3 n TYR 59 N 1.17 0.52 -4.48 9.09 4.01 -1.04 -4.96 117.16 121.47 3gt3 n TYR 59 Ca -0.21 -0.43 -0.22 0.00 -0.16 0.00 0.00 57.90 56.89 3gt3 n TYR 59 Cb 0.56 -0.02 -0.05 0.00 -0.31 0.00 0.00 39.34 39.53 3gt3 n TYR 59 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3gt3 n TYR 60 N 0.83 0.56 0.31 -0.72 4.01 -1.26 -5.04 117.16 115.85 3gt3 n TYR 60 Ca 0.14 -1.85 0.17 0.00 -0.16 0.00 0.00 57.90 56.19 3gt3 n TYR 60 Cb 0.46 -0.15 0.71 0.00 -0.31 0.00 0.00 39.34 40.05 3gt3 n TYR 60 CO 0.00 0.00 0.00 0.10 -0.46 0.00 0.00 176.86 176.50 3gt3 h TYR 61 N 1.31 0.00 -3.88 -0.72 -0.00 -2.00 -3.42 116.97 108.25 3gt3 h TYR 61 Ca -0.28 0.00 -0.25 0.00 0.00 0.00 0.00 58.73 58.20 3gt3 h TYR 61 Cb 0.91 0.00 -0.18 0.00 0.00 0.00 0.00 36.73 37.46 3gt3 h TYR 61 CO 0.00 0.00 -0.72 0.45 -0.00 0.00 0.00 178.16 177.89 3gt3 s SER 62 N -5.19 1.04 0.00 0.10 0.15 -1.26 -5.01 113.70 103.54 3gt3 s SER 62 Ca 0.01 -0.79 0.27 0.00 0.70 0.00 0.00 55.95 56.14 3gt3 s SER 62 Cb 0.09 0.06 0.86 0.00 -1.71 0.00 0.00 66.02 65.32 3gt3 s SER 62 CO 0.47 -0.33 1.63 -1.54 1.20 0.00 0.00 173.24 174.67 3gt3 n SER 63 N 0.67 1.61 -4.77 5.45 3.41 -1.26 -4.81 113.62 113.92 3gt3 n SER 63 Ca -0.17 -1.45 -0.37 0.00 -0.26 0.00 0.00 58.87 56.62 3gt3 n SER 63 Cb 0.58 0.04 -0.00 0.00 -0.26 0.00 0.00 64.21 64.57 3gt3 n SER 63 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3gt3 s ARG 64 N -2.11 3.67 -0.74 4.33 3.00 -1.26 -4.43 118.95 121.41 3gt3 s ARG 64 Ca 0.34 1.83 -0.27 0.00 0.00 0.00 0.00 55.73 57.63 3gt3 s ARG 64 Cb 0.20 -2.38 0.02 0.00 0.00 0.00 0.00 34.95 32.80 3gt3 s ARG 64 CO 0.37 -0.65 1.41 0.34 0.00 0.00 0.00 175.30 176.78 3gt3 s ASP 65 N -1.31 6.00 -0.07 0.23 2.15 -1.26 -4.80 116.67 117.61 3gt3 s ASP 65 Ca 0.65 -0.38 0.13 0.00 0.43 0.00 0.00 52.55 53.38 3gt3 s ASP 65 Cb -0.30 -2.55 0.48 0.00 -0.30 0.00 0.00 42.92 40.25 3gt3 s ASP 65 CO 0.36 -1.93 1.35 0.61 -0.17 0.00 0.00 175.17 175.39 3gt3 n GLY 66 N 5.57 1.81 0.68 2.66 0.00 -1.26 -4.43 105.19 110.22 3gt3 n GLY 66 Ca 0.09 -0.57 -0.08 0.00 0.00 0.00 0.00 46.02 45.46 3gt3 n GLY 66 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3gt3 n ASN 67 N 0.72 1.04 0.00 1.61 2.85 -1.26 -4.89 115.26 115.34 3gt3 n ASN 67 Ca 0.17 0.16 0.00 0.00 -0.11 0.00 0.00 54.58 54.81 3gt3 n ASN 67 Cb 0.61 -0.39 0.00 0.00 1.24 0.00 0.00 39.78 41.25 3gt3 n ASN 67 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3gt3 n GLY 68 N 2.52 1.40 0.10 8.20 0.00 -1.26 -4.89 105.19 111.25 3gt3 n GLY 68 Ca -0.14 -0.24 -0.09 0.00 0.00 0.00 0.00 46.02 45.55 3gt3 n GLY 68 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3gt3 h HIS 69 N 0.00 -0.10 -0.92 1.61 6.17 -1.94 0.30 115.15 120.27 3gt3 h HIS 69 Ca 0.00 0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.10 3gt3 h HIS 69 Cb 0.00 0.07 -0.04 0.00 2.52 0.00 0.00 27.41 29.95 3gt3 h HIS 69 CO 0.00 -0.08 0.59 0.78 0.71 0.00 0.00 177.93 179.93 3gt3 h GLY 70 N -0.01 1.30 1.04 5.26 0.00 -1.89 -1.29 103.07 107.48 3gt3 h GLY 70 Ca 0.08 -0.51 -0.04 0.00 0.00 0.00 0.00 47.33 46.87 3gt3 h GLY 70 CO -0.18 0.49 0.36 -0.84 0.00 0.00 0.00 176.54 176.38 3gt3 h THR 71 N 1.25 1.26 -0.07 4.70 2.02 -1.28 0.78 112.91 121.57 3gt3 h THR 71 Ca 0.33 -0.76 -0.00 0.00 0.77 0.00 0.00 66.41 66.75 3gt3 h THR 71 Cb -0.11 0.25 -0.00 0.00 -1.74 0.00 0.00 68.15 66.54 3gt3 h THR 71 CO -0.07 0.32 0.03 -0.74 0.37 0.00 0.00 175.52 175.43 3gt3 h HIS 72 N 1.17 0.10 -0.36 3.16 6.17 -0.38 -0.26 115.15 124.75 3gt3 h HIS 72 Ca 0.28 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.35 3gt3 h HIS 72 Cb 0.16 -0.03 -0.02 0.00 2.52 0.00 0.00 27.41 30.04 3gt3 h HIS 72 CO 0.02 0.19 0.24 0.00 0.71 0.00 0.00 177.93 179.08 3gt3 h ALA 74 N 1.13 1.51 -0.98 0.00 0.00 -0.76 -1.64 119.26 118.52 3gt3 h ALA 74 Ca 0.13 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3gt3 h ALA 74 Cb -0.05 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.41 3gt3 h ALA 74 CO -0.03 0.45 0.63 0.78 0.00 0.00 0.00 179.25 181.08 3gt3 h GLY 75 N 0.96 1.39 1.65 0.00 0.00 -0.34 -1.42 103.07 105.30 3gt3 h GLY 75 Ca 0.27 -0.54 -0.14 0.00 0.00 0.00 0.00 47.33 46.92 3gt3 h GLY 75 CO -0.06 0.53 -0.54 -0.84 0.00 0.00 0.00 176.54 175.63 3gt3 h THR 76 N 1.33 1.34 0.36 4.70 2.02 -0.61 -0.80 112.91 121.25 3gt3 h THR 76 Ca 0.35 -1.81 -0.02 0.00 0.77 0.00 0.00 66.41 65.71 3gt3 h THR 76 Cb -0.12 1.83 0.00 0.00 -1.74 0.00 0.00 68.15 68.13 3gt3 h THR 76 CO -0.07 0.55 -0.17 0.58 0.37 0.00 0.00 175.52 176.77 3gt3 h VAL 77 N 0.29 0.66 0.00 3.16 2.07 -0.92 -0.28 116.25 121.22 3gt3 h VAL 77 Ca 0.01 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.43 3gt3 h VAL 77 Cb 1.04 0.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 3gt3 h VAL 77 CO 0.09 0.02 0.00 0.61 0.02 0.00 0.00 177.57 178.31 3gt3 n GLY 78 N -1.16 -1.44 3.77 2.17 0.00 -0.57 -0.61 105.19 107.35 3gt3 n GLY 78 Ca -0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.59 3gt3 n GLY 78 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3gt3 s SER 79 N 0.00 5.00 0.21 1.61 1.04 -0.35 -4.53 113.70 116.69 3gt3 s SER 79 Ca 0.00 1.92 -0.10 0.00 0.48 0.00 0.00 55.95 58.25 3gt3 s SER 79 Cb 0.00 -2.54 0.17 0.00 0.10 0.00 0.00 66.02 63.75 3gt3 s SER 79 CO 0.00 -1.70 1.88 0.08 0.98 0.00 0.00 173.24 174.48 3gt3 h ARG 80 N -0.30 1.01 0.06 4.02 0.11 -1.55 -1.01 114.38 116.72 3gt3 h ARG 80 Ca -0.46 -0.06 -0.38 0.00 0.10 0.00 0.00 59.98 59.19 3gt3 h ARG 80 Cb 1.24 -0.23 -0.04 0.00 1.11 0.00 0.00 29.97 32.05 3gt3 h ARG 80 CO 0.54 0.67 -2.20 2.41 0.10 0.00 0.00 179.97 181.48 3gt3 n THR 81 N -4.55 1.63 0.85 0.08 -1.04 -1.26 -4.58 114.28 105.40 3gt3 n THR 81 Ca 0.08 -0.57 0.10 0.00 -2.04 0.00 0.00 64.05 61.62 3gt3 n THR 81 Cb 0.02 -1.62 0.07 0.00 -1.82 0.00 0.00 70.33 66.98 3gt3 n THR 81 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3gt3 n TYR 82 N -3.48 0.00 -4.10 -1.42 4.01 -1.24 -4.72 117.16 106.21 3gt3 n TYR 82 Ca -0.40 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.07 3gt3 n TYR 82 Cb 0.99 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.96 3gt3 n TYR 82 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 3gt3 s GLY 83 N -1.75 1.79 0.07 2.72 0.00 -0.38 -4.13 107.32 105.64 3gt3 s GLY 83 Ca 0.23 -1.19 -0.16 0.00 0.00 0.00 0.00 44.72 43.60 3gt3 s GLY 83 CO 0.28 -1.19 1.29 -2.08 0.00 0.00 0.00 173.10 171.40 3gt3 h VAL 84 N 2.26 1.33 -3.29 1.40 2.07 -0.64 -3.40 116.25 115.98 3gt3 h VAL 84 Ca -0.47 -1.75 -0.65 0.00 0.82 0.00 0.00 66.70 64.65 3gt3 h VAL 84 Cb 1.19 2.00 -0.40 0.00 -1.52 0.00 0.00 31.29 32.56 3gt3 h VAL 84 CO 0.63 0.54 -0.52 0.00 0.02 0.00 0.00 177.57 178.24 3gt3 s ALA 85 N -3.87 3.63 -1.66 1.67 0.00 0.22 -4.91 121.76 116.85 3gt3 s ALA 85 Ca -0.12 -3.55 0.25 0.00 0.00 0.00 0.00 51.96 48.55 3gt3 s ALA 85 Cb 0.07 -2.30 1.37 0.00 0.00 0.00 0.00 23.12 22.26 3gt3 s ALA 85 CO 0.84 -2.08 1.86 1.63 0.00 0.00 0.00 175.76 178.01 3gt3 n LYS 86 N 2.66 0.54 -0.06 0.00 5.02 -1.05 -2.44 118.16 122.83 3gt3 n LYS 86 Ca 0.12 0.03 0.03 0.00 -2.02 0.00 0.00 58.31 56.48 3gt3 n LYS 86 Cb 0.34 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 33.89 3gt3 n LYS 86 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3gt3 n LYS 87 N -1.17 1.86 -1.27 1.97 4.01 0.79 -4.70 118.16 119.66 3gt3 n LYS 87 Ca 0.15 -1.64 -0.30 0.00 -0.51 0.00 0.00 58.31 56.01 3gt3 n LYS 87 Cb 0.15 -1.04 0.11 0.00 -0.51 0.00 0.00 35.03 33.74 3gt3 n LYS 87 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 3gt3 s THR 88 N -1.33 3.05 -0.14 -0.18 -1.32 -1.02 -3.85 115.64 110.85 3gt3 s THR 88 Ca 0.09 0.34 -0.16 0.00 -1.21 0.00 0.00 61.69 60.76 3gt3 s THR 88 Cb 0.08 -2.86 -0.04 0.00 -1.51 0.00 0.00 72.50 68.17 3gt3 s THR 88 CO 0.01 -0.45 0.37 -1.10 -2.21 0.00 0.00 174.62 171.24 3gt3 s GLN 89 N -4.94 4.29 -0.18 7.08 -1.52 -1.04 -4.89 119.66 118.46 3gt3 s GLN 89 Ca 0.62 0.24 -0.05 0.00 -1.95 0.00 0.00 55.36 54.23 3gt3 s GLN 89 Cb -0.17 -3.43 -0.03 0.00 -0.22 0.00 0.00 33.01 29.16 3gt3 s GLN 89 CO 0.56 0.20 -0.01 -0.51 -0.25 0.00 0.00 175.29 175.28 3gt3 s LEU 90 N 0.54 3.28 -0.16 2.90 1.43 -0.47 -0.58 118.68 125.62 3gt3 s LEU 90 Ca 0.20 -0.16 0.02 0.00 -1.03 0.00 0.00 54.13 53.16 3gt3 s LEU 90 Cb -0.14 -1.82 0.01 0.00 0.03 0.00 0.00 46.19 44.28 3gt3 s LEU 90 CO 0.07 0.11 -0.20 -0.36 0.23 0.00 0.00 176.35 176.19 3gt3 s PHE 91 N 0.73 2.73 -0.06 0.29 0.08 -0.19 -1.71 117.98 119.85 3gt3 s PHE 91 Ca -0.00 -1.41 -0.15 0.00 0.12 0.00 0.00 56.93 55.48 3gt3 s PHE 91 Cb -0.14 -1.87 -0.05 0.00 -0.57 0.00 0.00 43.02 40.39 3gt3 s PHE 91 CO 0.02 -0.67 0.40 0.20 -0.10 0.00 0.00 175.22 175.08 3gt3 s GLY 92 N 1.01 2.40 -0.25 4.36 0.00 0.58 -0.91 107.32 114.51 3gt3 s GLY 92 Ca -0.02 -0.26 0.01 0.00 0.00 0.00 0.00 44.72 44.45 3gt3 s GLY 92 CO -0.06 0.36 -0.03 0.14 0.00 0.00 0.00 173.10 173.51 3gt3 s VAL 93 N -0.35 1.56 -0.83 1.40 1.01 -0.79 -0.87 120.40 121.53 3gt3 s VAL 93 Ca 0.23 -1.37 -0.20 0.00 0.00 0.00 0.00 61.98 60.64 3gt3 s VAL 93 Cb -0.16 -1.89 0.12 0.00 0.00 0.00 0.00 36.38 34.45 3gt3 s VAL 93 CO 0.11 -0.21 1.04 -0.75 0.00 0.00 0.00 175.10 175.28 3gt3 s LYS 94 N 1.36 3.43 0.00 2.72 2.20 0.06 -1.31 119.74 128.20 3gt3 s LYS 94 Ca -0.02 -1.52 0.22 0.00 -0.36 0.00 0.00 55.97 54.29 3gt3 s LYS 94 Cb -0.19 -4.68 -0.02 0.00 -1.51 0.00 0.00 37.83 31.44 3gt3 s LYS 94 CO -0.08 -1.75 1.05 1.33 -0.36 0.00 0.00 175.35 175.54 3gt3 n VAL 95 N 5.56 0.00 -4.70 4.02 0.24 -0.46 -2.51 118.33 120.49 3gt3 n VAL 95 Ca 0.14 -0.01 -0.33 0.00 -2.04 0.00 0.00 64.34 62.10 3gt3 n VAL 95 Cb 0.47 0.80 -0.12 0.00 -1.47 0.00 0.00 33.84 33.52 3gt3 n VAL 95 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3gt3 s LEU 96 N -2.98 3.01 1.16 1.34 1.43 -0.79 -4.52 118.68 117.32 3gt3 s LEU 96 Ca 0.09 -0.11 -0.19 0.00 -1.03 0.00 0.00 54.13 52.89 3gt3 s LEU 96 Cb 0.16 -1.65 0.27 0.00 0.03 0.00 0.00 46.19 45.01 3gt3 s LEU 96 CO 0.81 0.33 1.18 1.51 0.23 0.00 0.00 176.35 180.41 3gt3 s ASP 97 N -0.60 1.35 0.00 2.29 1.47 0.15 -4.32 116.67 117.01 3gt3 s ASP 97 Ca 0.09 0.46 0.22 0.00 1.18 0.00 0.00 52.55 54.50 3gt3 s ASP 97 Cb -0.12 -0.59 1.14 0.00 -0.34 0.00 0.00 42.92 43.01 3gt3 s ASP 97 CO 0.02 -3.84 1.73 0.47 0.68 0.00 0.00 175.17 174.22 3gt3 n ASP 98 N -4.55 0.00 -0.50 2.11 8.00 -1.26 -0.89 116.55 119.47 3gt3 n ASP 98 Ca 0.15 -0.06 0.14 0.00 0.71 0.00 0.00 54.79 55.72 3gt3 n ASP 98 Cb 0.60 -0.27 0.46 0.00 -0.02 0.00 0.00 41.12 41.88 3gt3 n ASP 98 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3gt3 n ASN 99 N -1.27 1.59 0.00 -2.24 3.02 -1.26 -4.05 115.26 111.05 3gt3 n ASN 99 Ca 0.11 -1.47 0.00 0.00 -0.03 0.00 0.00 54.58 53.18 3gt3 n ASN 99 Cb 0.17 0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.37 3gt3 n ASN 99 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gt3 n GLY 100 N 1.21 0.75 3.69 7.41 0.00 -0.06 -5.06 105.19 113.13 3gt3 n GLY 100 Ca 0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.96 3gt3 n GLY 100 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gt3 s SER 101 N -2.26 4.85 -0.19 1.61 0.01 -1.26 -4.80 113.70 111.66 3gt3 s SER 101 Ca 0.00 -0.48 -0.28 0.00 1.31 0.00 0.00 55.95 56.50 3gt3 s SER 101 Cb 0.00 -1.03 0.12 0.00 0.21 0.00 0.00 66.02 65.32 3gt3 s SER 101 CO 0.00 0.02 0.97 -0.83 0.41 0.00 0.00 173.24 173.81 3gt3 s GLY 102 N -3.50 -0.26 0.40 3.44 0.00 -1.26 0.33 107.32 106.46 3gt3 s GLY 102 Ca 0.31 2.18 -0.25 0.00 0.00 0.00 0.00 44.72 46.96 3gt3 s GLY 102 CO 0.21 1.31 1.14 1.20 0.00 0.00 0.00 173.10 176.96 3gt3 s GLN 103 N -0.63 4.10 0.44 2.90 1.11 -1.26 -4.92 119.66 121.39 3gt3 s GLN 103 Ca -0.01 1.76 0.11 0.00 0.01 0.00 0.00 55.36 57.23 3gt3 s GLN 103 Cb -0.02 -2.66 0.99 0.00 -1.01 0.00 0.00 33.01 30.31 3gt3 s GLN 103 CO -0.00 -0.26 2.04 1.88 0.01 0.00 0.00 175.29 178.96 3gt3 h TYR 104 N 2.65 0.40 -0.32 0.91 0.05 -1.99 -1.42 116.97 117.26 3gt3 h TYR 104 Ca -0.49 0.01 -0.06 0.00 0.05 0.00 0.00 58.73 58.25 3gt3 h TYR 104 Cb 1.23 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 38.82 3gt3 h TYR 104 CO 0.56 0.23 -0.04 0.66 -1.05 0.00 0.00 178.16 178.52 3gt3 h SER 105 N 0.42 0.47 -0.25 3.88 4.64 -1.99 0.35 113.55 121.07 3gt3 h SER 105 Ca 0.18 -0.10 -0.08 0.00 -0.47 0.00 0.00 61.79 61.32 3gt3 h SER 105 Cb 0.19 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 3gt3 h SER 105 CO -0.04 0.57 -0.15 0.74 -0.87 0.00 0.00 176.83 177.08 3gt3 h THR 106 N 0.48 1.31 -0.67 2.95 2.02 -1.67 -1.82 112.91 115.51 3gt3 h THR 106 Ca 0.10 -1.26 0.02 0.00 0.77 0.00 0.00 66.41 66.04 3gt3 h THR 106 Cb 0.37 1.59 -0.04 0.00 -1.74 0.00 0.00 68.15 68.34 3gt3 h THR 106 CO 0.02 0.39 0.44 0.40 0.37 0.00 0.00 175.52 177.13 3gt3 h ILE 107 N 0.26 1.14 -0.35 3.11 2.04 -0.89 -0.32 117.51 122.51 3gt3 h ILE 107 Ca 0.05 -0.30 -0.00 0.00 1.00 0.00 0.00 64.86 65.61 3gt3 h ILE 107 Cb 0.67 0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 3gt3 h ILE 107 CO 0.04 0.16 0.20 0.40 0.00 0.00 0.00 178.15 178.95 3gt3 h ILE 108 N 0.88 1.13 -0.81 -0.67 2.04 -0.91 -1.39 117.51 117.78 3gt3 h ILE 108 Ca 0.26 -0.32 0.04 0.00 1.00 0.00 0.00 64.86 65.84 3gt3 h ILE 108 Cb -0.06 0.71 -0.05 0.00 -0.74 0.00 0.00 36.82 36.68 3gt3 h ILE 108 CO -0.07 0.13 0.50 0.00 0.00 0.00 0.00 178.15 178.71 3gt3 h ALA 109 N 1.07 1.08 -0.37 1.87 0.00 -1.00 -1.04 119.26 120.86 3gt3 h ALA 109 Ca 0.12 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 3gt3 h ALA 109 Cb 0.03 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3gt3 h ALA 109 CO -0.02 0.28 0.01 0.78 0.00 0.00 0.00 179.25 180.30 3gt3 h GLY 110 N 0.96 0.63 0.74 0.00 0.00 -0.53 0.17 103.07 105.04 3gt3 h GLY 110 Ca 0.34 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 3gt3 h GLY 110 CO -0.14 0.35 0.00 -0.33 0.00 0.00 0.00 176.54 176.43 3gt3 h MET 111 N 0.56 0.07 -0.18 4.80 2.07 -0.65 -1.96 114.93 119.64 3gt3 h MET 111 Ca 0.12 -0.02 -0.04 0.00 -2.07 0.00 0.00 59.70 57.69 3gt3 h MET 111 Cb 0.35 -0.01 -0.01 0.00 -1.87 0.00 0.00 31.60 30.06 3gt3 h MET 111 CO 0.01 0.33 -0.05 -0.44 1.07 0.00 0.00 176.91 177.83 3gt3 h ASP 112 N -0.21 0.25 -0.26 1.22 3.32 -1.01 -2.01 116.42 117.72 3gt3 h ASP 112 Ca 0.01 -0.04 0.05 0.00 0.02 0.00 0.00 57.03 57.08 3gt3 h ASP 112 Cb 0.30 -0.06 -0.05 0.00 0.22 0.00 0.00 39.33 39.73 3gt3 h ASP 112 CO 0.00 0.34 -0.08 0.15 -1.72 0.00 0.00 179.24 177.93 3gt3 h PHE 113 N 0.26 -0.18 -0.74 4.55 3.57 -0.47 -2.65 116.94 121.29 3gt3 h PHE 113 Ca 0.06 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.53 3gt3 h PHE 113 Cb 0.26 0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 3gt3 h PHE 113 CO 0.00 -0.13 0.26 0.28 -2.23 0.00 0.00 178.31 176.50 3gt3 h VAL 114 N -0.03 1.25 -0.63 1.41 2.07 -0.67 0.68 116.25 120.34 3gt3 h VAL 114 Ca 0.13 -0.84 0.03 0.00 0.82 0.00 0.00 66.70 66.84 3gt3 h VAL 114 Cb 0.22 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 30.36 3gt3 h VAL 114 CO -0.28 0.34 0.41 0.00 0.02 0.00 0.00 177.57 178.06 3gt3 h ALA 115 N 1.20 1.67 0.17 1.67 0.00 -1.13 -2.07 119.26 120.77 3gt3 h ALA 115 Ca 0.24 -0.03 -0.31 0.00 0.00 0.00 0.00 54.91 54.81 3gt3 h ALA 115 Cb 0.25 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.85 3gt3 h ALA 115 CO -0.01 0.26 -1.55 1.03 0.00 0.00 0.00 179.25 178.97 3gt3 h SER 116 N 0.73 0.55 0.21 0.00 0.87 -1.09 -3.39 113.55 111.44 3gt3 h SER 116 Ca 0.25 -0.91 -0.02 0.00 -1.23 0.00 0.00 61.79 59.88 3gt3 h SER 116 Cb 0.09 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 61.87 3gt3 h SER 116 CO -0.07 1.70 -0.08 -0.78 -0.53 0.00 0.00 176.83 177.07 3gt3 h ASP 117 N -0.06 0.00 -0.01 6.23 3.58 0.70 -1.09 116.42 125.77 3gt3 h ASP 117 Ca -0.31 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.14 3gt3 h ASP 117 Cb 1.96 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 43.01 3gt3 h ASP 117 CO 0.15 0.08 0.01 0.07 -2.88 0.00 0.00 179.24 176.67 3gt3 h LYS 118 N 0.00 0.00 0.00 0.28 2.10 -1.57 0.23 116.57 117.61 3gt3 h LYS 118 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3gt3 h LYS 118 Cb 0.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.54 3gt3 h LYS 118 CO 0.01 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.55 3gt3 n ASN 119 N -3.67 0.00 -0.89 7.07 3.02 -0.41 -2.15 115.26 118.22 3gt3 n ASN 119 Ca -0.03 0.09 0.09 0.00 -0.03 0.00 0.00 54.58 54.71 3gt3 n ASN 119 Cb 0.09 -0.33 0.16 0.00 -0.61 0.00 0.00 39.78 39.09 3gt3 n ASN 119 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3gt3 n ASN 120 N -1.33 3.00 -4.39 6.41 3.02 0.81 -5.00 115.26 117.78 3gt3 n ASN 120 Ca 0.09 -1.88 -0.23 0.00 -0.03 0.00 0.00 54.58 52.53 3gt3 n ASN 120 Cb 0.17 -0.17 -0.11 0.00 -0.61 0.00 0.00 39.78 39.07 3gt3 n ASN 120 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3gt3 s ARG 121 N -1.33 1.45 -0.45 3.52 1.81 -0.91 -5.11 118.95 117.93 3gt3 s ARG 121 Ca 0.29 -1.58 -0.15 0.00 -1.72 0.00 0.00 55.73 52.57 3gt3 s ARG 121 Cb 0.18 -1.50 0.05 0.00 -0.45 0.00 0.00 34.95 33.23 3gt3 s ARG 121 CO 0.25 0.29 0.37 -0.80 -0.68 0.00 0.00 175.30 174.73 3gt3 s ASN 122 N -3.07 6.14 -0.39 0.23 0.01 -1.26 -4.95 114.94 111.66 3gt3 s ASN 122 Ca 0.22 -1.13 0.11 0.00 -0.71 0.00 0.00 52.86 51.35 3gt3 s ASN 122 Cb -0.05 -2.18 0.33 0.00 0.41 0.00 0.00 41.25 39.76 3gt3 s ASN 122 CO 0.10 -0.58 0.74 0.00 -1.51 0.00 0.00 177.10 175.85 3gt3 h PRO 124 N 3.19 0.00 -0.01 0.00 0.13 -1.77 -1.14 132.00 132.40 3gt3 h PRO 124 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 3gt3 h PRO 124 Cb 0.97 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.10 3gt3 h PRO 124 CO 0.45 0.01 -0.32 1.63 -0.23 0.00 0.00 178.00 179.54 3gt3 n LYS 125 N -3.85 0.91 0.00 0.86 4.76 -0.21 -5.02 118.16 115.61 3gt3 n LYS 125 Ca -0.03 -0.61 0.00 0.00 -2.87 0.00 0.00 58.31 54.80 3gt3 n LYS 125 Cb 0.10 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.80 3gt3 n LYS 125 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3gt3 n GLY 126 N 1.36 2.35 3.07 0.72 0.00 -0.43 -4.27 105.19 107.99 3gt3 n GLY 126 Ca 0.11 -2.17 -0.23 0.00 0.00 0.00 0.00 46.02 43.74 3gt3 n GLY 126 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gt3 s VAL 127 N -1.87 1.09 0.08 1.61 1.01 -1.26 -1.64 120.40 119.42 3gt3 s VAL 127 Ca 0.00 -0.54 0.07 0.00 0.00 0.00 0.00 61.98 61.51 3gt3 s VAL 127 Cb 0.00 -0.94 -0.03 0.00 0.00 0.00 0.00 36.38 35.41 3gt3 s VAL 127 CO 0.00 0.32 -0.18 -0.69 0.00 0.00 0.00 175.10 174.55 3gt3 s VAL 128 N 0.01 1.47 -0.05 2.92 1.01 0.05 -1.34 120.40 124.47 3gt3 s VAL 128 Ca -0.01 -1.40 0.03 0.00 0.00 0.00 0.00 61.98 60.60 3gt3 s VAL 128 Cb -0.09 -1.35 0.00 0.00 0.00 0.00 0.00 36.38 34.94 3gt3 s VAL 128 CO 0.01 -0.09 -0.14 0.00 0.00 0.00 0.00 175.10 174.88 3gt3 s ALA 129 N -1.14 1.30 -0.21 5.51 0.00 0.42 -0.49 121.76 127.15 3gt3 s ALA 129 Ca 0.03 -0.53 -0.02 0.00 0.00 0.00 0.00 51.96 51.44 3gt3 s ALA 129 Cb -0.10 -0.49 0.00 0.00 0.00 0.00 0.00 23.12 22.54 3gt3 s ALA 129 CO 0.03 0.20 -0.09 0.45 0.00 0.00 0.00 175.76 176.35 3gt3 s SER 130 N 0.26 3.93 -0.63 0.00 0.15 0.74 -1.07 113.70 117.08 3gt3 s SER 130 Ca -0.07 -0.47 0.04 0.00 0.70 0.00 0.00 55.95 56.15 3gt3 s SER 130 Cb -0.12 -1.65 0.15 0.00 -1.71 0.00 0.00 66.02 62.69 3gt3 s SER 130 CO 0.02 -0.01 0.40 -0.76 1.20 0.00 0.00 173.24 174.10 3gt3 s LEU 131 N 1.39 4.67 -1.28 3.45 1.02 -0.05 -1.88 118.68 126.00 3gt3 s LEU 131 Ca 0.05 -3.41 -0.08 0.00 0.02 0.00 0.00 54.13 50.72 3gt3 s LEU 131 Cb -0.14 -1.67 0.16 0.00 0.02 0.00 0.00 46.19 44.56 3gt3 s LEU 131 CO -0.06 -0.17 2.04 -1.20 0.02 0.00 0.00 176.35 176.97 3gt3 n SER 132 N 2.60 6.22 -3.62 2.29 7.64 -1.26 -1.64 113.62 125.85 3gt3 n SER 132 Ca 0.12 -3.14 -0.09 0.00 1.01 0.00 0.00 58.87 56.77 3gt3 n SER 132 Cb 0.34 -1.42 -0.02 0.00 -1.01 0.00 0.00 64.21 62.10 3gt3 n SER 132 CO 0.00 0.00 0.00 -1.48 -3.01 0.00 0.00 175.04 170.55 3gt3 s LEU 133 N -1.03 -0.39 0.00 -3.43 0.05 -1.26 -4.88 118.68 107.74 3gt3 s LEU 133 Ca 0.44 -0.25 0.00 0.00 0.05 0.00 0.00 54.13 54.37 3gt3 s LEU 133 Cb 0.13 2.51 0.00 0.00 -2.05 0.00 0.00 46.19 46.78 3gt3 s LEU 133 CO -0.03 -1.04 0.00 0.61 -0.55 0.00 0.00 176.35 175.34 3gt3 n GLY 134 N -0.40 1.64 0.00 -3.48 0.00 -1.26 -4.49 105.19 97.20 3gt3 n GLY 134 Ca -0.10 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.92 3gt3 n GLY 134 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gt3 n GLY 135 N -0.71 4.28 3.80 -0.02 0.00 -0.49 -4.98 105.19 107.08 3gt3 n GLY 135 Ca 0.00 -0.69 -0.29 0.00 0.00 0.00 0.00 46.02 45.04 3gt3 n GLY 135 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gt3 s GLY 136 N 0.00 1.59 0.15 -0.02 0.00 -1.26 -0.71 107.32 107.06 3gt3 s GLY 136 Ca 0.00 -0.46 -0.34 0.00 0.00 0.00 0.00 44.72 43.91 3gt3 s GLY 136 CO 0.00 0.05 1.43 2.98 0.00 0.00 0.00 173.10 177.57 3gt3 n TYR 137 N -3.63 1.90 -3.66 1.90 9.36 -0.59 -3.61 117.16 118.83 3gt3 n TYR 137 Ca 0.07 0.46 -0.15 0.00 3.32 0.00 0.00 57.90 61.60 3gt3 n TYR 137 Cb 0.59 -2.43 -0.14 0.00 -0.63 0.00 0.00 39.34 36.72 3gt3 n TYR 137 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 3gt3 s SER 138 N 0.59 0.54 0.38 2.98 0.15 -1.26 -4.92 113.70 112.15 3gt3 s SER 138 Ca 0.79 0.47 0.08 0.00 0.70 0.00 0.00 55.95 57.99 3gt3 s SER 138 Cb -0.79 0.53 0.75 0.00 -1.71 0.00 0.00 66.02 64.80 3gt3 s SER 138 CO 0.44 -0.24 1.92 0.77 1.20 0.00 0.00 173.24 177.32 3gt3 h SER 139 N 8.32 0.30 -0.22 5.45 4.64 -1.99 -1.64 113.55 128.40 3gt3 h SER 139 Ca -0.14 -0.05 -0.14 0.00 -0.47 0.00 0.00 61.79 60.99 3gt3 h SER 139 Cb 1.12 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.12 3gt3 h SER 139 CO 0.14 0.42 -0.35 0.77 -0.87 0.00 0.00 176.83 176.93 3gt3 h SER 140 N 0.31 0.78 -0.47 4.97 4.64 -1.99 0.19 113.55 121.98 3gt3 h SER 140 Ca 0.07 -0.33 -0.09 0.00 -0.47 0.00 0.00 61.79 60.96 3gt3 h SER 140 Cb 0.33 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.19 3gt3 h SER 140 CO 0.02 1.06 -0.07 0.58 -0.87 0.00 0.00 176.83 177.54 3gt3 h VAL 141 N 0.62 1.27 -0.66 0.95 2.07 -1.87 -1.63 116.25 117.00 3gt3 h VAL 141 Ca 0.06 -1.18 -0.05 0.00 0.82 0.00 0.00 66.70 66.35 3gt3 h VAL 141 Cb 0.89 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 31.70 3gt3 h VAL 141 CO 0.08 0.41 0.21 0.78 0.02 0.00 0.00 177.57 179.07 3gt3 h ASN 142 N 0.73 0.95 -0.19 0.57 4.21 -1.09 -2.02 115.58 118.74 3gt3 h ASN 142 Ca 0.13 -0.20 -0.06 0.00 1.21 0.00 0.00 56.30 57.37 3gt3 h ASN 142 Cb 0.61 -0.25 -0.02 0.00 -1.12 0.00 0.00 38.32 37.54 3gt3 h ASN 142 CO 0.04 0.90 -0.06 0.28 -1.29 0.00 0.00 177.43 177.30 3gt3 h SER 143 N 0.95 0.50 -0.69 5.81 0.02 -0.74 0.96 113.55 120.35 3gt3 h SER 143 Ca 0.21 -0.11 -0.04 0.00 -0.84 0.00 0.00 61.79 61.01 3gt3 h SER 143 Cb 0.29 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.66 3gt3 h SER 143 CO -0.01 0.61 0.27 0.00 -1.14 0.00 0.00 176.83 176.56 3gt3 h ALA 144 N 1.45 0.90 -0.60 3.77 0.00 -1.01 0.27 119.26 124.04 3gt3 h ALA 144 Ca 0.10 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 3gt3 h ALA 144 Cb 0.41 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3gt3 h ALA 144 CO 0.02 0.52 0.04 0.00 0.00 0.00 0.00 179.25 179.83 3gt3 h ALA 145 N 1.12 0.94 -0.79 0.00 0.00 -0.63 -1.43 119.26 118.48 3gt3 h ALA 145 Ca 0.23 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 3gt3 h ALA 145 Cb 0.22 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 3gt3 h ALA 145 CO -0.02 0.65 0.32 0.00 0.00 0.00 0.00 179.25 180.20 3gt3 h ALA 146 N 1.09 1.03 -0.45 0.00 0.00 -0.53 -1.56 119.26 118.84 3gt3 h ALA 146 Ca 0.18 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 3gt3 h ALA 146 Cb 0.49 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3gt3 h ALA 146 CO 0.02 0.65 0.16 0.00 0.00 0.00 0.00 179.25 180.08 3gt3 h ARG 147 N 1.15 0.68 -0.33 0.00 3.08 -0.69 0.23 114.38 118.51 3gt3 h ARG 147 Ca 0.27 -0.13 0.04 0.00 0.07 0.00 0.00 59.98 60.22 3gt3 h ARG 147 Cb 0.21 -0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.11 3gt3 h ARG 147 CO -0.02 0.64 0.11 1.25 -1.07 0.00 0.00 179.97 180.87 3gt3 h LEU 148 N 0.59 0.11 -0.18 3.04 5.85 -1.07 0.15 115.31 123.79 3gt3 h LEU 148 Ca 0.15 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.92 3gt3 h LEU 148 Cb 0.22 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 3gt3 h LEU 148 CO -0.01 0.10 0.08 -0.61 -0.34 0.00 0.00 178.44 177.66 3gt3 h GLN 149 N 0.24 0.17 -0.52 1.25 5.75 -1.12 -2.62 115.11 118.27 3gt3 h GLN 149 Ca 0.15 -0.01 0.07 0.00 -0.15 0.00 0.00 58.65 58.71 3gt3 h GLN 149 Cb 0.13 -0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.61 3gt3 h GLN 149 CO -0.16 0.12 0.35 1.03 -2.65 0.00 0.00 178.83 177.51 3gt3 h SER 150 N 0.18 0.36 0.53 -0.69 0.87 -0.42 -1.05 113.55 113.33 3gt3 h SER 150 Ca 0.08 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 3gt3 h SER 150 Cb 0.03 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 61.91 3gt3 h SER 150 CO -0.06 0.23 0.00 -1.54 -0.53 0.00 0.00 176.83 174.93 3gt3 n SER 151 N -4.47 0.00 0.00 6.23 3.41 -0.01 -4.82 113.62 113.96 3gt3 n SER 151 Ca 0.07 0.45 0.00 0.00 -0.26 0.00 0.00 58.87 59.13 3gt3 n SER 151 Cb 0.28 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 3gt3 n SER 151 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gt3 n GLY 152 N 0.16 1.96 3.35 5.00 0.00 -0.40 -5.10 105.19 110.16 3gt3 n GLY 152 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 3gt3 n GLY 152 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gt3 s VAL 153 N -2.00 2.73 -0.43 1.61 1.01 -1.18 -4.53 120.40 117.61 3gt3 s VAL 153 Ca 0.00 -0.80 -0.29 0.00 0.00 0.00 0.00 61.98 60.90 3gt3 s VAL 153 Cb 0.00 -2.10 0.01 0.00 0.00 0.00 0.00 36.38 34.29 3gt3 s VAL 153 CO 0.00 0.55 1.43 -0.32 0.00 0.00 0.00 175.10 176.76 3gt3 s MET 154 N 0.06 3.53 -0.27 2.72 1.75 -0.45 -4.06 119.30 122.59 3gt3 s MET 154 Ca -0.07 0.90 -0.12 0.00 -1.25 0.00 0.00 55.69 55.15 3gt3 s MET 154 Cb -0.15 -4.04 -0.05 0.00 2.84 0.00 0.00 34.83 33.43 3gt3 s MET 154 CO 0.05 -1.62 0.24 0.08 -0.65 0.00 0.00 175.02 173.12 3gt3 s VAL 155 N 5.56 5.27 -0.17 10.11 1.01 -1.26 -0.44 120.40 140.49 3gt3 s VAL 155 Ca 0.61 0.29 -0.02 0.00 0.00 0.00 0.00 61.98 62.86 3gt3 s VAL 155 Cb -0.13 -3.58 -0.01 0.00 0.00 0.00 0.00 36.38 32.65 3gt3 s VAL 155 CO 0.32 0.23 -0.08 0.00 0.00 0.00 0.00 175.10 175.56 3gt3 s ALA 156 N 1.81 2.75 0.04 5.51 0.00 -0.23 -0.63 121.76 131.02 3gt3 s ALA 156 Ca 0.09 -0.97 0.06 0.00 0.00 0.00 0.00 51.96 51.14 3gt3 s ALA 156 Cb -0.16 -1.44 -0.02 0.00 0.00 0.00 0.00 23.12 21.50 3gt3 s ALA 156 CO 0.10 0.01 -0.16 0.14 0.00 0.00 0.00 175.76 175.85 3gt3 s VAL 157 N 0.74 1.28 0.30 0.00 -7.23 0.12 -0.87 120.40 114.73 3gt3 s VAL 157 Ca -0.04 -1.08 -0.29 0.00 -1.81 0.00 0.00 61.98 58.77 3gt3 s VAL 157 Cb -0.15 -1.14 -0.10 0.00 0.56 0.00 0.00 36.38 35.55 3gt3 s VAL 157 CO 0.02 0.05 1.24 0.00 -0.31 0.00 0.00 175.10 176.10 3gt3 s ALA 158 N -0.86 3.47 0.25 1.32 0.00 -0.65 -0.77 121.76 124.52 3gt3 s ALA 158 Ca 0.03 1.13 0.17 0.00 0.00 0.00 0.00 51.96 53.29 3gt3 s ALA 158 Cb -0.08 -3.43 0.69 0.00 0.00 0.00 0.00 23.12 20.30 3gt3 s ALA 158 CO 0.01 -0.48 1.76 0.00 0.00 0.00 0.00 175.76 177.05 3gt3 h ALA 159 N 3.76 1.09 0.00 0.00 0.00 -1.16 -3.38 119.26 119.57 3gt3 h ALA 159 Ca -0.48 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.07 3gt3 h ALA 159 Cb 1.22 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3gt3 h ALA 159 CO 0.67 0.50 0.00 0.41 0.00 0.00 0.00 179.25 180.83 3gt3 n GLY 160 N 0.03 2.20 1.22 0.00 0.00 -1.26 -4.69 105.19 102.69 3gt3 n GLY 160 Ca -0.01 -2.00 -0.07 0.00 0.00 0.00 0.00 46.02 43.95 3gt3 n GLY 160 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3gt3 n ASN 161 N 0.00 3.06 -1.01 1.61 6.94 -1.26 -0.87 115.26 123.74 3gt3 n ASN 161 Ca 0.00 -3.83 0.10 0.00 -0.02 0.00 0.00 54.58 50.83 3gt3 n ASN 161 Cb 0.00 -0.52 0.20 0.00 -2.36 0.00 0.00 39.78 37.10 3gt3 n ASN 161 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 3gt3 n ASN 162 N -0.99 3.28 -4.08 0.53 3.02 -1.06 -4.78 115.26 111.18 3gt3 n ASN 162 Ca 0.31 -1.94 -0.27 0.00 -0.03 0.00 0.00 54.58 52.65 3gt3 n ASN 162 Cb 0.85 -0.26 -0.05 0.00 -0.61 0.00 0.00 39.78 39.71 3gt3 n ASN 162 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3gt3 n ASN 163 N 1.24 0.06 -3.91 6.41 5.15 -0.40 -4.94 115.26 118.87 3gt3 n ASN 163 Ca 0.17 -1.10 -0.14 0.00 -0.60 0.00 0.00 54.58 52.91 3gt3 n ASN 163 Cb 0.54 -2.56 -0.09 0.00 -0.53 0.00 0.00 39.78 37.14 3gt3 n ASN 163 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3gt3 s ALA 164 N -4.09 1.28 -0.03 5.20 0.00 -1.26 -4.94 121.76 117.92 3gt3 s ALA 164 Ca 0.02 -1.76 -0.30 0.00 0.00 0.00 0.00 51.96 49.92 3gt3 s ALA 164 Cb -0.01 1.39 -0.06 0.00 0.00 0.00 0.00 23.12 24.44 3gt3 s ALA 164 CO 0.93 -0.63 1.59 0.34 0.00 0.00 0.00 175.76 177.99 3gt3 s ASP 165 N -3.22 6.70 0.00 0.00 -1.08 -1.26 -0.96 116.67 116.85 3gt3 s ASP 165 Ca 0.38 2.22 0.08 0.00 -0.52 0.00 0.00 52.55 54.72 3gt3 s ASP 165 Cb 0.05 -2.54 0.35 0.00 -1.46 0.00 0.00 42.92 39.32 3gt3 s ASP 165 CO 0.17 -0.88 1.25 0.00 0.52 0.00 0.00 175.17 176.22 3gt3 n ALA 166 N 6.62 1.39 0.18 3.66 0.00 0.39 -2.90 120.51 129.86 3gt3 n ALA 166 Ca 0.16 -0.03 0.18 0.00 0.00 0.00 0.00 53.44 53.76 3gt3 n ALA 166 Cb 0.43 -1.13 0.81 0.00 0.00 0.00 0.00 19.45 19.55 3gt3 n ALA 166 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 3gt3 h ARG 167 N 0.00 0.00 -0.64 0.00 0.11 -1.90 -2.36 114.38 109.59 3gt3 h ARG 167 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3gt3 h ARG 167 Cb 0.13 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.21 3gt3 h ARG 167 CO 0.00 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.16 3gt3 n ASN 168 N -3.63 4.89 -4.23 0.08 3.02 -1.14 -4.78 115.26 109.47 3gt3 n ASN 168 Ca 0.03 -2.56 -0.20 0.00 -0.03 0.00 0.00 54.58 51.82 3gt3 n ASN 168 Cb 0.44 -0.60 -0.12 0.00 -0.61 0.00 0.00 39.78 38.89 3gt3 n ASN 168 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3gt3 s TYR 169 N -2.08 1.47 0.06 3.10 2.02 -0.89 -1.54 117.35 119.50 3gt3 s TYR 169 Ca 0.50 -0.47 0.05 0.00 -0.37 0.00 0.00 57.07 56.78 3gt3 s TYR 169 Cb 0.34 -0.80 -0.03 0.00 -0.40 0.00 0.00 41.96 41.08 3gt3 s TYR 169 CO 0.22 0.14 -0.14 -1.12 -1.57 0.00 0.00 175.55 173.08 3gt3 s SER 170 N -2.02 1.67 0.00 2.29 0.01 0.11 -0.75 113.70 115.02 3gt3 s SER 170 Ca 0.04 -0.54 0.08 0.00 1.31 0.00 0.00 55.95 56.84 3gt3 s SER 170 Cb -0.09 -0.08 0.45 0.00 0.21 0.00 0.00 66.02 66.52 3gt3 s SER 170 CO 0.03 -0.02 1.25 -0.81 0.41 0.00 0.00 173.24 174.10 3gt3 n PRO 171 N 1.58 0.95 -0.34 12.44 -0.04 -1.26 -1.40 135.00 146.93 3gt3 n PRO 171 Ca -0.20 0.00 0.22 0.00 -0.04 0.00 0.00 63.50 63.48 3gt3 n PRO 171 Cb 0.54 -1.12 0.45 0.00 -0.04 0.00 0.00 33.50 33.33 3gt3 n PRO 171 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3gt3 h ALA 172 N 3.16 1.99 -0.00 0.55 0.00 -1.74 -1.17 119.26 122.04 3gt3 h ALA 172 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3gt3 h ALA 172 Cb 0.00 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3gt3 h ALA 172 CO 0.00 -0.51 -0.01 -1.13 0.00 0.00 0.00 179.25 177.60 3gt3 n SER 173 N -4.88 0.41 -4.65 0.00 3.41 0.07 -4.78 113.62 103.20 3gt3 n SER 173 Ca 0.29 -1.02 -0.43 0.00 -0.26 0.00 0.00 58.87 57.46 3gt3 n SER 173 Cb 0.89 -0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.79 3gt3 n SER 173 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 3gt3 s GLU 174 N -2.09 4.09 0.46 4.33 2.56 -0.45 -4.89 118.70 122.71 3gt3 s GLU 174 Ca 0.42 1.98 0.14 0.00 0.00 0.00 0.00 54.97 57.51 3gt3 s GLU 174 Cb 0.21 -3.97 1.05 0.00 2.00 0.00 0.00 34.13 33.42 3gt3 s GLU 174 CO 0.38 -0.95 2.03 -1.35 -0.56 0.00 0.00 175.26 174.81 3gt3 h PRO 175 N 9.68 0.05 -0.00 4.30 0.11 -1.90 -3.19 132.00 141.04 3gt3 h PRO 175 Ca -0.36 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.74 3gt3 h PRO 175 Cb 1.16 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3gt3 h PRO 175 CO 0.97 0.16 -0.16 -1.13 -0.21 0.00 0.00 178.00 177.63 3gt3 n SER 176 N -4.39 0.51 -5.00 -2.05 3.41 -1.26 -4.84 113.62 100.00 3gt3 n SER 176 Ca -0.02 -0.49 -0.21 0.00 -0.26 0.00 0.00 58.87 57.89 3gt3 n SER 176 Cb 0.20 -0.05 0.04 0.00 -0.26 0.00 0.00 64.21 64.13 3gt3 n SER 176 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3gt3 s VAL 177 N -2.58 2.16 -0.44 -3.33 -7.23 -1.21 -4.98 120.40 102.80 3gt3 s VAL 177 Ca 0.25 -1.12 -0.15 0.00 -1.81 0.00 0.00 61.98 59.16 3gt3 s VAL 177 Cb 0.20 -2.28 0.05 0.00 0.56 0.00 0.00 36.38 34.91 3gt3 s VAL 177 CO 0.51 0.00 0.34 0.00 -0.31 0.00 0.00 175.10 175.64 3gt3 s THR 179 N 1.63 5.18 -0.19 0.00 2.01 -1.26 -0.70 115.64 122.31 3gt3 s THR 179 Ca 0.04 0.70 -0.01 0.00 0.31 0.00 0.00 61.69 62.74 3gt3 s THR 179 Cb -0.22 -3.73 0.01 0.00 0.01 0.00 0.00 72.50 68.56 3gt3 s THR 179 CO 0.07 0.22 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.39 3gt3 s VAL 180 N 1.52 2.62 0.59 3.82 1.01 0.05 -1.37 120.40 128.64 3gt3 s VAL 180 Ca 0.19 -0.76 0.03 0.00 0.00 0.00 0.00 61.98 61.43 3gt3 s VAL 180 Cb -0.15 -2.13 0.07 0.00 0.00 0.00 0.00 36.38 34.17 3gt3 s VAL 180 CO 0.08 0.50 0.82 -0.83 0.00 0.00 0.00 175.10 175.67 3gt3 s GLY 181 N 1.22 1.81 -0.02 4.51 0.00 -0.36 -0.63 107.32 113.84 3gt3 s GLY 181 Ca 0.02 -1.63 0.05 0.00 0.00 0.00 0.00 44.72 43.17 3gt3 s GLY 181 CO -0.07 -1.24 -0.17 0.00 0.00 0.00 0.00 173.10 171.63 3gt3 s ALA 182 N -2.81 2.58 0.33 3.20 0.00 -1.26 -1.00 121.76 122.80 3gt3 s ALA 182 Ca 0.60 -1.06 0.07 0.00 0.00 0.00 0.00 51.96 51.58 3gt3 s ALA 182 Cb -0.08 -0.85 -0.07 0.00 0.00 0.00 0.00 23.12 22.13 3gt3 s ALA 182 CO 0.40 0.56 -0.04 -1.54 0.00 0.00 0.00 175.76 175.14 3gt3 s SER 183 N -0.93 3.22 0.53 0.00 1.04 -0.36 -0.74 113.70 116.46 3gt3 s SER 183 Ca 0.12 -1.26 0.05 0.00 0.48 0.00 0.00 55.95 55.34 3gt3 s SER 183 Cb -0.10 -0.26 0.03 0.00 0.10 0.00 0.00 66.02 65.79 3gt3 s SER 183 CO 0.02 -0.36 0.33 1.51 0.98 0.00 0.00 173.24 175.71 3gt3 s ASP 184 N -3.55 4.54 0.07 7.02 1.47 -0.21 -0.52 116.67 125.48 3gt3 s ASP 184 Ca 0.33 -1.32 0.19 0.00 1.18 0.00 0.00 52.55 52.93 3gt3 s ASP 184 Cb 0.05 0.42 0.79 0.00 -0.34 0.00 0.00 42.92 43.84 3gt3 s ASP 184 CO 0.15 -1.05 1.60 -2.11 0.68 0.00 0.00 175.17 174.44 3gt3 n ARG 185 N -1.66 0.06 -0.72 2.11 1.85 -1.26 -1.26 116.66 115.77 3gt3 n ARG 185 Ca -0.05 0.26 0.08 0.00 -1.00 0.00 0.00 57.85 57.14 3gt3 n ARG 185 Cb 0.65 -1.60 0.36 0.00 -1.05 0.00 0.00 32.46 30.82 3gt3 n ARG 185 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 3gt3 n TYR 186 N -1.71 1.68 -2.69 2.89 4.01 -1.26 -4.40 117.16 115.68 3gt3 n TYR 186 Ca 0.04 -0.71 -0.17 0.00 -0.16 0.00 0.00 57.90 56.89 3gt3 n TYR 186 Cb 0.22 -0.39 0.02 0.00 -0.31 0.00 0.00 39.34 38.88 3gt3 n TYR 186 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3gt3 n ASP 187 N 0.59 -5.07 -4.88 7.72 8.00 -0.39 -4.89 116.55 117.62 3gt3 n ASP 187 Ca 0.26 -0.16 -0.35 0.00 0.71 0.00 0.00 54.79 55.24 3gt3 n ASP 187 Cb 1.04 -4.00 -0.05 0.00 -0.02 0.00 0.00 41.12 38.09 3gt3 n ASP 187 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3gt3 s ARG 188 N -5.26 3.58 0.16 -1.24 0.52 -1.26 -0.71 118.95 114.74 3gt3 s ARG 188 Ca 0.17 -0.06 -0.34 0.00 -0.52 0.00 0.00 55.73 54.97 3gt3 s ARG 188 Cb -0.07 -3.10 -0.14 0.00 0.52 0.00 0.00 34.95 32.16 3gt3 s ARG 188 CO 0.21 0.67 1.53 -2.13 0.02 0.00 0.00 175.30 175.59 3gt3 n ARG 189 N 1.24 2.01 -1.67 3.54 0.63 0.08 -1.05 116.66 121.44 3gt3 n ARG 189 Ca -0.12 0.72 -0.40 0.00 -0.92 0.00 0.00 57.85 57.13 3gt3 n ARG 189 Cb 0.53 -2.47 0.02 0.00 0.45 0.00 0.00 32.46 31.00 3gt3 n ARG 189 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 3gt3 n SER 190 N 3.19 1.87 0.23 6.15 7.64 0.08 -4.78 113.62 128.01 3gt3 n SER 190 Ca 0.17 1.01 0.06 0.00 1.01 0.00 0.00 58.87 61.12 3gt3 n SER 190 Cb 0.28 -1.45 0.54 0.00 -1.01 0.00 0.00 64.21 62.56 3gt3 n SER 190 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 3gt3 h SER 191 N 1.52 0.00 0.42 6.43 4.64 -1.91 -1.21 113.55 123.44 3gt3 h SER 191 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3gt3 h SER 191 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 3gt3 h SER 191 CO 0.57 0.15 -0.73 2.22 -0.87 0.00 0.00 176.83 178.16 3gt3 n PHE 192 N -4.33 0.11 -1.95 4.77 1.16 -1.26 -4.68 117.46 111.28 3gt3 n PHE 192 Ca -0.03 0.03 -0.42 0.00 -1.87 0.00 0.00 57.45 55.17 3gt3 n PHE 192 Cb 0.22 -0.28 -0.03 0.00 -1.61 0.00 0.00 39.48 37.78 3gt3 n PHE 192 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 3gt3 s SER 193 N -3.32 6.59 1.02 5.98 0.15 -0.46 -1.27 113.70 122.40 3gt3 s SER 193 Ca 0.08 2.65 -0.12 0.00 0.70 0.00 0.00 55.95 59.26 3gt3 s SER 193 Cb 0.16 -2.61 0.20 0.00 -1.71 0.00 0.00 66.02 62.07 3gt3 s SER 193 CO 0.76 -0.79 1.08 0.20 1.20 0.00 0.00 173.24 175.68 3gt3 s ASN 194 N 0.86 2.31 0.06 5.45 0.01 -0.04 -4.01 114.94 119.57 3gt3 s ASN 194 Ca 0.66 1.48 0.01 0.00 -0.71 0.00 0.00 52.86 54.30 3gt3 s ASN 194 Cb -0.43 -2.16 -0.00 0.00 0.41 0.00 0.00 41.25 39.06 3gt3 s ASN 194 CO 0.36 -3.37 0.06 0.00 -1.51 0.00 0.00 177.10 172.65 3gt3 n TYR 195 N -4.36 -0.32 0.00 2.20 0.18 -0.14 -4.76 117.16 109.97 3gt3 n TYR 195 Ca 0.06 -0.47 0.00 0.00 1.88 0.00 0.00 57.90 59.36 3gt3 n TYR 195 Cb 0.55 0.07 0.00 0.00 -0.38 0.00 0.00 39.34 39.58 3gt3 n TYR 195 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3gt3 n GLY 196 N -0.11 2.02 0.31 -7.48 0.00 -1.26 -0.46 105.19 98.21 3gt3 n GLY 196 Ca 0.01 -2.19 0.17 0.00 0.00 0.00 0.00 46.02 44.01 3gt3 n GLY 196 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3gt3 h SER 197 N 0.00 0.00 1.48 1.61 4.64 -1.97 -2.09 113.55 117.23 3gt3 h SER 197 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3gt3 h SER 197 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 3gt3 h SER 197 CO 0.00 0.00 0.00 0.55 -0.87 0.00 0.00 176.83 176.51 3gt3 n VAL 198 N -3.62 0.62 -2.00 0.95 3.14 -1.26 -4.76 118.33 111.41 3gt3 n VAL 198 Ca -0.03 -0.28 -0.39 0.00 -2.96 0.00 0.00 64.34 60.67 3gt3 n VAL 198 Cb 0.08 -0.60 0.00 0.00 -1.06 0.00 0.00 33.84 32.26 3gt3 n VAL 198 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 3gt3 s LEU 199 N -4.59 4.16 -0.10 6.55 1.02 -0.78 -4.56 118.68 120.38 3gt3 s LEU 199 Ca 0.10 2.70 0.13 0.00 0.02 0.00 0.00 54.13 57.08 3gt3 s LEU 199 Cb 0.12 -3.95 -0.19 0.00 0.02 0.00 0.00 46.19 42.19 3gt3 s LEU 199 CO 0.59 -0.97 0.14 0.47 0.02 0.00 0.00 176.35 176.61 3gt3 n ASP 200 N -0.04 1.55 -3.56 2.29 8.00 -0.47 -4.66 116.55 119.65 3gt3 n ASP 200 Ca 0.05 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.45 3gt3 n ASP 200 Cb 0.43 1.11 -0.04 0.00 -0.02 0.00 0.00 41.12 42.60 3gt3 n ASP 200 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3gt3 s ILE 201 N -2.56 0.00 0.07 0.53 1.10 -1.18 -4.75 121.20 114.40 3gt3 s ILE 201 Ca -0.06 0.00 0.04 0.00 -0.51 0.00 0.00 60.65 60.12 3gt3 s ILE 201 Cb 0.06 -1.00 -0.04 0.00 0.15 0.00 0.00 42.46 41.63 3gt3 s ILE 201 CO 0.59 0.00 -0.00 -0.36 -2.11 0.00 0.00 174.94 173.06 3gt3 s PHE 202 N -1.59 3.00 0.19 3.50 0.08 -0.36 -1.23 117.98 121.58 3gt3 s PHE 202 Ca 0.00 -0.00 -0.00 0.00 0.12 0.00 0.00 56.93 57.04 3gt3 s PHE 202 Cb -0.01 -1.57 -0.04 0.00 -0.57 0.00 0.00 43.02 40.83 3gt3 s PHE 202 CO -0.01 0.47 0.09 0.20 -0.10 0.00 0.00 175.22 175.87 3gt3 s GLY 203 N -2.10 1.34 0.10 4.36 0.00 -0.17 -1.04 107.32 109.81 3gt3 s GLY 203 Ca 0.24 -1.66 -0.34 0.00 0.00 0.00 0.00 44.72 42.97 3gt3 s GLY 203 CO 0.16 -1.44 1.68 -1.05 0.00 0.00 0.00 173.10 172.44 3gt3 n PRO 204 N -0.25 2.25 0.00 2.90 -0.02 -1.26 -1.22 135.00 137.40 3gt3 n PRO 204 Ca -0.02 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.28 3gt3 n PRO 204 Cb 0.65 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 3gt3 n PRO 204 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gt3 n GLY 205 N 3.75 0.97 3.49 -1.23 0.00 0.32 -2.81 105.19 109.68 3gt3 n GLY 205 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 3gt3 n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gt3 s THR 206 N -0.06 4.37 -0.99 2.61 2.01 -1.06 -0.16 115.64 122.36 3gt3 s THR 206 Ca 0.00 -0.16 -0.05 0.00 0.31 0.00 0.00 61.69 61.78 3gt3 s THR 206 Cb 0.00 -3.01 -0.06 0.00 0.01 0.00 0.00 72.50 69.44 3gt3 s THR 206 CO 0.00 0.38 0.87 0.47 -0.69 0.00 0.00 174.62 175.65 3gt3 n ASP 207 N 4.47 -6.60 -4.49 3.53 8.00 -1.22 -4.64 116.55 115.60 3gt3 n ASP 207 Ca -0.16 -0.63 -0.41 0.00 0.71 0.00 0.00 54.79 54.30 3gt3 n ASP 207 Cb 0.52 -5.07 -0.11 0.00 -0.02 0.00 0.00 41.12 36.44 3gt3 n ASP 207 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3gt3 s ILE 208 N -3.34 5.13 0.05 0.53 -1.09 -0.14 -4.84 121.20 117.49 3gt3 s ILE 208 Ca 0.41 -0.42 -0.30 0.00 -2.23 0.00 0.00 60.65 58.10 3gt3 s ILE 208 Cb -0.05 -3.71 -0.05 0.00 -1.58 0.00 0.00 42.46 37.07 3gt3 s ILE 208 CO 0.72 -0.10 1.04 -0.22 -1.23 0.00 0.00 174.94 175.14 3gt3 s LEU 209 N 1.68 4.41 0.00 2.97 2.96 -1.26 -2.12 118.68 127.31 3gt3 s LEU 209 Ca 0.05 1.81 -0.10 0.00 -0.22 0.00 0.00 54.13 55.67 3gt3 s LEU 209 Cb -0.18 -3.58 0.04 0.00 0.50 0.00 0.00 46.19 42.97 3gt3 s LEU 209 CO 0.09 -0.27 0.55 -0.24 -1.32 0.00 0.00 176.35 175.16 3gt3 n SER 210 N 3.55 -1.59 -4.74 3.68 2.88 -0.65 -4.88 113.62 111.86 3gt3 n SER 210 Ca 0.06 -2.12 -0.34 0.00 -1.33 0.00 0.00 58.87 55.14 3gt3 n SER 210 Cb 0.49 2.65 0.07 0.00 -0.75 0.00 0.00 64.21 66.68 3gt3 n SER 210 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3gt3 s THR 211 N -2.38 2.75 0.19 2.46 -4.23 -1.26 -1.30 115.64 111.87 3gt3 s THR 211 Ca 0.11 0.36 -0.03 0.00 -1.18 0.00 0.00 61.69 60.95 3gt3 s THR 211 Cb -0.03 -2.88 -0.03 0.00 1.34 0.00 0.00 72.50 70.89 3gt3 s THR 211 CO 0.08 -0.21 0.18 0.86 -0.54 0.00 0.00 174.62 174.99 3gt3 s TRP 212 N -2.17 0.94 0.86 3.99 -0.11 -0.19 -2.91 118.94 119.35 3gt3 s TRP 212 Ca 0.71 -1.22 -0.11 0.00 1.22 0.00 0.00 56.10 56.69 3gt3 s TRP 212 Cb -0.25 -0.40 0.11 0.00 -1.50 0.00 0.00 33.47 31.43 3gt3 s TRP 212 CO 0.44 -0.68 1.09 0.96 -4.62 0.00 0.00 176.95 174.14 3gt3 s ILE 213 N -4.11 2.83 -1.29 5.86 -4.36 -1.26 -2.04 121.20 116.83 3gt3 s ILE 213 Ca 0.33 0.27 0.00 0.00 -0.26 0.00 0.00 60.65 60.99 3gt3 s ILE 213 Cb 0.06 -2.78 0.00 0.00 1.25 0.00 0.00 42.46 40.99 3gt3 s ILE 213 CO 0.09 -0.35 0.00 0.61 0.24 0.00 0.00 174.94 175.53 3gt3 n GLY 214 N -1.24 0.45 2.34 6.27 0.00 -1.26 -3.44 105.19 108.31 3gt3 n GLY 214 Ca 0.07 -0.34 -0.14 0.00 0.00 0.00 0.00 46.02 45.62 3gt3 n GLY 214 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gt3 n GLY 215 N -1.12 -0.19 0.00 -0.02 0.00 -1.21 -4.99 105.19 97.65 3gt3 n GLY 215 Ca -0.15 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.60 3gt3 n GLY 215 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3gt3 n SER 216 N -0.77 1.37 -3.89 1.61 3.41 -0.87 -4.96 113.62 109.52 3gt3 n SER 216 Ca -0.15 -0.85 -0.10 0.00 -0.26 0.00 0.00 58.87 57.52 3gt3 n SER 216 Cb 0.62 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.48 3gt3 n SER 216 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3gt3 s THR 217 N -0.12 0.12 0.17 6.66 -4.23 -1.26 -1.03 115.64 115.95 3gt3 s THR 217 Ca 0.00 -0.97 -0.24 0.00 -1.18 0.00 0.00 61.69 59.31 3gt3 s THR 217 Cb 0.00 -0.84 0.06 0.00 1.34 0.00 0.00 72.50 73.06 3gt3 s THR 217 CO 0.00 -0.53 0.74 0.00 -0.54 0.00 0.00 174.62 174.29 3gt3 s ARG 218 N -2.43 1.34 -0.23 3.99 1.70 -0.42 -4.82 118.95 118.08 3gt3 s ARG 218 Ca -0.06 -0.62 -0.07 0.00 -0.47 0.00 0.00 55.73 54.50 3gt3 s ARG 218 Cb -0.02 0.53 -0.03 0.00 -0.57 0.00 0.00 34.95 34.86 3gt3 s ARG 218 CO -0.04 -0.60 0.06 0.45 -1.08 0.00 0.00 175.30 174.09 3gt3 s SER 219 N -2.78 5.18 0.27 -2.89 0.15 -1.26 -1.64 113.70 110.73 3gt3 s SER 219 Ca 0.06 -0.15 0.03 0.00 0.70 0.00 0.00 55.95 56.59 3gt3 s SER 219 Cb -0.03 -1.92 -0.04 0.00 -1.71 0.00 0.00 66.02 62.33 3gt3 s SER 219 CO -0.04 0.02 0.19 0.27 1.20 0.00 0.00 173.24 174.88 3gt3 s ILE 220 N 1.27 0.07 0.04 6.45 -4.36 -0.90 -4.83 121.20 118.94 3gt3 s ILE 220 Ca 0.05 -2.00 0.04 0.00 -0.26 0.00 0.00 60.65 58.47 3gt3 s ILE 220 Cb -0.15 -2.50 -0.02 0.00 1.25 0.00 0.00 42.46 41.04 3gt3 s ILE 220 CO 0.03 0.00 -0.11 -0.44 0.24 0.00 0.00 174.94 174.66 3gt3 s SER 221 N -3.28 1.25 0.00 4.36 0.01 -1.26 -0.97 113.70 113.81 3gt3 s SER 221 Ca 0.39 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 57.18 3gt3 s SER 221 Cb 0.05 -0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.23 3gt3 s SER 221 CO 0.19 -0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.39 3gt3 n GLY 222 N 1.79 2.49 0.26 3.44 0.00 0.78 -4.88 105.19 109.07 3gt3 n GLY 222 Ca -0.19 -0.90 0.17 0.00 0.00 0.00 0.00 46.02 45.10 3gt3 n GLY 222 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3gt3 h THR 223 N 0.84 0.00 -0.08 2.61 1.35 -1.85 -1.44 112.91 114.34 3gt3 h THR 223 Ca 0.00 -0.26 0.02 0.00 -0.55 0.00 0.00 66.41 65.62 3gt3 h THR 223 Cb 0.00 1.16 -0.00 0.00 -1.73 0.00 0.00 68.15 67.58 3gt3 h THR 223 CO 0.00 0.00 0.07 0.28 -0.25 0.00 0.00 175.52 175.62 3gt3 h SER 224 N 0.00 0.00 0.64 5.36 0.02 -1.90 -1.55 113.55 116.12 3gt3 h SER 224 Ca 0.00 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.69 3gt3 h SER 224 Cb 0.28 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.78 3gt3 h SER 224 CO 0.00 0.00 -1.50 0.24 -1.14 0.00 0.00 176.83 174.43 3gt3 h MET 225 N 0.00 0.00 -0.27 3.45 2.86 -1.57 -3.37 114.93 116.04 3gt3 h MET 225 Ca 0.04 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.54 3gt3 h MET 225 Cb 0.17 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.83 3gt3 h MET 225 CO -0.00 0.59 -0.37 0.00 1.06 0.00 0.00 176.91 178.19 3gt3 h ALA 226 N 1.05 0.41 -0.23 6.32 0.00 -1.31 -3.31 119.26 122.18 3gt3 h ALA 226 Ca -0.21 -0.44 0.06 0.00 0.00 0.00 0.00 54.91 54.32 3gt3 h ALA 226 Cb 1.91 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 19.56 3gt3 h ALA 226 CO 0.09 0.49 -0.17 1.15 0.00 0.00 0.00 179.25 180.81 3gt3 h THR 227 N 0.47 0.52 0.00 0.00 2.02 -1.44 -1.65 112.91 112.83 3gt3 h THR 227 Ca 0.03 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.19 3gt3 h THR 227 Cb 0.95 0.52 -0.00 0.00 -1.74 0.00 0.00 68.15 67.89 3gt3 h THR 227 CO 0.09 0.00 -0.09 1.55 0.37 0.00 0.00 175.52 177.44 3gt3 h PRO 228 N -0.16 0.00 -0.49 6.66 0.13 -1.72 -0.22 132.00 136.19 3gt3 h PRO 228 Ca 0.13 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.28 3gt3 h PRO 228 Cb 0.37 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.46 3gt3 h PRO 228 CO -0.33 0.09 0.30 0.45 -0.23 0.00 0.00 178.00 178.28 3gt3 h HIS 229 N 0.00 0.57 -0.42 1.56 3.86 -1.39 -0.03 115.15 119.29 3gt3 h HIS 229 Ca -0.00 0.02 -0.12 0.00 -1.16 0.00 0.00 60.37 59.11 3gt3 h HIS 229 Cb 0.41 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.68 3gt3 h HIS 229 CO 0.00 0.33 -0.19 0.28 0.86 0.00 0.00 177.93 179.22 3gt3 h VAL 230 N 0.61 1.28 -0.24 2.45 2.07 -1.05 -0.60 116.25 120.77 3gt3 h VAL 230 Ca 0.19 -1.33 0.00 0.00 0.82 0.00 0.00 66.70 66.39 3gt3 h VAL 230 Cb -0.01 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 3gt3 h VAL 230 CO -0.08 0.45 0.15 0.00 0.02 0.00 0.00 177.57 178.12 3gt3 h ALA 231 N 0.83 0.30 -0.83 1.67 0.00 -1.00 -0.18 119.26 120.04 3gt3 h ALA 231 Ca 0.10 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 3gt3 h ALA 231 Cb 0.75 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 3gt3 h ALA 231 CO 0.06 -0.23 0.45 0.78 0.00 0.00 0.00 179.25 180.31 3gt3 h GLY 232 N 0.31 1.24 1.00 0.00 0.00 -0.97 -1.88 103.07 102.76 3gt3 h GLY 232 Ca 0.09 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 46.86 3gt3 h GLY 232 CO -0.02 0.54 0.30 -2.00 0.00 0.00 0.00 176.54 175.36 3gt3 h LEU 233 N 1.16 0.56 -0.27 3.11 5.85 -0.75 -0.54 115.31 124.43 3gt3 h LEU 233 Ca 0.29 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 59.02 3gt3 h LEU 233 Cb 0.03 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 40.88 3gt3 h LEU 233 CO -0.05 0.43 0.01 0.00 -0.34 0.00 0.00 178.44 178.49 3gt3 h ALA 234 N 1.16 0.25 -0.48 1.25 0.00 -0.79 0.57 119.26 121.21 3gt3 h ALA 234 Ca 0.17 0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.18 3gt3 h ALA 234 Cb -0.04 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3gt3 h ALA 234 CO -0.04 -0.40 0.27 0.00 0.00 0.00 0.00 179.25 179.08 3gt3 h ALA 235 N 1.23 0.61 -0.40 0.00 0.00 -0.99 0.50 119.26 120.20 3gt3 h ALA 235 Ca 0.13 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.07 3gt3 h ALA 235 Cb 0.16 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 3gt3 h ALA 235 CO -0.21 -0.05 0.19 -0.92 0.00 0.00 0.00 179.25 178.26 3gt3 h TYR 236 N 0.54 0.35 -0.17 0.00 3.20 -0.68 -1.18 116.97 119.03 3gt3 h TYR 236 Ca 0.20 0.02 -0.15 0.00 3.14 0.00 0.00 58.73 61.93 3gt3 h TYR 236 Cb 0.05 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.21 3gt3 h TYR 236 CO -0.08 0.18 -0.54 -0.07 -1.64 0.00 0.00 178.16 176.01 3gt3 h LEU 237 N 0.39 0.55 -0.41 2.82 3.38 -0.38 -1.79 115.31 119.87 3gt3 h LEU 237 Ca 0.17 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 3gt3 h LEU 237 Cb 0.09 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3gt3 h LEU 237 CO -0.13 0.98 0.24 0.24 0.09 0.00 0.00 178.44 179.85 3gt3 h MET 238 N 0.38 0.56 -0.77 1.13 2.86 -0.77 -1.81 114.93 116.51 3gt3 h MET 238 Ca 0.01 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 3gt3 h MET 238 Cb 1.07 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 32.57 3gt3 h MET 238 CO 0.10 0.44 0.49 1.15 1.06 0.00 0.00 176.91 180.15 3gt3 h THR 239 N 0.54 1.20 0.00 2.22 2.02 -1.04 -0.24 112.91 117.61 3gt3 h THR 239 Ca 0.15 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 66.93 3gt3 h THR 239 Cb 0.03 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.52 3gt3 h THR 239 CO -0.03 0.20 0.00 0.18 0.37 0.00 0.00 175.52 176.24 3gt3 n LEU 240 N -4.41 0.22 0.00 2.58 4.77 -0.69 -4.88 117.00 114.59 3gt3 n LEU 240 Ca 0.08 0.56 0.00 0.00 -0.03 0.00 0.00 56.01 56.62 3gt3 n LEU 240 Cb 0.04 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 40.60 3gt3 n LEU 240 CO 0.37 -0.38 0.00 0.61 -1.33 0.00 0.00 177.39 176.66 3gt3 n GLY 241 N -0.12 0.53 0.18 -0.72 0.00 -0.10 -4.93 105.19 100.03 3gt3 n GLY 241 Ca 0.03 -0.13 0.08 0.00 0.00 0.00 0.00 46.02 45.99 3gt3 n GLY 241 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gt3 h LYS 242 N 1.12 0.00 -2.89 1.61 1.79 -1.57 -3.48 116.57 113.15 3gt3 h LYS 242 Ca 0.00 0.00 0.02 0.00 -2.18 0.00 0.00 60.65 58.49 3gt3 h LYS 242 Cb 0.00 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.65 3gt3 h LYS 242 CO 0.00 0.24 0.35 -0.08 -1.08 0.00 0.00 179.45 178.88 3gt3 s THR 243 N -3.10 0.00 0.30 -0.16 -1.32 -1.25 -5.02 115.64 105.09 3gt3 s THR 243 Ca 0.06 -0.90 0.04 0.00 -1.21 0.00 0.00 61.69 59.68 3gt3 s THR 243 Cb 0.06 -2.95 -0.06 0.00 -1.51 0.00 0.00 72.50 68.04 3gt3 s THR 243 CO 0.70 0.00 0.02 0.42 -2.21 0.00 0.00 174.62 173.55 3gt3 s THR 244 N -2.16 1.29 0.31 5.08 -4.23 -1.26 -4.38 115.64 110.29 3gt3 s THR 244 Ca 0.17 -2.04 0.03 0.00 -1.18 0.00 0.00 61.69 58.67 3gt3 s THR 244 Cb -0.05 -2.64 0.29 0.00 1.34 0.00 0.00 72.50 71.45 3gt3 s THR 244 CO 0.10 -0.13 1.88 0.00 -0.54 0.00 0.00 174.62 175.93 3gt3 h ALA 245 N 2.21 1.58 0.00 3.99 0.00 -1.88 0.98 119.26 126.15 3gt3 h ALA 245 Ca -0.40 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.44 3gt3 h ALA 245 Cb 1.24 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 3gt3 h ALA 245 CO 0.68 0.23 -0.30 0.00 0.00 0.00 0.00 179.25 179.86 3gt3 h ALA 246 N 1.54 0.93 -0.01 0.00 0.00 -1.89 -3.32 119.26 116.51 3gt3 h ALA 246 Ca 0.43 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3gt3 h ALA 246 Cb 0.39 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3gt3 h ALA 246 CO -0.19 0.37 -0.03 -1.13 0.00 0.00 0.00 179.25 178.28 3gt3 n SER 247 N -3.35 1.43 -0.08 0.00 3.41 -0.69 -4.77 113.62 109.57 3gt3 n SER 247 Ca 0.01 -1.21 -0.08 0.00 -0.26 0.00 0.00 58.87 57.33 3gt3 n SER 247 Cb 0.52 0.09 0.09 0.00 -0.26 0.00 0.00 64.21 64.65 3gt3 n SER 247 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gt3 h ALA 248 N 1.25 0.88 -0.23 7.33 0.00 -0.94 -0.57 119.26 126.98 3gt3 h ALA 248 Ca 0.00 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 3gt3 h ALA 248 Cb 0.26 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3gt3 h ALA 248 CO 0.00 0.63 0.12 0.00 0.00 0.00 0.00 179.25 180.00 3gt3 h ARG 250 N 0.25 0.88 -0.47 0.00 3.08 -1.86 -1.10 114.38 115.16 3gt3 h ARG 250 Ca 0.08 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 3gt3 h ARG 250 Cb 0.10 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 3gt3 h ARG 250 CO -0.01 0.58 0.27 -0.92 -1.07 0.00 0.00 179.97 178.82 3gt3 h TYR 251 N 0.90 0.64 -0.78 3.04 3.20 -0.72 0.15 116.97 123.41 3gt3 h TYR 251 Ca 0.27 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.11 3gt3 h TYR 251 Cb -0.05 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 37.98 3gt3 h TYR 251 CO -0.03 0.47 0.41 0.82 -1.64 0.00 0.00 178.16 178.18 3gt3 h ILE 252 N 0.62 1.24 -0.66 1.81 2.04 -0.28 -1.38 117.51 120.91 3gt3 h ILE 252 Ca 0.17 -0.62 -0.08 0.00 1.00 0.00 0.00 64.86 65.33 3gt3 h ILE 252 Cb 0.03 0.22 -0.03 0.00 -0.74 0.00 0.00 36.82 36.31 3gt3 h ILE 252 CO -0.03 0.27 0.10 0.00 0.00 0.00 0.00 178.15 178.49 3gt3 h ALA 253 N 1.21 0.87 -0.78 1.87 0.00 -0.86 -0.69 119.26 120.87 3gt3 h ALA 253 Ca 0.27 -0.27 0.05 0.00 0.00 0.00 0.00 54.91 54.95 3gt3 h ALA 253 Cb 0.06 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.56 3gt3 h ALA 253 CO -0.04 0.64 0.51 -0.44 0.00 0.00 0.00 179.25 179.92 3gt3 h ASP 254 N 1.01 0.80 -0.31 0.00 3.32 -0.33 -2.94 116.42 117.96 3gt3 h ASP 254 Ca 0.20 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 3gt3 h ASP 254 Cb 0.45 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.82 3gt3 h ASP 254 CO 0.01 0.54 0.00 0.35 -1.72 0.00 0.00 179.24 178.42 3gt3 n THR 255 N -4.46 0.57 -1.34 0.35 -2.24 -0.55 -5.01 114.28 101.59 3gt3 n THR 255 Ca 0.11 -0.78 -0.33 0.00 -2.27 0.00 0.00 64.05 60.77 3gt3 n THR 255 Cb 0.15 0.87 0.10 0.00 -2.10 0.00 0.00 70.33 69.35 3gt3 n THR 255 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gt3 s ALA 256 N -1.18 2.10 0.06 6.98 0.00 -0.29 -4.64 121.76 124.79 3gt3 s ALA 256 Ca 0.29 0.64 -0.31 0.00 0.00 0.00 0.00 51.96 52.58 3gt3 s ALA 256 Cb 0.17 -3.40 -0.07 0.00 0.00 0.00 0.00 23.12 19.82 3gt3 s ALA 256 CO 0.23 -1.88 1.50 -0.80 0.00 0.00 0.00 175.76 174.80 3gt3 s ASN 257 N -2.51 6.74 -0.11 0.00 0.01 -0.52 -4.84 114.94 113.72 3gt3 s ASN 257 Ca 0.69 2.32 -0.01 0.00 -0.71 0.00 0.00 52.86 55.15 3gt3 s ASN 257 Cb -0.24 -2.57 -0.03 0.00 0.41 0.00 0.00 41.25 38.83 3gt3 s ASN 257 CO 0.48 -0.77 -0.08 -0.54 -1.51 0.00 0.00 177.10 174.68 3gt3 s LYS 258 N 2.15 3.19 -0.30 -0.60 1.02 -1.26 -0.77 119.74 123.17 3gt3 s LYS 258 Ca 0.68 -0.58 0.00 0.00 0.02 0.00 0.00 55.97 56.09 3gt3 s LYS 258 Cb -0.36 -2.69 0.00 0.00 -0.52 0.00 0.00 37.83 34.26 3gt3 s LYS 258 CO 0.29 0.42 0.00 0.41 -0.92 0.00 0.00 175.35 175.55 3gt3 n GLY 259 N 2.97 0.57 0.21 -3.33 0.00 -0.03 -4.91 105.19 100.67 3gt3 n GLY 259 Ca -0.18 -0.31 0.11 0.00 0.00 0.00 0.00 46.02 45.64 3gt3 n GLY 259 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3gt3 n ASP 260 N 0.17 1.40 -4.86 1.61 8.00 -1.26 -4.95 116.55 116.67 3gt3 n ASP 260 Ca -0.03 -1.17 -0.36 0.00 0.71 0.00 0.00 54.79 53.95 3gt3 n ASP 260 Cb 0.19 0.71 -0.06 0.00 -0.02 0.00 0.00 41.12 41.95 3gt3 n ASP 260 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3gt3 s LEU 261 N -2.77 4.38 0.20 0.64 1.43 -1.26 -4.87 118.68 116.43 3gt3 s LEU 261 Ca 0.13 0.88 0.02 0.00 -1.03 0.00 0.00 54.13 54.13 3gt3 s LEU 261 Cb 0.17 -2.94 -0.04 0.00 0.03 0.00 0.00 46.19 43.42 3gt3 s LEU 261 CO 0.72 0.20 0.35 -0.94 0.23 0.00 0.00 176.35 176.91 3gt3 s SER 262 N -1.60 6.34 -1.38 2.29 1.04 0.11 -4.56 113.70 115.95 3gt3 s SER 262 Ca 0.32 0.23 -0.09 0.00 0.48 0.00 0.00 55.95 56.88 3gt3 s SER 262 Cb -0.15 -1.93 0.02 0.00 0.10 0.00 0.00 66.02 64.06 3gt3 s SER 262 CO 0.17 -0.03 1.16 -3.20 0.98 0.00 0.00 173.24 172.32 3gt3 n ASN 263 N -0.89 -6.10 -4.56 7.02 5.15 -1.26 -0.75 115.26 113.88 3gt3 n ASN 263 Ca -0.07 -0.57 -0.41 0.00 -0.60 0.00 0.00 54.58 52.93 3gt3 n ASN 263 Cb 0.55 -4.89 -0.07 0.00 -0.53 0.00 0.00 39.78 34.83 3gt3 n ASN 263 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3gt3 s ILE 264 N -3.32 4.97 0.56 -1.44 -1.09 -1.26 -4.65 121.20 114.97 3gt3 s ILE 264 Ca 0.58 0.45 -0.21 0.00 -2.23 0.00 0.00 60.65 59.24 3gt3 s ILE 264 Cb -0.26 -4.00 -0.04 0.00 -1.58 0.00 0.00 42.46 36.57 3gt3 s ILE 264 CO 0.74 -0.25 1.31 -2.84 -1.23 0.00 0.00 174.94 172.68 3gt3 s PRO 265 N 2.51 3.08 0.04 2.79 0.02 -1.26 -4.88 135.00 137.30 3gt3 s PRO 265 Ca 0.21 2.12 -0.36 0.00 0.02 0.00 0.00 61.00 62.99 3gt3 s PRO 265 Cb -0.15 -2.17 -0.15 0.00 0.02 0.00 0.00 34.50 32.05 3gt3 s PRO 265 CO 0.14 -1.20 1.50 0.34 -0.33 0.00 0.00 177.00 177.45 3gt3 n PHE 266 N -1.18 1.85 -0.06 6.54 7.35 -1.26 -1.15 117.46 129.55 3gt3 n PHE 266 Ca 0.11 0.48 0.00 0.00 -0.76 0.00 0.00 57.45 57.28 3gt3 n PHE 266 Cb 0.46 -2.43 0.00 0.00 0.35 0.00 0.00 39.48 37.86 3gt3 n PHE 266 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3gt3 n GLY 267 N 3.13 0.82 3.88 7.13 0.00 -1.26 -5.03 105.19 113.86 3gt3 n GLY 267 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 3gt3 n GLY 267 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gt3 s THR 268 N -2.35 5.48 0.53 2.61 2.01 -0.30 -3.88 115.64 119.74 3gt3 s THR 268 Ca 0.00 0.17 -0.22 0.00 0.31 0.00 0.00 61.69 61.95 3gt3 s THR 268 Cb 0.00 -3.43 -0.05 0.00 0.01 0.00 0.00 72.50 69.02 3gt3 s THR 268 CO 0.00 0.57 1.33 0.68 -0.69 0.00 0.00 174.62 176.51 3gt3 s VAL 269 N -1.08 2.24 -0.80 3.82 -7.23 -1.26 -4.82 120.40 111.27 3gt3 s VAL 269 Ca 0.17 0.18 0.02 0.00 -1.81 0.00 0.00 61.98 60.54 3gt3 s VAL 269 Cb -0.12 -3.09 0.21 0.00 0.56 0.00 0.00 36.38 33.94 3gt3 s VAL 269 CO 0.07 -0.00 0.72 -3.20 -0.31 0.00 0.00 175.10 172.38 3gt3 n ASN 270 N -0.89 3.85 -3.77 4.85 2.85 -1.26 -4.93 115.26 115.96 3gt3 n ASN 270 Ca 0.10 -3.24 -0.19 0.00 -0.11 0.00 0.00 54.58 51.13 3gt3 n ASN 270 Cb 0.45 -0.89 -0.17 0.00 1.24 0.00 0.00 39.78 40.41 3gt3 n ASN 270 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 3gt3 s LEU 271 N -1.72 0.75 -0.16 1.20 1.43 -1.26 -0.85 118.68 118.07 3gt3 s LEU 271 Ca 0.29 -0.01 0.01 0.00 -1.03 0.00 0.00 54.13 53.39 3gt3 s LEU 271 Cb -0.01 -0.25 0.01 0.00 0.03 0.00 0.00 46.19 45.96 3gt3 s LEU 271 CO -0.11 -0.16 -0.18 -0.22 0.23 0.00 0.00 176.35 175.91 3gt3 s LEU 272 N 1.56 2.31 0.20 1.79 2.96 0.05 -1.22 118.68 126.33 3gt3 s LEU 272 Ca -0.02 -0.54 -0.32 0.00 -0.22 0.00 0.00 54.13 53.02 3gt3 s LEU 272 Cb -0.13 -1.52 -0.15 0.00 0.50 0.00 0.00 46.19 44.90 3gt3 s LEU 272 CO -0.03 0.06 1.31 0.00 -1.32 0.00 0.00 176.35 176.38 3gt3 n ALA 273 N 4.19 0.22 -3.56 5.97 0.00 -0.21 -1.44 120.51 125.68 3gt3 n ALA 273 Ca -0.20 0.44 -0.12 0.00 0.00 0.00 0.00 53.44 53.57 3gt3 n ALA 273 Cb 0.51 -2.16 -0.12 0.00 0.00 0.00 0.00 19.45 17.68 3gt3 n ALA 273 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3gt3 s TYR 274 N -0.01 -0.42 -1.74 0.00 5.04 -1.26 -4.46 117.35 114.51 3gt3 s TYR 274 Ca 0.72 0.95 0.28 0.00 -2.44 0.00 0.00 57.07 56.58 3gt3 s TYR 274 Cb -0.75 0.13 0.98 0.00 0.35 0.00 0.00 41.96 42.67 3gt3 s TYR 274 CO 0.50 -0.25 1.71 0.27 -1.34 0.00 0.00 175.55 176.44 3gt3 n ASN 275 N 3.84 0.80 -3.03 4.32 0.23 0.73 -4.70 115.26 117.44 3gt3 n ASN 275 Ca -0.21 -0.77 -0.18 0.00 -0.53 0.00 0.00 54.58 52.88 3gt3 n ASN 275 Cb 0.55 0.04 -0.01 0.00 -2.08 0.00 0.00 39.78 38.28 3gt3 n ASN 275 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 3gt3 n ASN 276 N -0.75 -3.47 -4.68 0.53 5.15 -1.26 -4.89 115.26 105.88 3gt3 n ASN 276 Ca 0.13 -0.15 -0.42 0.00 -0.60 0.00 0.00 54.58 53.54 3gt3 n ASN 276 Cb 0.32 -2.92 -0.03 0.00 -0.53 0.00 0.00 39.78 36.62 3gt3 n ASN 276 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 3gt3 s TYR 277 N -2.76 3.49 -0.42 1.20 5.04 -1.26 -5.00 117.35 117.65 3gt3 s TYR 277 Ca 0.25 1.48 -0.09 0.00 -2.44 0.00 0.00 57.07 56.27 3gt3 s TYR 277 Cb -0.13 -3.12 0.07 0.00 0.35 0.00 0.00 41.96 39.13 3gt3 s TYR 277 CO 0.31 -0.21 0.26 1.14 -1.34 0.00 0.00 175.55 175.71 3gt3 s GLN 278 N 1.97 2.63 0.00 4.97 -2.07 -1.26 -4.98 119.66 120.93 3gt3 s GLN 278 Ca 0.45 -1.43 0.00 0.00 -1.82 0.00 0.00 55.36 52.56 3gt3 s GLN 278 Cb -0.18 -3.79 0.00 0.00 -1.09 0.00 0.00 33.01 27.96 3gt3 s GLN 278 CO 0.16 -0.94 0.31 0.00 -1.32 0.00 0.00 175.29 173.51