#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gh1 s LEU 3 N 0.00 4.02 -0.21 -3.43 2.96 -1.26 -4.95 118.68 115.82 3gh1 s LEU 3 Ca 0.00 1.22 -0.04 0.00 -0.22 0.00 0.00 54.13 55.09 3gh1 s LEU 3 Cb 0.00 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.13 3gh1 s LEU 3 CO 0.00 -0.77 -0.03 -0.63 -1.32 0.00 0.00 176.35 173.60 3gh1 s ILE 4 N 3.42 3.57 -0.15 6.68 1.01 -1.26 -0.82 121.20 133.65 3gh1 s ILE 4 Ca 0.45 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.67 3gh1 s ILE 4 Cb -0.14 -2.61 -0.00 0.00 0.01 0.00 0.00 42.46 39.72 3gh1 s ILE 4 CO 0.10 0.43 -0.16 -0.63 0.00 0.00 0.00 174.94 174.68 3gh1 s ILE 5 N 1.21 2.62 0.03 2.92 -1.09 0.07 -4.94 121.20 122.01 3gh1 s ILE 5 Ca 0.03 -0.79 -0.19 0.00 -2.23 0.00 0.00 60.65 57.46 3gh1 s ILE 5 Cb -0.14 -2.09 -0.06 0.00 -1.58 0.00 0.00 42.46 38.58 3gh1 s ILE 5 CO -0.00 0.52 0.56 -1.10 -1.23 0.00 0.00 174.94 173.69 3gh1 s GLN 6 N 0.72 4.23 -0.20 2.79 1.11 -1.26 -0.61 119.66 126.45 3gh1 s GLN 6 Ca -0.07 0.70 -0.03 0.00 0.01 0.00 0.00 55.36 55.97 3gh1 s GLN 6 Cb -0.16 -3.29 -0.01 0.00 -1.01 0.00 0.00 33.01 28.55 3gh1 s GLN 6 CO 0.01 0.52 -0.06 0.08 0.01 0.00 0.00 175.29 175.85 3gh1 s VAL 7 N -0.67 3.36 0.70 1.09 1.01 0.12 -4.96 120.40 121.06 3gh1 s VAL 7 Ca 0.29 -0.51 -0.11 0.00 0.00 0.00 0.00 61.98 61.65 3gh1 s VAL 7 Cb -0.19 -2.50 0.01 0.00 0.00 0.00 0.00 36.38 33.71 3gh1 s VAL 7 CO 0.17 0.45 1.06 -0.44 0.00 0.00 0.00 175.10 176.35 3gh1 s SER 8 N 1.15 5.28 0.26 3.32 0.01 -1.26 -1.74 113.70 120.72 3gh1 s SER 8 Ca 0.02 1.64 -0.29 0.00 1.31 0.00 0.00 55.95 58.63 3gh1 s SER 8 Cb -0.14 -2.49 -0.15 0.00 0.21 0.00 0.00 66.02 63.45 3gh1 s SER 8 CO -0.01 -1.51 1.00 -2.65 0.41 0.00 0.00 173.24 170.47 3gh1 n PRO 9 N -3.18 1.21 -3.72 12.44 -0.02 -1.25 -4.93 135.00 135.56 3gh1 n PRO 9 Ca 0.08 0.43 -0.12 0.00 -2.02 0.00 0.00 63.50 61.87 3gh1 n PRO 9 Cb 0.53 -1.79 -0.11 0.00 -0.02 0.00 0.00 33.50 32.11 3gh1 n PRO 9 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gh1 s ALA 10 N -0.90 -0.88 0.00 3.55 0.00 -1.26 -5.10 121.76 117.18 3gh1 s ALA 10 Ca 0.62 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.80 3gh1 s ALA 10 Cb -0.74 -0.74 0.00 0.00 0.00 0.00 0.00 23.12 21.64 3gh1 s ALA 10 CO 0.58 -0.21 0.00 0.41 0.00 0.00 0.00 175.76 176.54 3gh1 n GLY 11 N 3.76 -1.15 3.41 0.00 0.00 -1.26 -4.70 105.19 105.25 3gh1 n GLY 11 Ca -0.20 -1.31 -0.33 0.00 0.00 0.00 0.00 46.02 44.17 3gh1 n GLY 11 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3gh1 s SER 12 N -4.00 4.33 0.21 1.61 1.04 -1.26 -5.18 113.70 110.46 3gh1 s SER 12 Ca 0.00 -0.26 0.03 0.00 0.48 0.00 0.00 55.95 56.20 3gh1 s SER 12 Cb 0.00 -1.69 -0.05 0.00 0.10 0.00 0.00 66.02 64.38 3gh1 s SER 12 CO 0.00 0.14 -0.01 -1.81 0.98 0.00 0.00 173.24 172.54 3gh1 s ASP 14 N 0.51 1.71 0.48 7.02 1.01 -1.26 -5.14 116.67 121.00 3gh1 s ASP 14 Ca -0.06 -1.20 -0.24 0.00 0.71 0.00 0.00 52.55 51.76 3gh1 s ASP 14 Cb -0.15 0.03 -0.08 0.00 1.01 0.00 0.00 42.92 43.73 3gh1 s ASP 14 CO 0.03 -0.51 1.41 0.18 0.21 0.00 0.00 175.17 176.49 3gh1 n LEU 15 N -0.37 5.18 -4.52 1.23 4.77 -1.26 -4.80 117.00 117.23 3gh1 n LEU 15 Ca -0.06 1.08 -0.28 0.00 -0.03 0.00 0.00 56.01 56.73 3gh1 n LEU 15 Cb 0.64 -1.59 -0.10 0.00 -2.33 0.00 0.00 43.42 40.03 3gh1 n LEU 15 CO 0.36 -0.28 -0.46 -0.76 -1.33 0.00 0.00 177.39 174.92 3gh1 s LEU 16 N -2.83 2.80 0.66 2.23 1.43 -1.26 -5.10 118.68 116.61 3gh1 s LEU 16 Ca 0.64 -0.61 -0.06 0.00 -1.03 0.00 0.00 54.13 53.07 3gh1 s LEU 16 Cb -0.44 -1.55 0.04 0.00 0.03 0.00 0.00 46.19 44.27 3gh1 s LEU 16 CO 0.55 0.13 0.96 -0.94 0.23 0.00 0.00 176.35 177.29 3gh1 s SER 17 N -2.56 5.06 0.20 2.29 1.04 -1.26 -4.99 113.70 113.48 3gh1 s SER 17 Ca 0.22 0.47 -0.10 0.00 0.48 0.00 0.00 55.95 57.02 3gh1 s SER 17 Cb -0.09 -1.23 0.20 0.00 0.10 0.00 0.00 66.02 64.99 3gh1 s SER 17 CO 0.13 -1.41 1.82 -0.61 0.98 0.00 0.00 173.24 174.15 3gh1 h GLN 18 N -0.42 0.71 -0.62 4.02 5.75 -2.01 -2.81 115.11 119.73 3gh1 h GLN 18 Ca -0.44 -0.04 0.08 0.00 -0.15 0.00 0.00 58.65 58.09 3gh1 h GLN 18 Cb 1.30 -0.16 -0.06 0.00 1.07 0.00 0.00 27.48 29.63 3gh1 h GLN 18 CO 0.60 0.47 0.29 1.25 -2.65 0.00 0.00 178.83 178.78 3gh1 h LEU 19 N 0.73 0.37 -1.99 -2.39 5.85 -2.01 -1.17 115.31 114.71 3gh1 h LEU 19 Ca 0.28 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 59.04 3gh1 h LEU 19 Cb 0.10 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.12 3gh1 h LEU 19 CO -0.14 0.23 -0.06 -0.33 -0.34 0.00 0.00 178.44 177.80 3gh1 h GLU 20 N 0.53 0.00 -0.00 1.25 5.08 -1.88 -3.22 114.58 116.33 3gh1 h GLU 20 Ca 0.30 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 3gh1 h GLU 20 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 3gh1 h GLU 20 CO -0.24 0.06 -0.19 1.33 -1.00 0.00 0.00 179.01 178.98 3gh1 n VAL 21 N -4.26 0.00 -0.17 3.13 0.24 -0.84 -4.70 118.33 111.74 3gh1 n VAL 21 Ca -0.03 -0.41 -0.04 0.00 -2.04 0.00 0.00 64.34 61.82 3gh1 n VAL 21 Cb 0.14 1.04 0.05 0.00 -1.47 0.00 0.00 33.84 33.61 3gh1 n VAL 21 CO 0.00 0.00 0.00 1.05 -2.14 0.00 0.00 176.83 175.74 3gh1 h GLU 22 N 0.40 0.51 0.00 7.34 4.11 -1.24 -0.89 114.58 124.80 3gh1 h GLU 22 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.40 3gh1 h GLU 22 Cb 0.18 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3gh1 h GLU 22 CO 0.00 0.34 0.00 0.54 0.07 0.00 0.00 179.01 179.96 3gh1 n ARG 23 N -4.87 0.10 -0.11 1.06 1.74 -1.26 -1.47 116.66 111.85 3gh1 n ARG 23 Ca 0.04 0.23 0.11 0.00 -0.77 0.00 0.00 57.85 57.46 3gh1 n ARG 23 Cb 0.13 -1.50 0.32 0.00 -1.02 0.00 0.00 32.46 30.39 3gh1 n ARG 23 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3gh1 n LEU 24 N -1.31 2.13 -4.74 0.55 4.77 -0.34 -3.91 117.00 114.15 3gh1 n LEU 24 Ca 0.03 -0.90 -0.41 0.00 -0.03 0.00 0.00 56.01 54.70 3gh1 n LEU 24 Cb 0.06 -0.14 -0.05 0.00 -2.33 0.00 0.00 43.42 40.96 3gh1 n LEU 24 CO 0.06 0.45 0.70 -0.75 -1.33 0.00 0.00 177.39 176.52 3gh1 s LYS 25 N -1.71 4.72 0.02 3.23 2.20 -0.54 -4.76 119.74 122.90 3gh1 s LYS 25 Ca 0.33 1.55 -0.30 0.00 -0.36 0.00 0.00 55.97 57.20 3gh1 s LYS 25 Cb 0.18 -3.31 -0.08 0.00 -1.51 0.00 0.00 37.83 33.11 3gh1 s LYS 25 CO 0.27 0.28 1.89 0.21 -0.36 0.00 0.00 175.35 177.64 3gh1 s LYS 26 N -0.57 4.15 0.26 4.03 2.20 -1.26 -4.76 119.74 123.80 3gh1 s LYS 26 Ca 0.45 2.52 0.02 0.00 -0.36 0.00 0.00 55.97 58.61 3gh1 s LYS 26 Cb -0.26 -4.09 -0.04 0.00 -1.51 0.00 0.00 37.83 31.93 3gh1 s LYS 26 CO 0.33 -0.92 0.15 0.95 -0.36 0.00 0.00 175.35 175.49 3gh1 s THR 27 N 4.26 0.23 0.44 3.43 -4.23 -1.26 -5.04 115.64 113.46 3gh1 s THR 27 Ca 0.85 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 59.53 3gh1 s THR 27 Cb -0.41 -2.54 0.20 0.00 1.34 0.00 0.00 72.50 71.09 3gh1 s THR 27 CO 0.39 0.00 2.00 0.00 -0.54 0.00 0.00 174.62 176.46 3gh1 h ALA 28 N 2.39 1.58 -0.00 3.99 0.00 -2.07 -3.20 119.26 121.95 3gh1 h ALA 28 Ca -0.35 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3gh1 h ALA 28 Cb 1.25 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3gh1 h ALA 28 CO 0.53 0.23 -0.43 0.45 0.00 0.00 0.00 179.25 180.03 3gh1 n SER 29 N -4.15 1.02 -4.55 0.00 2.88 -1.26 -4.95 113.62 102.60 3gh1 n SER 29 Ca -0.02 -1.01 -0.39 0.00 -1.33 0.00 0.00 58.87 56.12 3gh1 n SER 29 Cb 0.26 0.73 -0.03 0.00 -0.75 0.00 0.00 64.21 64.42 3gh1 n SER 29 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3gh1 s SER 30 N -1.91 5.53 0.32 -3.46 0.15 -1.21 -4.81 113.70 108.31 3gh1 s SER 30 Ca 0.08 0.16 0.01 0.00 0.70 0.00 0.00 55.95 56.90 3gh1 s SER 30 Cb 0.10 -2.54 0.55 0.00 -1.71 0.00 0.00 66.02 62.43 3gh1 s SER 30 CO 0.42 -2.21 1.95 0.44 1.20 0.00 0.00 173.24 175.04 3gh1 h ASP 31 N 13.56 0.86 -0.35 5.45 3.32 -1.93 -2.46 116.42 134.87 3gh1 h ASP 31 Ca -0.27 -0.01 -0.07 0.00 0.02 0.00 0.00 57.03 56.71 3gh1 h ASP 31 Cb 1.13 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.48 3gh1 h ASP 31 CO 1.23 0.58 -0.07 0.25 -1.72 0.00 0.00 179.24 179.51 3gh1 h LEU 32 N 0.99 0.67 -0.33 1.55 5.85 -1.87 -2.19 115.31 119.98 3gh1 h LEU 32 Ca 0.34 -0.35 0.06 0.00 0.84 0.00 0.00 57.88 58.76 3gh1 h LEU 32 Cb 0.09 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.89 3gh1 h LEU 32 CO -0.11 0.86 0.01 0.22 -0.34 0.00 0.00 178.44 179.09 3gh1 h TYR 33 N 0.46 0.01 -0.90 1.25 5.03 -1.65 -1.36 116.97 119.81 3gh1 h TYR 33 Ca 0.09 0.02 0.01 0.00 2.58 0.00 0.00 58.73 61.43 3gh1 h TYR 33 Cb 0.56 0.05 -0.04 0.00 1.55 0.00 0.00 36.73 38.84 3gh1 h TYR 33 CO 0.05 -0.04 0.59 1.96 -1.32 0.00 0.00 178.16 179.40 3gh1 h GLN 34 N 0.11 1.18 -0.25 1.82 1.08 -1.23 -0.17 115.11 117.65 3gh1 h GLN 34 Ca 0.16 -0.07 -0.00 0.00 -1.45 0.00 0.00 58.65 57.28 3gh1 h GLN 34 Cb 0.21 -0.27 -0.01 0.00 -0.05 0.00 0.00 27.48 27.36 3gh1 h GLN 34 CO -0.26 0.78 0.15 1.25 -0.95 0.00 0.00 178.83 179.81 3gh1 h LEU 35 N 1.22 0.30 -0.61 1.46 6.46 -1.15 -0.48 115.31 122.50 3gh1 h LEU 35 Ca 0.33 -0.05 0.00 0.00 -0.12 0.00 0.00 57.88 58.04 3gh1 h LEU 35 Cb -0.14 -0.07 -0.03 0.00 -0.73 0.00 0.00 40.66 39.69 3gh1 h LEU 35 CO -0.07 0.26 0.39 0.22 -0.62 0.00 0.00 178.44 178.62 3gh1 h TYR 36 N 0.31 0.79 -0.46 1.25 3.20 -0.90 -0.82 116.97 120.33 3gh1 h TYR 36 Ca 0.09 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.96 3gh1 h TYR 36 Cb 0.02 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.01 3gh1 h TYR 36 CO -0.05 0.51 0.27 -0.09 -1.64 0.00 0.00 178.16 177.17 3gh1 h ARG 37 N 0.83 0.63 -0.44 1.82 2.43 -0.96 0.70 114.38 119.40 3gh1 h ARG 37 Ca 0.22 -0.06 -0.14 0.00 -0.81 0.00 0.00 59.98 59.20 3gh1 h ARG 37 Cb -0.06 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.34 3gh1 h ARG 37 CO -0.05 0.47 -0.26 -0.97 -1.51 0.00 0.00 179.97 177.65 3gh1 h ASN 38 N 0.61 0.96 -0.46 -3.80 -1.24 -0.76 0.92 115.58 111.80 3gh1 h ASN 38 Ca 0.16 -0.38 -0.11 0.00 0.71 0.00 0.00 56.30 56.68 3gh1 h ASN 38 Cb 0.01 -0.27 -0.02 0.00 0.73 0.00 0.00 38.32 38.77 3gh1 h ASN 38 CO -0.03 1.16 -0.14 0.00 -1.29 0.00 0.00 177.43 177.13 3gh1 h SER 40 N 0.84 0.47 -0.91 0.00 0.02 -0.68 -2.77 113.55 110.51 3gh1 h SER 40 Ca 0.13 -0.29 0.02 0.00 -0.84 0.00 0.00 61.79 60.80 3gh1 h SER 40 Cb 0.69 -0.13 -0.05 0.00 0.14 0.00 0.00 62.40 63.05 3gh1 h SER 40 CO 0.05 0.65 0.60 0.25 -1.14 0.00 0.00 176.83 177.24 3gh1 h LEU 41 N 0.27 1.02 -1.03 5.07 5.85 -0.76 -2.68 115.31 123.06 3gh1 h LEU 41 Ca 0.08 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 3gh1 h LEU 41 Cb 0.40 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 3gh1 h LEU 41 CO 0.01 0.73 0.47 0.00 -0.34 0.00 0.00 178.44 179.31 3gh1 h ALA 42 N 1.44 1.26 0.00 1.25 0.00 -1.19 0.44 119.26 122.47 3gh1 h ALA 42 Ca 0.34 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 3gh1 h ALA 42 Cb -0.09 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.35 3gh1 h ALA 42 CO -0.08 0.61 -0.37 -0.39 0.00 0.00 0.00 179.25 179.02 3gh1 h VAL 43 N 1.15 1.22 0.00 0.00 -1.51 -1.21 -2.45 116.25 113.45 3gh1 h VAL 43 Ca 0.29 -1.28 -0.12 0.00 -1.23 0.00 0.00 66.70 64.37 3gh1 h VAL 43 Cb 0.00 1.70 -0.02 0.00 -2.13 0.00 0.00 31.29 30.84 3gh1 h VAL 43 CO -0.05 0.36 -0.61 -0.07 -1.23 0.00 0.00 177.57 175.97 3gh1 h LEU 44 N 0.00 0.00 -6.24 4.19 3.38 -1.13 -3.37 115.31 112.14 3gh1 h LEU 44 Ca -0.00 0.00 -0.73 0.00 0.09 0.00 0.00 57.88 57.23 3gh1 h LEU 44 Cb 0.67 0.00 -0.33 0.00 0.09 0.00 0.00 40.66 41.09 3gh1 h LEU 44 CO 0.05 0.54 0.38 -3.20 0.09 0.00 0.00 178.44 176.29 3gh1 n ASN 45 N -3.20 5.97 -3.27 -0.43 5.15 0.08 -3.91 115.26 115.65 3gh1 n ASN 45 Ca 0.01 -3.57 -0.38 0.00 -0.60 0.00 0.00 54.58 50.04 3gh1 n ASN 45 Cb 0.76 -1.00 -0.01 0.00 -0.53 0.00 0.00 39.78 39.00 3gh1 n ASN 45 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 3gh1 n SER 46 N 0.43 7.58 -2.77 1.20 3.41 -1.24 -4.86 113.62 117.37 3gh1 n SER 46 Ca 0.35 -3.29 -0.02 0.00 -0.26 0.00 0.00 58.87 55.64 3gh1 n SER 46 Cb 0.33 -1.28 0.06 0.00 -0.26 0.00 0.00 64.21 63.06 3gh1 n SER 46 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3gh1 n THR 50 N 1.10 0.96 -4.77 6.66 -2.24 -1.26 -5.05 114.28 109.68 3gh1 n THR 50 Ca 0.56 -2.59 -0.33 0.00 -2.27 0.00 0.00 64.05 59.43 3gh1 n THR 50 Cb 0.31 1.12 -0.07 0.00 -2.10 0.00 0.00 70.33 69.59 3gh1 n THR 50 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 3gh1 s ASP 51 N -3.14 4.10 -0.08 3.42 -4.77 -1.26 -5.00 116.67 109.94 3gh1 s ASP 51 Ca 0.24 -1.69 0.12 0.00 -3.30 0.00 0.00 52.55 47.92 3gh1 s ASP 51 Cb 0.37 0.64 0.19 0.00 -1.09 0.00 0.00 42.92 43.03 3gh1 s ASP 51 CO -0.04 -0.91 1.11 -0.46 0.70 0.00 0.00 175.17 175.57 3gh1 n ASN 52 N -1.31 2.29 -4.92 2.11 6.94 -1.26 -5.00 115.26 114.12 3gh1 n ASN 52 Ca -0.20 -2.66 -0.28 0.00 -0.02 0.00 0.00 54.58 51.41 3gh1 n ASN 52 Cb 0.67 -0.27 -0.03 0.00 -2.36 0.00 0.00 39.78 37.78 3gh1 n ASN 52 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 3gh1 s SER 53 N -2.11 6.41 -0.24 0.53 0.15 -1.26 -4.81 113.70 112.38 3gh1 s SER 53 Ca 0.20 0.50 0.00 0.00 0.70 0.00 0.00 55.95 57.36 3gh1 s SER 53 Cb 0.18 -2.05 0.24 0.00 -1.71 0.00 0.00 66.02 62.67 3gh1 s SER 53 CO 0.02 -0.07 1.71 0.29 1.20 0.00 0.00 173.24 176.40 3gh1 n LYS 54 N -0.63 1.62 -1.25 5.44 5.02 -1.26 -3.76 118.16 123.34 3gh1 n LYS 54 Ca -0.04 -1.33 -0.26 0.00 -2.02 0.00 0.00 58.31 54.66 3gh1 n LYS 54 Cb 0.54 -1.52 0.14 0.00 -0.02 0.00 0.00 35.03 34.17 3gh1 n LYS 54 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3gh1 n GLU 55 N 0.15 2.40 -0.03 1.97 1.02 -1.26 -4.06 120.64 120.82 3gh1 n GLU 55 Ca 0.26 -3.15 -0.03 0.00 -0.02 0.00 0.00 57.16 54.22 3gh1 n GLU 55 Cb 0.78 -2.19 -0.13 0.00 -0.02 0.00 0.00 31.44 29.88 3gh1 n GLU 55 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3gh1 n LEU 56 N -1.06 0.41 -0.31 -4.62 4.32 -1.25 -4.06 117.00 110.43 3gh1 n LEU 56 Ca 0.58 0.18 0.03 0.00 -0.02 0.00 0.00 56.01 56.79 3gh1 n LEU 56 Cb 1.28 0.23 0.10 0.00 -1.62 0.00 0.00 43.42 43.40 3gh1 n LEU 56 CO 0.63 0.28 0.55 0.18 -1.22 0.00 0.00 177.39 177.81 3gh1 n LEU 57 N -2.75 -0.38 -0.02 2.23 4.77 -1.26 -2.88 117.00 116.72 3gh1 n LEU 57 Ca -0.18 1.47 0.17 0.00 -0.03 0.00 0.00 56.01 57.44 3gh1 n LEU 57 Cb 0.94 -0.42 0.62 0.00 -2.33 0.00 0.00 43.42 42.23 3gh1 n LEU 57 CO 0.44 -1.39 1.18 0.44 -1.33 0.00 0.00 177.39 176.73 3gh1 h ASP 58 N 0.00 0.13 0.07 -1.43 5.19 -1.88 0.84 116.42 119.34 3gh1 h ASP 58 Ca 0.38 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.77 3gh1 h ASP 58 Cb 0.59 -0.02 -0.00 0.00 0.18 0.00 0.00 39.33 40.08 3gh1 h ASP 58 CO -0.87 0.07 -0.08 0.50 -3.12 0.00 0.00 179.24 175.74 3gh1 h LYS 59 N 0.14 0.04 -0.94 3.56 3.64 -1.79 -3.29 116.57 117.93 3gh1 h LYS 59 Ca 0.25 -0.01 -0.54 0.00 -1.27 0.00 0.00 60.65 59.09 3gh1 h LYS 59 Cb 0.81 -0.01 -0.42 0.00 -0.41 0.00 0.00 32.23 32.19 3gh1 h LYS 59 CO -0.03 0.13 -0.82 0.66 -2.27 0.00 0.00 179.45 177.11 3gh1 n TYR 60 N -4.42 2.80 -0.13 1.91 4.01 0.29 -4.80 117.16 116.83 3gh1 n TYR 60 Ca -0.02 -2.46 0.10 0.00 -0.16 0.00 0.00 57.90 55.35 3gh1 n TYR 60 Cb 0.17 -0.27 0.44 0.00 -0.31 0.00 0.00 39.34 39.38 3gh1 n TYR 60 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 3gh1 h LYS 61 N 2.33 0.52 -0.01 -0.72 1.57 -1.62 -2.19 116.57 116.46 3gh1 h LYS 61 Ca 0.31 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 3gh1 h LYS 61 Cb 1.35 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.54 3gh1 h LYS 61 CO 0.74 0.35 -0.05 0.27 -0.57 0.00 0.00 179.45 180.19 3gh1 n ASN 62 N -4.48 0.95 -4.77 0.86 0.23 -1.26 -4.90 115.26 101.89 3gh1 n ASN 62 Ca 0.11 -1.17 -0.40 0.00 -0.53 0.00 0.00 54.58 52.59 3gh1 n ASN 62 Cb 0.33 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 38.05 3gh1 n ASN 62 CO 0.00 0.00 0.00 0.12 -0.93 0.00 0.00 177.26 176.45 3gh1 s PHE 63 N -2.13 2.53 0.16 -2.53 5.36 -0.82 -4.60 117.98 115.93 3gh1 s PHE 63 Ca 0.37 1.24 -0.20 0.00 -0.96 0.00 0.00 56.93 57.38 3gh1 s PHE 63 Cb 0.21 -3.94 0.05 0.00 -0.34 0.00 0.00 43.02 39.00 3gh1 s PHE 63 CO 0.39 -2.90 0.53 -0.51 -1.46 0.00 0.00 175.22 171.27 3gh1 s ASP 64 N -0.40 -0.41 -0.01 6.13 1.01 -1.02 -4.99 116.67 116.97 3gh1 s ASP 64 Ca 0.58 -0.18 0.00 0.00 0.71 0.00 0.00 52.55 53.66 3gh1 s ASP 64 Cb -0.44 0.56 0.01 0.00 1.01 0.00 0.00 42.92 44.06 3gh1 s ASP 64 CO 0.58 -0.96 0.01 -0.51 0.21 0.00 0.00 175.17 174.50 3gh1 s ILE 65 N -3.79 0.03 -0.09 0.77 2.07 -1.26 -0.70 121.20 118.23 3gh1 s ILE 65 Ca 0.03 0.07 0.03 0.00 -1.41 0.00 0.00 60.65 59.38 3gh1 s ILE 65 Cb -0.00 -0.09 0.00 0.00 0.13 0.00 0.00 42.46 42.50 3gh1 s ILE 65 CO -0.11 0.06 -0.19 -0.89 -1.91 0.00 0.00 174.94 171.89 3gh1 s THR 66 N 0.50 1.70 0.76 4.00 2.01 0.29 -4.87 115.64 120.03 3gh1 s THR 66 Ca -0.04 -0.81 -0.01 0.00 0.31 0.00 0.00 61.69 61.13 3gh1 s THR 66 Cb -0.06 -1.49 0.15 0.00 0.01 0.00 0.00 72.50 71.10 3gh1 s THR 66 CO -0.01 0.48 1.04 0.52 -0.69 0.00 0.00 174.62 175.96 3gh1 n VAL 67 N 3.63 0.00 -3.65 3.82 0.31 -1.26 -0.74 118.33 120.44 3gh1 n VAL 67 Ca -0.20 -1.58 -0.20 0.00 -0.01 0.00 0.00 64.34 62.35 3gh1 n VAL 67 Cb 0.52 -0.91 -0.17 0.00 -0.91 0.00 0.00 33.84 32.37 3gh1 n VAL 67 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 3gh1 s ARG 69 N -5.21 -0.01 0.00 5.55 0.52 -1.26 -5.01 118.95 113.53 3gh1 s ARG 69 Ca 0.68 0.33 0.00 0.00 -0.52 0.00 0.00 55.73 56.22 3gh1 s ARG 69 Cb -0.04 -0.73 0.00 0.00 0.52 0.00 0.00 34.95 34.71 3gh1 s ARG 69 CO 0.45 -0.40 0.00 0.54 0.02 0.00 0.00 175.30 175.91 3gh1 n ARG 70 N 5.30 1.05 -0.25 3.54 5.12 -0.43 -4.97 116.66 126.02 3gh1 n ARG 70 Ca -0.04 0.00 -0.06 0.00 -1.93 0.00 0.00 57.85 55.82 3gh1 n ARG 70 Cb 0.50 0.00 0.08 0.00 -1.16 0.00 0.00 32.46 31.87 3gh1 n ARG 70 CO 0.00 0.00 0.00 1.05 -1.93 0.00 0.00 177.63 176.75 3gh1 h GLU 71 N 0.00 1.11 -0.67 5.56 9.09 -2.04 -1.90 114.58 125.73 3gh1 h GLU 71 Ca 0.00 -0.24 -0.28 0.00 0.05 0.00 0.00 59.36 58.89 3gh1 h GLU 71 Cb 0.00 -0.16 -0.17 0.00 -1.65 0.00 0.00 28.75 26.77 3gh1 h GLU 71 CO 0.00 0.95 0.27 0.54 0.05 0.00 0.00 179.01 180.83 3gh1 n ARG 72 N -4.25 2.68 0.00 1.06 1.74 -1.26 -5.06 116.66 111.58 3gh1 n ARG 72 Ca 0.06 -3.07 0.00 0.00 -0.77 0.00 0.00 57.85 54.07 3gh1 n ARG 72 Cb 0.24 -2.06 0.00 0.00 -1.02 0.00 0.00 32.46 29.61 3gh1 n ARG 72 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gh1 n GLY 73 N -0.76 -0.68 3.73 -0.13 0.00 -0.71 -4.91 105.19 101.73 3gh1 n GLY 73 Ca 0.43 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.05 3gh1 n GLY 73 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gh1 s ILE 74 N 0.00 4.30 0.08 -0.61 -1.09 -1.26 -1.32 121.20 121.30 3gh1 s ILE 74 Ca 0.00 2.00 0.07 0.00 -2.23 0.00 0.00 60.65 60.49 3gh1 s ILE 74 Cb 0.00 -4.28 -0.04 0.00 -1.58 0.00 0.00 42.46 36.57 3gh1 s ILE 74 CO 0.00 0.35 -0.16 -0.54 -1.23 0.00 0.00 174.94 173.36 3gh1 s LYS 75 N -0.31 2.01 -0.06 2.79 1.02 -1.26 -3.89 119.74 120.04 3gh1 s LYS 75 Ca 0.46 -1.04 0.04 0.00 0.02 0.00 0.00 55.97 55.45 3gh1 s LYS 75 Cb -0.25 -2.20 -0.02 0.00 -0.52 0.00 0.00 37.83 34.84 3gh1 s LYS 75 CO 0.31 0.52 -0.17 -0.51 -0.92 0.00 0.00 175.35 174.58 3gh1 s LEU 76 N -1.81 2.53 -0.22 3.17 1.43 -0.71 -4.56 118.68 118.50 3gh1 s LEU 76 Ca 0.17 -0.31 -0.04 0.00 -1.03 0.00 0.00 54.13 52.92 3gh1 s LEU 76 Cb -0.11 -1.50 -0.01 0.00 0.03 0.00 0.00 46.19 44.60 3gh1 s LEU 76 CO 0.08 0.30 -0.02 -0.70 0.23 0.00 0.00 176.35 176.24 3gh1 s GLU 77 N -0.45 3.46 -0.22 1.70 2.12 0.08 0.15 118.70 125.55 3gh1 s GLU 77 Ca 0.05 -0.59 -0.10 0.00 0.36 0.00 0.00 54.97 54.70 3gh1 s GLU 77 Cb -0.12 -3.05 -0.05 0.00 0.26 0.00 0.00 34.13 31.17 3gh1 s GLU 77 CO 0.02 -0.15 0.13 -0.51 -0.54 0.00 0.00 175.26 174.21 3gh1 s LEU 78 N 1.38 4.06 -0.21 2.70 1.43 0.22 -0.55 118.68 127.72 3gh1 s LEU 78 Ca 0.05 0.13 -0.14 0.00 -1.03 0.00 0.00 54.13 53.13 3gh1 s LEU 78 Cb -0.14 -2.07 -0.04 0.00 0.03 0.00 0.00 46.19 43.97 3gh1 s LEU 78 CO -0.01 0.12 0.34 0.00 0.23 0.00 0.00 176.35 177.02 3gh1 s ALA 79 N 0.71 3.57 -1.27 4.21 0.00 0.12 -0.75 121.76 128.35 3gh1 s ALA 79 Ca 0.07 -0.61 -0.03 0.00 0.00 0.00 0.00 51.96 51.39 3gh1 s ALA 79 Cb -0.12 -2.55 -0.01 0.00 0.00 0.00 0.00 23.12 20.44 3gh1 s ALA 79 CO 0.01 -0.26 0.71 0.09 0.00 0.00 0.00 175.76 176.31 3gh1 n ASN 80 N 4.39 -1.94 -4.78 0.00 3.02 -0.00 -2.44 115.26 113.51 3gh1 n ASN 80 Ca -0.10 -0.85 -0.34 0.00 -0.03 0.00 0.00 54.58 53.26 3gh1 n ASN 80 Cb 0.51 -4.00 0.01 0.00 -0.61 0.00 0.00 39.78 35.69 3gh1 n ASN 80 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3gh1 s PRO 81 N -5.90 3.27 0.54 3.52 0.04 -1.26 -4.43 135.00 130.78 3gh1 s PRO 81 Ca 0.09 1.42 -0.22 0.00 0.04 0.00 0.00 61.00 62.33 3gh1 s PRO 81 Cb -0.02 -2.01 -0.06 0.00 0.04 0.00 0.00 34.50 32.45 3gh1 s PRO 81 CO 0.82 -0.88 1.26 -2.30 0.04 0.00 0.00 177.00 175.94 3gh1 n PRO 82 N -1.70 1.54 0.20 0.56 -0.01 -1.26 -4.88 135.00 129.43 3gh1 n PRO 82 Ca 0.10 0.57 0.07 0.00 -0.01 0.00 0.00 63.50 64.23 3gh1 n PRO 82 Cb 0.52 -2.45 0.32 0.00 -0.01 0.00 0.00 33.50 31.87 3gh1 n PRO 82 CO 0.00 0.00 0.00 1.05 -0.01 0.00 0.00 175.50 176.54 3gh1 h GLU 83 N 1.30 0.00 0.00 -0.52 4.11 -1.92 -3.13 114.58 114.42 3gh1 h GLU 83 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.93 3gh1 h GLU 83 Cb 1.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.57 3gh1 h GLU 83 CO 0.56 0.31 0.00 -2.39 0.07 0.00 0.00 179.01 177.56 3gh1 n HIS 84 N -3.37 0.00 0.87 2.06 1.44 -1.26 -2.47 115.22 112.49 3gh1 n HIS 84 Ca 0.01 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.82 3gh1 n HIS 84 Cb 0.52 -0.35 0.50 0.00 0.12 0.00 0.00 29.99 30.79 3gh1 n HIS 84 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3gh1 n ALA 85 N -1.35 2.06 -2.57 1.59 0.00 -1.18 -4.84 120.51 114.22 3gh1 n ALA 85 Ca 0.08 -0.09 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 3gh1 n ALA 85 Cb 0.18 -1.36 -0.11 0.00 0.00 0.00 0.00 19.45 18.17 3gh1 n ALA 85 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3gh1 s PHE 86 N -2.84 2.82 -0.15 0.00 0.08 -1.03 -0.84 117.98 116.02 3gh1 s PHE 86 Ca 0.15 -0.09 0.02 0.00 0.12 0.00 0.00 56.93 57.13 3gh1 s PHE 86 Cb 0.15 -1.56 0.02 0.00 -0.57 0.00 0.00 43.02 41.05 3gh1 s PHE 86 CO 0.38 0.36 -0.19 0.08 -0.10 0.00 0.00 175.22 175.74 3gh1 s VAL 87 N -1.02 1.91 -1.46 -0.44 1.01 0.63 -4.72 120.40 116.32 3gh1 s VAL 87 Ca 0.17 -0.87 -0.01 0.00 0.00 0.00 0.00 61.98 61.27 3gh1 s VAL 87 Cb -0.11 -1.72 0.01 0.00 0.00 0.00 0.00 36.38 34.56 3gh1 s VAL 87 CO 0.08 0.52 0.32 0.47 0.00 0.00 0.00 175.10 176.49 3gh1 n ASP 88 N 4.34 -0.07 0.00 3.32 8.00 -1.26 -1.46 116.55 129.43 3gh1 n ASP 88 Ca -0.20 -1.08 0.00 0.00 0.71 0.00 0.00 54.79 54.22 3gh1 n ASP 88 Cb 0.51 -2.63 0.00 0.00 -0.02 0.00 0.00 41.12 38.98 3gh1 n ASP 88 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3gh1 n GLY 89 N -2.12 0.41 3.23 0.44 0.00 -1.26 -5.00 105.19 100.87 3gh1 n GLY 89 Ca -0.30 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.47 3gh1 n GLY 89 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gh1 s GLN 90 N -0.62 1.35 0.08 1.61 -1.52 -0.53 -5.06 119.66 114.97 3gh1 s GLN 90 Ca 0.00 -0.87 -0.30 0.00 -1.95 0.00 0.00 55.36 52.24 3gh1 s GLN 90 Cb 0.00 -1.42 -0.05 0.00 -0.22 0.00 0.00 33.01 31.32 3gh1 s GLN 90 CO 0.00 0.37 0.96 0.42 -0.25 0.00 0.00 175.29 176.79 3gh1 s ILE 91 N -0.75 4.59 0.19 1.08 1.01 -1.26 -0.26 121.20 125.79 3gh1 s ILE 91 Ca 0.07 2.06 -0.33 0.00 0.00 0.00 0.00 60.65 62.45 3gh1 s ILE 91 Cb -0.08 -4.32 -0.14 0.00 0.01 0.00 0.00 42.46 37.93 3gh1 s ILE 91 CO 0.01 0.28 1.50 -0.38 0.00 0.00 0.00 174.94 176.36 3gh1 n ILE 92 N 3.04 0.36 -0.33 2.92 5.41 -0.02 -4.82 119.36 125.92 3gh1 n ILE 92 Ca 0.03 -0.09 0.02 0.00 1.00 0.00 0.00 62.75 63.71 3gh1 n ILE 92 Cb 0.50 -1.48 0.16 0.00 -0.71 0.00 0.00 39.64 38.10 3gh1 n ILE 92 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 3gh1 h LYS 93 N 5.22 0.99 -0.86 0.38 1.57 -1.92 -1.44 116.57 120.51 3gh1 h LYS 93 Ca -0.45 -0.06 0.12 0.00 -1.87 0.00 0.00 60.65 58.39 3gh1 h LYS 93 Cb 1.27 -0.22 -0.06 0.00 0.08 0.00 0.00 32.23 33.29 3gh1 h LYS 93 CO 0.83 0.65 0.56 0.78 -0.57 0.00 0.00 179.45 181.70 3gh1 h GLY 94 N 1.02 1.17 0.96 3.86 0.00 -1.90 -0.62 103.07 107.56 3gh1 h GLY 94 Ca 0.40 -0.31 -0.06 0.00 0.00 0.00 0.00 47.33 47.36 3gh1 h GLY 94 CO -0.18 0.14 0.05 -2.22 0.00 0.00 0.00 176.54 174.33 3gh1 h ILE 95 N 0.74 1.25 -0.18 2.60 2.04 -1.56 -0.75 117.51 121.66 3gh1 h ILE 95 Ca 0.41 -0.94 0.02 0.00 1.00 0.00 0.00 64.86 65.35 3gh1 h ILE 95 Cb 0.57 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 3gh1 h ILE 95 CO -0.18 0.33 0.04 1.56 0.00 0.00 0.00 178.15 179.90 3gh1 h GLN 96 N 0.60 0.11 -0.96 2.37 4.20 -0.89 -0.56 115.11 119.98 3gh1 h GLN 96 Ca 0.13 -0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.87 3gh1 h GLN 96 Cb 0.42 -0.02 -0.06 0.00 0.30 0.00 0.00 27.48 28.12 3gh1 h GLN 96 CO 0.01 0.07 0.63 0.93 -0.67 0.00 0.00 178.83 179.80 3gh1 h GLU 97 N 0.11 1.17 -0.71 1.46 5.08 -0.94 -2.55 114.58 118.21 3gh1 h GLU 97 Ca 0.08 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3gh1 h GLU 97 Cb 0.07 -0.26 -0.04 0.00 0.50 0.00 0.00 28.75 29.02 3gh1 h GLU 97 CO -0.10 0.78 0.47 0.45 -1.00 0.00 0.00 179.01 179.60 3gh1 h HIS 98 N 1.21 0.90 -0.92 4.33 3.86 -0.40 -1.65 115.15 122.47 3gh1 h HIS 98 Ca 0.39 0.02 0.05 0.00 -1.16 0.00 0.00 60.37 59.67 3gh1 h HIS 98 Cb 0.01 -0.30 -0.06 0.00 1.06 0.00 0.00 27.41 28.12 3gh1 h HIS 98 CO -0.01 0.57 0.60 -0.07 0.86 0.00 0.00 177.93 179.88 3gh1 h LEU 99 N 0.97 0.95 -0.33 2.43 3.38 -0.69 -1.22 115.31 120.80 3gh1 h LEU 99 Ca 0.26 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.05 3gh1 h LEU 99 Cb -0.11 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 3gh1 h LEU 99 CO -0.06 0.63 -0.84 -0.26 0.09 0.00 0.00 178.44 178.00 3gh1 h PHE 100 N 1.09 0.15 -0.67 1.13 0.04 -1.42 -2.22 116.94 115.04 3gh1 h PHE 100 Ca 0.39 -0.08 -0.04 0.00 2.80 0.00 0.00 57.97 61.03 3gh1 h PHE 100 Cb 0.13 -0.02 -0.03 0.00 2.20 0.00 0.00 35.95 38.23 3gh1 h PHE 100 CO -0.00 0.89 0.27 0.77 -0.60 0.00 0.00 178.31 179.64 3gh1 h SER 101 N 0.06 0.93 -0.09 2.17 0.02 -0.89 -0.16 113.55 115.58 3gh1 h SER 101 Ca -0.03 -0.17 -0.00 0.00 -0.84 0.00 0.00 61.79 60.75 3gh1 h SER 101 Cb 1.47 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 63.76 3gh1 h SER 101 CO 0.12 0.85 0.05 0.58 -1.14 0.00 0.00 176.83 177.29 3gh1 h VAL 102 N 0.96 1.07 -0.12 2.27 2.07 -1.17 -2.11 116.25 119.22 3gh1 h VAL 102 Ca 0.22 -0.20 0.01 0.00 0.82 0.00 0.00 66.70 67.55 3gh1 h VAL 102 Cb 0.21 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 3gh1 h VAL 102 CO -0.02 0.06 0.07 0.25 0.02 0.00 0.00 177.57 177.95 3gh1 h LEU 103 N 0.06 0.11 -0.41 2.57 5.85 -1.30 -1.12 115.31 121.08 3gh1 h LEU 103 Ca 0.03 0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.84 3gh1 h LEU 103 Cb 0.06 -0.02 -0.09 0.00 0.37 0.00 0.00 40.66 40.98 3gh1 h LEU 103 CO -0.01 0.08 -0.19 -0.09 -0.34 0.00 0.00 178.44 177.89 3gh1 h ARG 104 N 0.14 -0.11 0.11 1.25 2.43 -0.93 -1.73 114.38 115.54 3gh1 h ARG 104 Ca 0.05 0.01 -0.27 0.00 -0.81 0.00 0.00 59.98 58.95 3gh1 h ARG 104 Cb -0.00 0.03 0.01 0.00 -0.42 0.00 0.00 29.97 29.59 3gh1 h ARG 104 CO -0.03 -0.07 -1.19 -0.44 -1.51 0.00 0.00 179.97 176.73 3gh1 h ASP 105 N -0.12 0.62 -0.81 -3.80 3.32 -1.20 -1.69 116.42 112.73 3gh1 h ASP 105 Ca 0.20 -0.59 -0.00 0.00 0.02 0.00 0.00 57.03 56.66 3gh1 h ASP 105 Cb 0.42 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.74 3gh1 h ASP 105 CO -0.48 1.42 0.51 0.40 -1.72 0.00 0.00 179.24 179.37 3gh1 h ILE 106 N 0.18 1.22 -0.22 0.35 1.08 -1.08 -2.58 117.51 116.45 3gh1 h ILE 106 Ca -0.15 -0.47 -0.14 0.00 -0.39 0.00 0.00 64.86 63.72 3gh1 h ILE 106 Cb 1.87 0.05 0.00 0.00 -3.07 0.00 0.00 36.82 35.68 3gh1 h ILE 106 CO 0.21 0.23 -0.39 0.58 -0.69 0.00 0.00 178.15 178.09 3gh1 h VAL 107 N 1.12 1.32 0.21 1.67 2.07 -1.22 -2.74 116.25 118.68 3gh1 h VAL 107 Ca 0.30 -1.61 -0.01 0.00 0.82 0.00 0.00 66.70 66.20 3gh1 h VAL 107 Cb -0.07 1.79 -0.00 0.00 -1.52 0.00 0.00 31.29 31.49 3gh1 h VAL 107 CO -0.06 0.50 -0.11 0.22 0.02 0.00 0.00 177.57 178.14 3gh1 h TYR 108 N 0.36 -0.29 -0.80 1.57 3.20 -1.13 -2.85 116.97 117.03 3gh1 h TYR 108 Ca 0.01 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 3gh1 h TYR 108 Cb 0.99 0.10 -0.04 0.00 1.54 0.00 0.00 36.73 39.32 3gh1 h TYR 108 CO 0.08 -0.18 0.42 0.28 -1.64 0.00 0.00 178.16 177.12 3gh1 h VAL 109 N -0.30 1.24 0.00 1.81 2.07 -1.53 -2.22 116.25 117.32 3gh1 h VAL 109 Ca -0.02 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.86 3gh1 h VAL 109 Cb 0.24 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 3gh1 h VAL 109 CO 0.04 0.28 0.00 -3.20 0.02 0.00 0.00 177.57 174.70 3gh1 n ASN 110 N -4.33 2.62 -0.13 0.57 4.05 -1.04 -2.83 115.26 114.17 3gh1 n ASN 110 Ca 0.08 -1.59 0.00 0.00 0.45 0.00 0.00 54.58 53.52 3gh1 n ASN 110 Cb 0.12 -0.53 0.00 0.00 1.23 0.00 0.00 39.78 40.60 3gh1 n ASN 110 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 177.26 175.62 3gh1 n HIS 112 N 1.40 0.00 -2.89 1.20 8.25 -0.84 -5.10 115.22 117.23 3gh1 n HIS 112 Ca 0.00 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.03 3gh1 n HIS 112 Cb 0.29 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.36 3gh1 n HIS 112 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3gh1 s LEU 113 N -0.10 4.70 0.00 2.41 1.43 -1.13 -5.12 118.68 120.88 3gh1 s LEU 113 Ca 0.00 -1.49 0.00 0.00 -1.03 0.00 0.00 54.13 51.61 3gh1 s LEU 113 Cb 0.00 -2.41 0.00 0.00 0.03 0.00 0.00 46.19 43.81 3gh1 s LEU 113 CO 0.00 -1.26 0.00 0.41 0.23 0.00 0.00 176.35 175.73 3gh1 n THR 122 N 5.75 0.00 -0.24 5.49 -1.04 -1.26 -5.24 114.28 117.74 3gh1 n THR 122 Ca 0.09 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 62.14 3gh1 n THR 122 Cb 0.47 0.00 0.13 0.00 -1.82 0.00 0.00 70.33 69.11 3gh1 n THR 122 CO 0.00 0.00 0.00 -1.13 -0.64 0.00 0.00 175.07 173.30 3gh1 h ASN 123 N 0.00 -0.37 -0.22 8.00 -1.24 -2.05 1.61 115.58 121.31 3gh1 h ASN 123 Ca 0.00 0.19 -0.03 0.00 0.71 0.00 0.00 56.30 57.17 3gh1 h ASN 123 Cb 0.00 0.34 -0.01 0.00 0.73 0.00 0.00 38.32 39.38 3gh1 h ASN 123 CO 0.00 -0.17 0.04 0.00 -1.29 0.00 0.00 177.43 176.01 3gh1 h ALA 124 N 1.67 0.29 -0.64 1.57 0.00 -2.00 -0.41 119.26 119.74 3gh1 h ALA 124 Ca 0.38 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.13 3gh1 h ALA 124 Cb 0.65 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3gh1 h ALA 124 CO -0.64 -0.04 0.41 1.15 0.00 0.00 0.00 179.25 180.14 3gh1 h THR 125 N 0.16 1.14 -0.34 0.00 2.02 -1.67 -2.48 112.91 111.74 3gh1 h THR 125 Ca 0.07 -0.29 0.03 0.00 0.77 0.00 0.00 66.41 66.99 3gh1 h THR 125 Cb 0.32 0.23 -0.03 0.00 -1.74 0.00 0.00 68.15 66.92 3gh1 h THR 125 CO 0.00 0.15 0.13 -0.74 0.37 0.00 0.00 175.52 175.44 3gh1 h HIS 126 N 0.84 0.24 -0.35 3.16 6.17 0.27 -0.95 115.15 124.53 3gh1 h HIS 126 Ca 0.24 0.02 -0.07 0.00 0.71 0.00 0.00 60.37 61.27 3gh1 h HIS 126 Cb -0.07 -0.06 -0.01 0.00 2.52 0.00 0.00 27.41 29.79 3gh1 h HIS 126 CO -0.04 0.11 -0.05 0.82 0.71 0.00 0.00 177.93 179.49 3gh1 h ILE 127 N 0.29 1.27 -0.71 6.26 2.04 -0.87 -1.85 117.51 123.94 3gh1 h ILE 127 Ca 0.15 -1.08 -0.05 0.00 1.00 0.00 0.00 64.86 64.88 3gh1 h ILE 127 Cb 0.10 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 3gh1 h ILE 127 CO -0.14 0.35 0.25 0.74 0.00 0.00 0.00 178.15 179.36 3gh1 h THR 128 N 0.44 1.25 -0.32 -0.27 2.02 -1.29 -1.48 112.91 113.27 3gh1 h THR 128 Ca 0.09 -0.84 -0.09 0.00 0.77 0.00 0.00 66.41 66.34 3gh1 h THR 128 Cb 0.53 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 3gh1 h THR 128 CO 0.03 0.33 -0.20 0.78 0.37 0.00 0.00 175.52 176.83 3gh1 h ASN 129 N 1.03 0.58 -0.14 4.18 2.35 -1.07 -1.88 115.58 120.64 3gh1 h ASN 129 Ca 0.23 -0.19 -0.02 0.00 -0.55 0.00 0.00 56.30 55.78 3gh1 h ASN 129 Cb 0.26 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 3gh1 h ASN 129 CO -0.01 0.79 0.02 0.25 -1.65 0.00 0.00 177.43 176.83 3gh1 h LEU 130 N 0.52 0.22 -0.43 1.61 5.85 -1.08 -0.50 115.31 121.50 3gh1 h LEU 130 Ca 0.08 -0.26 0.07 0.00 0.84 0.00 0.00 57.88 58.61 3gh1 h LEU 130 Cb 0.63 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.54 3gh1 h LEU 130 CO 0.04 0.42 0.07 0.58 -0.34 0.00 0.00 178.44 179.22 3gh1 h VAL 131 N 0.00 0.75 -0.61 1.05 2.07 -1.06 0.19 116.25 118.65 3gh1 h VAL 131 Ca 0.04 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 3gh1 h VAL 131 Cb 0.30 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 3gh1 h VAL 131 CO 0.00 0.04 0.30 0.15 0.02 0.00 0.00 177.57 178.08 3gh1 h PHE 132 N 0.20 0.86 -0.57 1.57 3.57 -1.30 -1.95 116.94 119.32 3gh1 h PHE 132 Ca 0.21 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.65 3gh1 h PHE 132 Cb 0.28 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 3gh1 h PHE 132 CO -0.22 0.65 0.27 0.78 -2.23 0.00 0.00 178.31 177.55 3gh1 h GLY 133 N 0.83 0.89 0.96 2.40 0.00 -0.11 -0.12 103.07 107.92 3gh1 h GLY 133 Ca 0.21 -0.45 -0.01 0.00 0.00 0.00 0.00 47.33 47.08 3gh1 h GLY 133 CO -0.03 0.43 0.20 -2.22 0.00 0.00 0.00 176.54 174.92 3gh1 h ILE 134 N 0.78 1.15 -0.62 2.60 2.04 -0.42 -0.35 117.51 122.68 3gh1 h ILE 134 Ca 0.20 -0.39 -0.06 0.00 1.00 0.00 0.00 64.86 65.60 3gh1 h ILE 134 Cb 0.13 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 3gh1 h ILE 134 CO -0.02 0.15 0.14 -0.07 0.00 0.00 0.00 178.15 178.35 3gh1 h LEU 135 N 0.47 0.95 -0.45 1.44 3.38 -1.14 -1.52 115.31 118.45 3gh1 h LEU 135 Ca 0.13 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 3gh1 h LEU 135 Cb 0.07 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 3gh1 h LEU 135 CO -0.02 0.94 0.01 -0.09 0.09 0.00 0.00 178.44 179.37 3gh1 h ARG 136 N 0.92 0.79 -0.15 1.13 2.43 -0.93 -0.81 114.38 117.76 3gh1 h ARG 136 Ca 0.19 -0.25 -0.04 0.00 -0.81 0.00 0.00 59.98 59.07 3gh1 h ARG 136 Cb 0.37 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 3gh1 h ARG 136 CO 0.00 0.85 -0.09 -0.97 -1.51 0.00 0.00 179.97 178.25 3gh1 h ASN 137 N 0.64 0.21 0.48 -3.80 -1.24 -0.84 -1.67 115.58 109.36 3gh1 h ASN 137 Ca 0.13 -0.04 0.00 0.00 0.71 0.00 0.00 56.30 57.10 3gh1 h ASN 137 Cb 0.49 -0.06 0.00 0.00 0.73 0.00 0.00 38.32 39.48 3gh1 h ASN 137 CO 0.02 0.34 0.00 0.00 -1.29 0.00 0.00 177.43 176.50 3gh1 n ALA 138 N -2.49 2.43 -1.19 1.57 0.00 -0.59 -4.89 120.51 115.34 3gh1 n ALA 138 Ca -0.01 -0.14 -0.06 0.00 0.00 0.00 0.00 53.44 53.23 3gh1 n ALA 138 Cb 0.24 -1.46 -0.03 0.00 0.00 0.00 0.00 19.45 18.20 3gh1 n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gh1 n GLY 139 N 1.10 0.87 0.02 0.00 0.00 -0.63 -4.91 105.19 101.64 3gh1 n GLY 139 Ca 0.14 -0.60 0.14 0.00 0.00 0.00 0.00 46.02 45.70 3gh1 n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gh1 n ALA 140 N 1.12 2.39 -3.72 4.61 0.00 -0.34 -4.53 120.51 120.04 3gh1 n ALA 140 Ca -0.06 -0.10 -0.37 0.00 0.00 0.00 0.00 53.44 52.91 3gh1 n ALA 140 Cb 0.24 -1.45 -0.10 0.00 0.00 0.00 0.00 19.45 18.14 3gh1 n ALA 140 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3gh1 s LEU 141 N -3.31 5.28 -0.29 0.00 1.43 -1.24 -4.99 118.68 115.56 3gh1 s LEU 141 Ca 0.13 -2.58 -0.23 0.00 -1.03 0.00 0.00 54.13 50.42 3gh1 s LEU 141 Cb 0.18 -1.86 -0.00 0.00 0.03 0.00 0.00 46.19 44.53 3gh1 s LEU 141 CO 0.55 -0.44 0.76 -0.63 0.23 0.00 0.00 176.35 176.83 3gh1 s ILE 142 N 0.34 4.84 0.16 -0.59 1.01 -1.26 -4.95 121.20 120.75 3gh1 s ILE 142 Ca 0.14 1.22 -0.10 0.00 0.00 0.00 0.00 60.65 61.91 3gh1 s ILE 142 Cb -0.21 -4.10 0.02 0.00 0.01 0.00 0.00 42.46 38.18 3gh1 s ILE 142 CO -0.04 -0.17 1.58 -0.65 0.00 0.00 0.00 174.94 175.66 3gh1 h PRO 143 N 8.01 1.01 -0.08 2.79 0.11 -1.98 -3.03 132.00 138.84 3gh1 h PRO 143 Ca -0.25 -0.39 0.00 0.00 0.11 0.00 0.00 66.00 65.47 3gh1 h PRO 143 Cb 1.10 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3gh1 h PRO 143 CO 0.86 1.07 0.00 0.41 -0.21 0.00 0.00 178.00 180.13 3gh1 n GLY 144 N -0.21 -0.21 3.76 -0.55 0.00 -1.26 -4.83 105.19 101.88 3gh1 n GLY 144 Ca 0.01 -0.34 -0.40 0.00 0.00 0.00 0.00 46.02 45.29 3gh1 n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gh1 s ALA 145 N -1.91 3.38 0.48 4.61 0.00 -1.15 -5.03 121.76 122.15 3gh1 s ALA 145 Ca 0.35 0.38 -0.21 0.00 0.00 0.00 0.00 51.96 52.47 3gh1 s ALA 145 Cb 0.18 -3.04 -0.08 0.00 0.00 0.00 0.00 23.12 20.19 3gh1 s ALA 145 CO 0.28 0.15 1.10 -0.08 0.00 0.00 0.00 175.76 177.21 3gh1 s THR 146 N -0.55 3.44 0.13 0.00 -1.32 -1.26 -4.75 115.64 111.32 3gh1 s THR 146 Ca 0.39 0.97 -0.34 0.00 -1.21 0.00 0.00 61.69 61.50 3gh1 s THR 146 Cb -0.22 -3.43 -0.14 0.00 -1.51 0.00 0.00 72.50 67.20 3gh1 s THR 146 CO 0.26 -0.13 1.62 -2.65 -2.21 0.00 0.00 174.62 171.51 3gh1 n PRO 147 N -0.82 2.16 -0.42 7.08 -0.02 -1.26 -4.83 135.00 136.89 3gh1 n PRO 147 Ca 0.09 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 3gh1 n PRO 147 Cb 0.51 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 3gh1 n PRO 147 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 3gh1 n ASN 148 N 3.88 0.00 -4.66 2.55 6.94 -1.26 -5.01 115.26 117.70 3gh1 n ASN 148 Ca 0.18 -0.92 -0.36 0.00 -0.02 0.00 0.00 54.58 53.45 3gh1 n ASN 148 Cb 0.29 0.00 -0.09 0.00 -2.36 0.00 0.00 39.78 37.61 3gh1 n ASN 148 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3gh1 s LEU 149 N 0.00 4.09 -0.20 -4.53 2.96 -1.26 -0.54 118.68 119.21 3gh1 s LEU 149 Ca 0.00 0.11 -0.03 0.00 -0.22 0.00 0.00 54.13 53.99 3gh1 s LEU 149 Cb 0.00 -2.09 -0.01 0.00 0.50 0.00 0.00 46.19 44.58 3gh1 s LEU 149 CO 0.00 0.08 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.36 3gh1 s VAL 150 N 0.99 3.40 0.01 1.68 1.01 0.03 -1.19 120.40 126.33 3gh1 s VAL 150 Ca 0.07 -0.50 -0.28 0.00 0.00 0.00 0.00 61.98 61.28 3gh1 s VAL 150 Cb -0.13 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.68 3gh1 s VAL 150 CO 0.04 0.45 0.90 -0.69 0.00 0.00 0.00 175.10 175.79 3gh1 s VAL 151 N 1.17 4.82 -0.15 2.92 1.01 0.30 -1.47 120.40 128.98 3gh1 s VAL 151 Ca 0.02 1.90 0.00 0.00 0.00 0.00 0.00 61.98 63.90 3gh1 s VAL 151 Cb -0.14 -4.24 -0.00 0.00 0.00 0.00 0.00 36.38 31.99 3gh1 s VAL 151 CO -0.01 0.23 -0.15 0.00 0.00 0.00 0.00 175.10 175.18 3gh1 s TRP 153 N 0.77 1.93 0.00 0.00 0.51 0.08 -4.38 118.94 117.85 3gh1 s TRP 153 Ca -0.06 -0.45 0.00 0.00 -2.12 0.00 0.00 56.10 53.48 3gh1 s TRP 153 Cb -0.15 -0.94 0.00 0.00 -0.81 0.00 0.00 33.47 31.56 3gh1 s TRP 153 CO 0.01 0.39 0.00 0.41 -0.51 0.00 0.00 176.95 177.25 3gh1 n GLY 154 N 0.17 2.24 3.77 0.98 0.00 -1.26 -1.18 105.19 109.91 3gh1 n GLY 154 Ca -0.12 -0.82 -0.38 0.00 0.00 0.00 0.00 46.02 44.70 3gh1 n GLY 154 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3gh1 s GLY 155 N 0.00 2.87 0.37 -0.02 0.00 -0.56 -4.64 107.32 105.34 3gh1 s GLY 155 Ca 0.00 1.08 0.20 0.00 0.00 0.00 0.00 44.72 46.00 3gh1 s GLY 155 CO 0.00 1.60 1.63 1.12 0.00 0.00 0.00 173.10 177.45 3gh1 h HIS 156 N 2.40 0.00 -3.49 1.90 2.07 -1.89 -0.77 115.15 115.37 3gh1 h HIS 156 Ca -0.49 0.00 -0.64 0.00 -2.85 0.00 0.00 60.37 56.39 3gh1 h HIS 156 Cb 1.25 0.00 -0.40 0.00 2.57 0.00 0.00 27.41 30.83 3gh1 h HIS 156 CO 0.53 0.31 -0.72 0.45 -3.07 0.00 0.00 177.93 175.43 3gh1 s SER 157 N -6.31 4.49 0.06 3.10 0.15 -1.26 -3.06 113.70 110.87 3gh1 s SER 157 Ca 0.03 -2.10 0.03 0.00 0.70 0.00 0.00 55.95 54.60 3gh1 s SER 157 Cb 0.08 -1.40 -0.03 0.00 -1.71 0.00 0.00 66.02 62.97 3gh1 s SER 157 CO 0.69 -0.37 -0.08 0.27 1.20 0.00 0.00 173.24 174.94 3gh1 s ILE 158 N 0.98 0.65 1.01 6.45 -4.36 -1.26 -4.38 121.20 120.28 3gh1 s ILE 158 Ca 0.11 -1.27 -0.15 0.00 -0.26 0.00 0.00 60.65 59.08 3gh1 s ILE 158 Cb -0.19 -0.87 0.19 0.00 1.25 0.00 0.00 42.46 42.84 3gh1 s ILE 158 CO -0.12 -0.45 1.16 0.54 0.24 0.00 0.00 174.94 176.31 3gh1 s ASN 159 N -1.88 2.67 0.26 4.36 2.20 -1.26 -4.79 114.94 116.50 3gh1 s ASN 159 Ca -0.05 0.77 -0.05 0.00 -0.94 0.00 0.00 52.86 52.60 3gh1 s ASN 159 Cb -0.07 -1.18 0.30 0.00 -2.00 0.00 0.00 41.25 38.30 3gh1 s ASN 159 CO -0.00 -3.05 1.93 -0.33 -2.94 0.00 0.00 177.10 172.71 3gh1 h GLU 160 N -1.85 1.26 -0.15 3.55 4.39 -2.01 -0.99 114.58 118.79 3gh1 h GLU 160 Ca -0.48 -0.08 0.01 0.00 0.34 0.00 0.00 59.36 59.14 3gh1 h GLU 160 Cb 1.31 -0.28 -0.01 0.00 -0.10 0.00 0.00 28.75 29.66 3gh1 h GLU 160 CO 0.50 0.84 0.07 0.28 -1.16 0.00 0.00 179.01 179.54 3gh1 h VAL 161 N 1.30 0.99 -0.92 3.13 2.07 -1.99 -0.41 116.25 120.41 3gh1 h VAL 161 Ca 0.35 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.82 3gh1 h VAL 161 Cb -0.14 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.42 3gh1 h VAL 161 CO -0.07 0.03 0.57 -0.33 0.02 0.00 0.00 177.57 177.79 3gh1 h GLU 162 N 0.15 1.24 -0.24 1.57 5.08 -1.92 -1.44 114.58 119.02 3gh1 h GLU 162 Ca 0.06 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 3gh1 h GLU 162 Cb 0.02 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 28.99 3gh1 h GLU 162 CO -0.05 0.85 0.01 -0.92 -1.00 0.00 0.00 179.01 177.91 3gh1 h TYR 163 N 1.26 0.45 -0.55 4.33 3.20 -0.91 -1.87 116.97 122.88 3gh1 h TYR 163 Ca 0.33 -0.07 -0.04 0.00 3.14 0.00 0.00 58.73 62.09 3gh1 h TYR 163 Cb -0.08 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.04 3gh1 h TYR 163 CO 0.00 0.58 0.18 1.96 -1.64 0.00 0.00 178.16 179.23 3gh1 h GLN 164 N 0.20 0.82 -0.50 1.82 1.08 -0.98 -1.42 115.11 116.12 3gh1 h GLN 164 Ca 0.07 -0.14 0.02 0.00 -1.45 0.00 0.00 58.65 57.15 3gh1 h GLN 164 Cb 0.39 -0.14 -0.03 0.00 -0.05 0.00 0.00 27.48 27.65 3gh1 h GLN 164 CO 0.01 0.70 0.30 -0.92 -0.95 0.00 0.00 178.83 177.97 3gh1 h TYR 165 N 0.80 0.55 -0.34 2.96 3.20 -1.02 -0.84 116.97 122.28 3gh1 h TYR 165 Ca 0.18 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.07 3gh1 h TYR 165 Cb 0.22 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.30 3gh1 h TYR 165 CO 0.01 0.32 0.21 1.79 -1.64 0.00 0.00 178.16 178.85 3gh1 h THR 166 N 0.59 1.10 -0.22 1.81 1.35 -0.44 -0.72 112.91 116.37 3gh1 h THR 166 Ca 0.20 -0.21 -0.11 0.00 -0.55 0.00 0.00 66.41 65.74 3gh1 h THR 166 Cb 0.02 0.62 -0.00 0.00 -1.73 0.00 0.00 68.15 67.06 3gh1 h THR 166 CO -0.09 0.10 -0.30 -0.09 -0.25 0.00 0.00 175.52 174.89 3gh1 h ARG 167 N 0.46 0.60 -0.50 4.72 2.43 -0.89 -0.91 114.38 120.29 3gh1 h ARG 167 Ca 0.12 -0.34 0.01 0.00 -0.81 0.00 0.00 59.98 58.96 3gh1 h ARG 167 Cb -0.02 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.53 3gh1 h ARG 167 CO -0.02 0.95 0.32 0.93 -1.51 0.00 0.00 179.97 180.64 3gh1 h GLU 168 N 0.29 0.64 -0.48 0.20 5.08 -0.82 -1.47 114.58 118.02 3gh1 h GLU 168 Ca 0.03 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.39 3gh1 h GLU 168 Cb 0.88 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.94 3gh1 h GLU 168 CO 0.07 0.42 0.24 0.28 -1.00 0.00 0.00 179.01 179.02 3gh1 h VAL 169 N 0.66 0.95 -0.97 3.13 2.07 -0.98 -1.93 116.25 119.18 3gh1 h VAL 169 Ca 0.19 -0.16 0.01 0.00 0.82 0.00 0.00 66.70 67.55 3gh1 h VAL 169 Cb -0.06 0.44 -0.05 0.00 -1.52 0.00 0.00 31.29 30.11 3gh1 h VAL 169 CO -0.05 0.09 0.63 1.23 0.02 0.00 0.00 177.57 179.49 3gh1 h GLY 170 N 0.47 1.37 0.97 2.17 0.00 -0.55 -1.19 103.07 106.32 3gh1 h GLY 170 Ca 0.21 -0.52 0.00 0.00 0.00 0.00 0.00 47.33 47.03 3gh1 h GLY 170 CO -0.15 0.51 0.04 0.84 0.00 0.00 0.00 176.54 177.77 3gh1 h HIS 171 N 1.31 0.08 -1.01 5.60 6.17 -1.08 0.13 115.15 126.36 3gh1 h HIS 171 Ca 0.35 0.00 0.06 0.00 0.71 0.00 0.00 60.37 61.49 3gh1 h HIS 171 Cb -0.14 -0.02 -0.07 0.00 2.52 0.00 0.00 27.41 29.70 3gh1 h HIS 171 CO 0.00 0.05 0.65 0.93 0.71 0.00 0.00 177.93 180.27 3gh1 h GLU 172 N 0.09 1.17 -0.47 5.26 4.39 -0.74 -0.15 114.58 124.14 3gh1 h GLU 172 Ca 0.03 -0.07 -0.03 0.00 0.34 0.00 0.00 59.36 59.63 3gh1 h GLU 172 Cb 0.00 -0.26 -0.02 0.00 -0.10 0.00 0.00 28.75 28.37 3gh1 h GLU 172 CO -0.02 0.77 0.16 -0.07 -1.16 0.00 0.00 179.01 178.70 3gh1 h LEU 173 N 1.21 0.66 -0.35 1.33 3.38 -0.94 -2.47 115.31 118.14 3gh1 h LEU 173 Ca 0.43 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 58.22 3gh1 h LEU 173 Cb 0.12 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 3gh1 h LEU 173 CO -0.16 0.68 0.21 1.23 0.09 0.00 0.00 178.44 180.48 3gh1 h GLY 174 N 0.61 0.48 2.00 0.83 0.00 -0.29 -0.89 103.07 105.82 3gh1 h GLY 174 Ca 0.15 -0.16 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3gh1 h GLY 174 CO -0.01 0.14 -0.03 1.41 0.00 0.00 0.00 176.54 178.06 3gh1 h LEU 175 N 0.43 0.00 -2.21 3.11 3.38 -0.94 -1.08 115.31 118.00 3gh1 h LEU 175 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 3gh1 h LEU 175 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 3gh1 h LEU 175 CO -0.06 0.03 0.00 0.54 0.09 0.00 0.00 178.44 179.04 3gh1 n ARG 176 N -4.04 2.72 -3.72 1.13 1.74 -0.41 -4.93 116.66 109.15 3gh1 n ARG 176 Ca -0.03 -1.99 -0.27 0.00 -0.77 0.00 0.00 57.85 54.79 3gh1 n ARG 176 Cb 0.11 -1.62 0.06 0.00 -1.02 0.00 0.00 32.46 29.99 3gh1 n ARG 176 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3gh1 n GLU 177 N 0.83 -6.89 -4.02 5.56 1.02 -0.41 -4.97 120.64 111.77 3gh1 n GLU 177 Ca 0.18 0.73 -0.31 0.00 -0.02 0.00 0.00 57.16 57.74 3gh1 n GLU 177 Cb 0.60 -5.72 -0.06 0.00 -0.02 0.00 0.00 31.44 26.24 3gh1 n GLU 177 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3gh1 s LEU 178 N -7.29 4.01 0.34 -4.62 1.43 -0.75 -4.94 118.68 106.86 3gh1 s LEU 178 Ca 0.62 0.13 0.04 0.00 -1.03 0.00 0.00 54.13 53.90 3gh1 s LEU 178 Cb -0.29 -2.56 -0.01 0.00 0.03 0.00 0.00 46.19 43.36 3gh1 s LEU 178 CO 0.76 0.21 0.50 0.20 0.23 0.00 0.00 176.35 178.25 3gh1 s ASN 179 N -2.21 6.03 -0.05 2.29 0.01 0.30 -4.43 114.94 116.89 3gh1 s ASN 179 Ca 0.29 0.01 0.05 0.00 -0.71 0.00 0.00 52.86 52.51 3gh1 s ASN 179 Cb -0.12 -1.48 -0.01 0.00 0.41 0.00 0.00 41.25 40.05 3gh1 s ASN 179 CO 0.21 -0.41 -0.22 -0.63 -1.51 0.00 0.00 177.10 174.54 3gh1 s ILE 180 N -2.23 1.78 -0.08 0.60 1.01 -0.83 -0.79 121.20 120.66 3gh1 s ILE 180 Ca 0.43 -0.92 0.02 0.00 0.00 0.00 0.00 60.65 60.19 3gh1 s ILE 180 Cb -0.10 -1.51 0.01 0.00 0.01 0.00 0.00 42.46 40.87 3gh1 s ILE 180 CO 0.33 0.50 -0.13 0.00 0.00 0.00 0.00 174.94 175.64 3gh1 n THR 182 N 4.00 0.00 -0.40 0.00 5.66 0.79 -0.76 114.28 123.56 3gh1 n THR 182 Ca -0.21 -1.34 0.00 0.00 -3.05 0.00 0.00 64.05 59.45 3gh1 n THR 182 Cb 0.51 0.87 0.00 0.00 -1.55 0.00 0.00 70.33 70.17 3gh1 n THR 182 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3gh1 n GLY 183 N -0.46 -0.10 3.69 1.09 0.00 -1.26 -1.07 105.19 107.07 3gh1 n GLY 183 Ca -0.01 -1.71 -0.30 0.00 0.00 0.00 0.00 46.02 44.00 3gh1 n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gh1 n GLY 185 N -1.12 -1.58 0.56 0.00 0.00 -0.88 -4.72 105.19 97.45 3gh1 n GLY 185 Ca -0.13 -2.07 -0.04 0.00 0.00 0.00 0.00 46.02 43.78 3gh1 n GLY 185 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3gh1 n PRO 186 N 0.00 0.07 0.00 1.61 -0.04 -1.26 -3.77 135.00 131.61 3gh1 n PRO 186 Ca 0.00 -0.34 0.00 0.00 -0.04 0.00 0.00 63.50 63.12 3gh1 n PRO 186 Cb 0.00 -0.16 0.00 0.00 -0.04 0.00 0.00 33.50 33.30 3gh1 n PRO 186 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3gh1 n GLY 187 N 3.79 2.25 2.35 0.55 0.00 -1.17 -4.20 105.19 108.76 3gh1 n GLY 187 Ca 0.02 -0.39 -0.09 0.00 0.00 0.00 0.00 46.02 45.57 3gh1 n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gh1 n ALA 188 N 10.64 3.69 0.00 4.61 0.00 -0.30 -2.24 120.51 136.91 3gh1 n ALA 188 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 53.44 52.39 3gh1 n ALA 188 Cb 0.00 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.02 3gh1 n ALA 188 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3gh1 n GLU 190 N 3.11 0.00 0.13 0.00 2.13 -1.25 -4.31 120.64 120.46 3gh1 n GLU 190 Ca 0.24 0.00 -0.14 0.00 0.66 0.00 0.00 57.16 57.93 3gh1 n GLU 190 Cb 0.37 0.00 -0.08 0.00 0.27 0.00 0.00 31.44 32.00 3gh1 n GLU 190 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 3gh1 h GLY 191 N 0.00 -0.30 -2.03 8.31 0.00 -1.77 -3.03 103.07 104.25 3gh1 h GLY 191 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.44 3gh1 h GLY 191 CO 0.00 -0.11 0.00 -1.05 0.00 0.00 0.00 176.54 175.38 3gh1 n PRO 192 N -5.16 0.00 0.00 4.80 -0.02 -1.23 -1.84 135.00 131.55 3gh1 n PRO 192 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 3gh1 n PRO 192 Cb 0.18 -1.32 0.00 0.00 -0.02 0.00 0.00 33.50 32.33 3gh1 n PRO 192 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3gh1 n LYS 194 N 0.88 0.00 -0.10 -0.52 5.02 -1.15 -0.06 118.16 122.24 3gh1 n LYS 194 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.17 3gh1 n LYS 194 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 34.97 3gh1 n LYS 194 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 3gh1 h GLY 195 N 0.00 0.73 2.00 0.72 0.00 -1.53 -3.13 103.07 101.86 3gh1 h GLY 195 Ca 0.00 -0.70 -0.09 0.00 0.00 0.00 0.00 47.33 46.54 3gh1 h GLY 195 CO 0.00 0.63 -0.45 0.00 0.00 0.00 0.00 176.54 176.72 3gh1 h ALA 196 N 0.74 1.13 -0.90 3.60 0.00 -0.42 -1.88 119.26 121.53 3gh1 h ALA 196 Ca 0.06 -0.41 0.06 0.00 0.00 0.00 0.00 54.91 54.63 3gh1 h ALA 196 Cb 0.75 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.40 3gh1 h ALA 196 CO 0.06 0.56 0.57 0.00 0.00 0.00 0.00 179.25 180.43 3gh1 h ALA 197 N 1.55 1.25 0.05 0.00 0.00 -1.79 0.39 119.26 120.71 3gh1 h ALA 197 Ca -0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3gh1 h ALA 197 Cb 0.86 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3gh1 h ALA 197 CO 0.06 0.32 -0.02 0.28 0.00 0.00 0.00 179.25 179.89 3gh1 h VAL 198 N 1.03 1.26 -0.34 0.00 2.07 -1.54 -2.33 116.25 116.40 3gh1 h VAL 198 Ca 0.40 -1.08 0.01 0.00 0.82 0.00 0.00 66.70 66.84 3gh1 h VAL 198 Cb 0.18 1.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.90 3gh1 h VAL 198 CO -0.18 0.27 0.21 1.23 0.02 0.00 0.00 177.57 179.12 3gh1 h GLY 199 N -0.55 0.48 1.25 2.17 0.00 -0.77 -2.13 103.07 103.51 3gh1 h GLY 199 Ca -0.01 -0.16 -0.07 0.00 0.00 0.00 0.00 47.33 47.09 3gh1 h GLY 199 CO 0.01 0.15 0.09 0.45 0.00 0.00 0.00 176.54 177.24 3gh1 h HIS 200 N 0.43 0.98 -0.64 5.60 3.86 -0.34 -2.22 115.15 122.82 3gh1 h HIS 200 Ca 0.13 -0.12 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 3gh1 h HIS 200 Cb -0.02 -0.27 -0.03 0.00 1.06 0.00 0.00 27.41 28.14 3gh1 h HIS 200 CO -0.06 0.84 0.32 0.00 0.86 0.00 0.00 177.93 179.88 3gh1 h ALA 201 N 1.22 1.36 -0.18 2.45 0.00 -0.97 0.16 119.26 123.30 3gh1 h ALA 201 Ca 0.18 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 3gh1 h ALA 201 Cb 0.39 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3gh1 h ALA 201 CO 0.01 0.51 -0.34 0.87 0.00 0.00 0.00 179.25 180.30 3gh1 h LYS 202 N 0.90 0.36 -0.12 0.00 1.57 -1.08 -2.68 116.57 115.53 3gh1 h LYS 202 Ca 0.22 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 3gh1 h LYS 202 Cb 0.07 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.37 3gh1 h LYS 202 CO -0.03 0.66 0.00 0.94 -0.57 0.00 0.00 179.45 180.45 3gh1 n GLN 203 N -4.07 1.80 -3.09 3.15 -0.06 -0.87 -4.96 117.38 109.29 3gh1 n GLN 203 Ca -0.01 -1.19 -0.22 0.00 -2.00 0.00 0.00 57.00 53.57 3gh1 n GLN 203 Cb 0.45 -1.44 0.02 0.00 -4.06 0.00 0.00 30.24 25.21 3gh1 n GLN 203 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 3gh1 n ARG 204 N 0.42 -4.45 -2.93 3.69 5.12 -0.12 -4.91 116.66 113.47 3gh1 n ARG 204 Ca 0.17 0.80 -0.44 0.00 -1.93 0.00 0.00 57.85 56.45 3gh1 n ARG 204 Cb 0.38 -5.62 -0.00 0.00 -1.16 0.00 0.00 32.46 26.06 3gh1 n ARG 204 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 3gh1 s TYR 205 N -3.11 3.47 0.08 -1.55 5.04 0.36 -4.77 117.35 116.88 3gh1 s TYR 205 Ca 0.32 -2.12 0.27 0.00 -2.44 0.00 0.00 57.07 53.10 3gh1 s TYR 205 Cb -0.15 -4.33 1.00 0.00 0.35 0.00 0.00 41.96 38.83 3gh1 s TYR 205 CO 0.39 -1.41 1.85 0.66 -1.34 0.00 0.00 175.55 175.70 3gh1 h SER 206 N 7.18 0.00 -0.07 4.32 4.64 -1.91 -3.01 113.55 124.70 3gh1 h SER 206 Ca 0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 3gh1 h SER 206 Cb 0.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 3gh1 h SER 206 CO 1.25 0.15 0.00 -1.84 -0.87 0.00 0.00 176.83 175.52 3gh1 n GLU 207 N -3.28 1.44 -1.57 4.77 0.00 -1.26 -4.96 120.64 115.78 3gh1 n GLU 207 Ca 0.01 -0.37 -0.40 0.00 0.00 0.00 0.00 57.16 56.40 3gh1 n GLU 207 Cb 0.41 -1.55 0.02 0.00 0.00 0.00 0.00 31.44 30.32 3gh1 n GLU 207 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.13 179.61 3gh1 n TYR 208 N 0.05 0.62 -4.23 -1.84 0.18 -1.14 -5.01 117.16 105.79 3gh1 n TYR 208 Ca 0.03 0.53 -0.26 0.00 1.88 0.00 0.00 57.90 60.08 3gh1 n TYR 208 Cb 0.34 -2.14 -0.17 0.00 -0.38 0.00 0.00 39.34 36.99 3gh1 n TYR 208 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 3gh1 s ARG 209 N -2.10 1.60 -0.34 -3.48 0.52 -1.26 -5.03 118.95 108.86 3gh1 s ARG 209 Ca 0.66 -0.33 0.04 0.00 -0.52 0.00 0.00 55.73 55.58 3gh1 s ARG 209 Cb -0.52 -1.49 0.10 0.00 0.52 0.00 0.00 34.95 33.56 3gh1 s ARG 209 CO 0.55 -0.12 0.06 0.71 0.02 0.00 0.00 175.30 176.51 3gh1 s TYR 210 N 1.19 3.62 -0.21 -0.53 2.02 -1.26 -1.96 117.35 120.22 3gh1 s TYR 210 Ca -0.05 -2.93 -0.14 0.00 -0.37 0.00 0.00 57.07 53.58 3gh1 s TYR 210 Cb -0.14 -2.85 -0.04 0.00 -0.40 0.00 0.00 41.96 38.53 3gh1 s TYR 210 CO -0.03 -0.94 0.33 -0.51 -1.57 0.00 0.00 175.55 172.83 3gh1 s LEU 211 N 0.91 4.15 -0.17 -1.29 1.02 0.40 -1.71 118.68 121.99 3gh1 s LEU 211 Ca 0.11 0.41 0.00 0.00 0.02 0.00 0.00 54.13 54.67 3gh1 s LEU 211 Cb -0.19 -2.40 0.01 0.00 0.02 0.00 0.00 46.19 43.63 3gh1 s LEU 211 CO -0.09 -0.02 -0.16 -0.83 0.02 0.00 0.00 176.35 175.27 3gh1 s GLY 212 N 0.99 1.45 -0.09 -3.19 0.00 -0.58 -0.15 107.32 105.75 3gh1 s GLY 212 Ca 0.16 -1.13 -0.01 0.00 0.00 0.00 0.00 44.72 43.74 3gh1 s GLY 212 CO 0.07 0.16 -0.05 1.08 0.00 0.00 0.00 173.10 174.35 3gh1 s LEU 213 N 1.07 3.24 0.35 0.66 1.43 -0.24 -1.60 118.68 123.59 3gh1 s LEU 213 Ca -0.01 -0.02 -0.04 0.00 -1.03 0.00 0.00 54.13 53.03 3gh1 s LEU 213 Cb -0.14 -1.73 0.01 0.00 0.03 0.00 0.00 46.19 44.36 3gh1 s LEU 213 CO -0.05 0.32 0.52 0.28 0.23 0.00 0.00 176.35 177.65 3gh1 s THR 214 N -0.57 0.00 0.06 5.49 -1.32 -0.10 -3.74 115.64 115.46 3gh1 s THR 214 Ca 0.09 -1.52 -0.07 0.00 -1.21 0.00 0.00 61.69 58.98 3gh1 s THR 214 Cb -0.12 -2.68 -0.01 0.00 -1.51 0.00 0.00 72.50 68.18 3gh1 s THR 214 CO 0.02 0.00 0.15 -1.83 -2.21 0.00 0.00 174.62 170.75 3gh1 s GLU 215 N -2.92 0.74 0.47 7.08 4.04 -1.26 -4.35 118.70 122.49 3gh1 s GLU 215 Ca 0.29 -0.87 0.17 0.00 0.04 0.00 0.00 54.97 54.59 3gh1 s GLU 215 Cb -0.01 0.29 1.15 0.00 0.02 0.00 0.00 34.13 35.58 3gh1 s GLU 215 CO 0.19 -0.21 2.01 -1.35 -1.84 0.00 0.00 175.26 174.06 3gh1 h PRO 216 N 3.12 0.25 -0.00 -4.83 0.11 -1.96 -2.00 132.00 126.69 3gh1 h PRO 216 Ca -0.33 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.76 3gh1 h PRO 216 Cb 1.19 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3gh1 h PRO 216 CO 0.54 0.17 -0.23 -1.13 -0.21 0.00 0.00 178.00 177.14 3gh1 n SER 217 N -4.46 0.41 -0.00 -2.05 3.41 -1.26 -3.65 113.62 106.02 3gh1 n SER 217 Ca 0.08 -0.20 0.03 0.00 -0.26 0.00 0.00 58.87 58.52 3gh1 n SER 217 Cb 0.39 -0.05 -0.04 0.00 -0.26 0.00 0.00 64.21 64.25 3gh1 n SER 217 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gh1 n ILE 218 N -1.27 0.00 0.14 -1.33 0.13 -0.81 -4.61 119.36 111.61 3gh1 n ILE 218 Ca 0.09 -0.33 0.01 0.00 -1.10 0.00 0.00 62.75 61.42 3gh1 n ILE 218 Cb 0.32 0.97 0.31 0.00 -0.84 0.00 0.00 39.64 40.41 3gh1 n ILE 218 CO 0.00 0.00 0.00 -0.29 2.80 0.00 0.00 176.55 179.06 3gh1 h ILE 219 N 0.00 1.27 -0.42 9.51 2.10 -1.46 -1.25 117.51 127.26 3gh1 h ILE 219 Ca 0.00 -1.30 -0.05 0.00 1.08 0.00 0.00 64.86 64.59 3gh1 h ILE 219 Cb 0.17 1.62 -0.02 0.00 -1.09 0.00 0.00 36.82 37.50 3gh1 h ILE 219 CO 0.00 0.38 0.08 0.00 -1.08 0.00 0.00 178.15 177.53 3gh1 h ALA 220 N 1.54 0.55 -0.16 0.18 0.00 -1.86 -2.07 119.26 117.44 3gh1 h ALA 220 Ca 0.01 -0.21 -0.11 0.00 0.00 0.00 0.00 54.91 54.60 3gh1 h ALA 220 Cb 0.67 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3gh1 h ALA 220 CO 0.05 0.26 -0.37 0.00 0.00 0.00 0.00 179.25 179.19 3gh1 h ALA 221 N 0.94 1.06 -2.23 0.00 0.00 -1.71 -3.37 119.26 113.95 3gh1 h ALA 221 Ca 0.13 -0.40 -0.58 0.00 0.00 0.00 0.00 54.91 54.06 3gh1 h ALA 221 Cb 0.36 -0.10 -0.40 0.00 0.00 0.00 0.00 17.79 17.66 3gh1 h ALA 221 CO 0.01 0.59 -0.93 0.39 0.00 0.00 0.00 179.25 179.30 3gh1 n GLU 222 N -4.05 1.00 -2.34 0.00 1.02 -0.53 -4.88 120.64 110.86 3gh1 n GLU 222 Ca -0.01 -3.58 -0.40 0.00 -0.02 0.00 0.00 57.16 53.14 3gh1 n GLU 222 Cb 0.47 -1.62 -0.03 0.00 -0.02 0.00 0.00 31.44 30.24 3gh1 n GLU 222 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3gh1 s PRO 223 N -1.11 4.47 0.38 3.49 0.04 -0.79 -3.40 135.00 138.07 3gh1 s PRO 223 Ca 0.34 1.93 -0.26 0.00 0.04 0.00 0.00 61.00 63.05 3gh1 s PRO 223 Cb 0.11 -3.07 -0.09 0.00 0.04 0.00 0.00 34.50 31.49 3gh1 s PRO 223 CO -0.12 0.01 1.15 -1.25 0.04 0.00 0.00 177.00 176.83 3gh1 s PRO 224 N -1.69 4.18 0.38 0.56 0.04 -1.26 -2.07 135.00 135.15 3gh1 s PRO 224 Ca 0.48 1.81 -0.25 0.00 0.04 0.00 0.00 61.00 63.08 3gh1 s PRO 224 Cb -0.34 -2.76 -0.09 0.00 0.04 0.00 0.00 34.50 31.35 3gh1 s PRO 224 CO 0.44 -0.20 1.05 1.21 0.04 0.00 0.00 177.00 179.54 3gh1 s ASN 225 N -1.11 6.83 0.63 6.66 3.84 -1.26 -4.75 114.94 125.78 3gh1 s ASN 225 Ca 0.55 2.06 0.34 0.00 0.21 0.00 0.00 52.86 56.01 3gh1 s ASN 225 Cb -0.30 -2.59 1.88 0.00 -0.55 0.00 0.00 41.25 39.69 3gh1 s ASN 225 CO 0.38 -0.44 2.14 -0.65 -2.79 0.00 0.00 177.10 175.74 3gh1 h PRO 226 N 2.66 0.00 0.00 0.43 0.11 -1.93 -2.31 132.00 130.96 3gh1 h PRO 226 Ca -0.48 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 3gh1 h PRO 226 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 3gh1 h PRO 226 CO 0.63 0.00 -0.05 0.97 -0.21 0.00 0.00 178.00 179.34 3gh1 h ILE 227 N 0.00 0.12 -2.23 4.15 2.10 -1.94 -3.42 117.51 116.29 3gh1 h ILE 227 Ca 0.04 -0.72 -0.57 0.00 1.08 0.00 0.00 64.86 64.68 3gh1 h ILE 227 Cb 0.38 1.65 0.03 0.00 -1.09 0.00 0.00 36.82 37.78 3gh1 h ILE 227 CO -0.00 0.05 1.10 0.52 -1.08 0.00 0.00 178.15 178.73 3gh1 n VAL 228 N -3.15 0.51 0.81 2.19 0.31 -0.87 -4.88 118.33 113.25 3gh1 n VAL 228 Ca 0.01 -0.09 0.09 0.00 -0.01 0.00 0.00 64.34 64.34 3gh1 n VAL 228 Cb 0.37 -1.99 -0.01 0.00 -0.91 0.00 0.00 33.84 31.30 3gh1 n VAL 228 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 3gh1 n ASN 229 N 6.22 1.73 -3.63 4.52 6.94 -0.70 -4.68 115.26 125.66 3gh1 n ASN 229 Ca 0.20 -1.37 -0.29 0.00 -0.02 0.00 0.00 54.58 53.10 3gh1 n ASN 229 Cb 0.34 0.49 -0.13 0.00 -2.36 0.00 0.00 39.78 38.12 3gh1 n ASN 229 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 3gh1 s GLU 230 N -2.12 0.90 -0.03 -3.83 2.02 -0.81 -4.94 118.70 109.89 3gh1 s GLU 230 Ca 0.15 -1.54 -0.20 0.00 0.02 0.00 0.00 54.97 53.40 3gh1 s GLU 230 Cb 0.15 -1.90 -0.05 0.00 0.10 0.00 0.00 34.13 32.43 3gh1 s GLU 230 CO 0.47 -1.13 0.57 -1.17 0.02 0.00 0.00 175.26 174.03 3gh1 s LEU 231 N 0.91 4.38 -0.06 1.80 2.96 -1.26 -1.53 118.68 125.89 3gh1 s LEU 231 Ca 0.16 1.09 0.01 0.00 -0.22 0.00 0.00 54.13 55.17 3gh1 s LEU 231 Cb -0.22 -2.88 0.02 0.00 0.50 0.00 0.00 46.19 43.61 3gh1 s LEU 231 CO -0.06 0.07 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.29 3gh1 s VAL 232 N 0.00 0.73 0.44 1.68 1.01 -0.63 -4.86 120.40 118.78 3gh1 s VAL 232 Ca 0.30 -0.21 0.07 0.00 0.00 0.00 0.00 61.98 62.14 3gh1 s VAL 232 Cb -0.17 -0.74 0.01 0.00 0.00 0.00 0.00 36.38 35.48 3gh1 s VAL 232 CO 0.16 0.28 0.60 -0.63 0.00 0.00 0.00 175.10 175.50 3gh1 s ILE 233 N 1.03 3.00 -0.18 2.22 1.09 -1.26 -0.93 121.20 126.17 3gh1 s ILE 233 Ca -0.09 -0.94 0.16 0.00 -1.10 0.00 0.00 60.65 58.67 3gh1 s ILE 233 Cb -0.14 -3.02 -0.22 0.00 -1.06 0.00 0.00 42.46 38.02 3gh1 s ILE 233 CO -0.00 -0.01 0.06 -2.65 -0.10 0.00 0.00 174.94 172.23 3gh1 n PRO 235 N -1.92 1.05 -2.48 2.79 -0.02 -1.26 -4.84 135.00 128.32 3gh1 n PRO 235 Ca 0.08 -0.01 -0.04 0.00 -2.02 0.00 0.00 63.50 61.52 3gh1 n PRO 235 Cb 0.59 -1.46 0.01 0.00 -0.02 0.00 0.00 33.50 32.62 3gh1 n PRO 235 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 3gh1 n ASP 236 N -2.68 -1.07 -0.01 2.55 5.68 -1.26 -4.60 116.55 115.16 3gh1 n ASP 236 Ca -0.30 -1.69 -0.13 0.00 -0.50 0.00 0.00 54.79 52.17 3gh1 n ASP 236 Cb 1.08 1.77 -0.01 0.00 -1.14 0.00 0.00 41.12 42.83 3gh1 n ASP 236 CO 0.00 0.00 0.00 0.40 -1.33 0.00 0.00 177.20 176.27 3gh1 h ILE 237 N 1.50 1.31 -0.28 2.12 1.08 -1.96 -2.50 117.51 118.78 3gh1 h ILE 237 Ca -0.16 -1.91 -0.13 0.00 -0.39 0.00 0.00 64.86 62.27 3gh1 h ILE 237 Cb 0.62 1.88 -0.01 0.00 -3.07 0.00 0.00 36.82 36.24 3gh1 h ILE 237 CO 0.20 0.60 -0.35 -0.33 -0.69 0.00 0.00 178.15 177.58 3gh1 h GLU 238 N 0.47 0.63 -0.02 2.37 3.07 -1.92 -1.11 114.58 118.07 3gh1 h GLU 238 Ca -0.02 -0.30 -0.17 0.00 -0.50 0.00 0.00 59.36 58.37 3gh1 h GLU 238 Cb 1.24 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 29.13 3gh1 h GLU 238 CO 0.13 0.89 -0.77 0.87 -1.40 0.00 0.00 179.01 178.73 3gh1 h LYS 239 N 0.53 0.17 -0.85 2.33 1.57 -1.86 -1.88 116.57 116.58 3gh1 h LYS 239 Ca 0.06 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.65 3gh1 h LYS 239 Cb 0.85 0.04 -0.04 0.00 0.08 0.00 0.00 32.23 33.16 3gh1 h LYS 239 CO 0.07 0.85 0.42 -0.09 -0.57 0.00 0.00 179.45 180.14 3gh1 h ARG 240 N 0.11 1.21 -0.47 3.15 2.43 -1.20 0.14 114.38 119.74 3gh1 h ARG 240 Ca -0.03 -0.17 -0.04 0.00 -0.81 0.00 0.00 59.98 58.94 3gh1 h ARG 240 Cb 1.34 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 30.65 3gh1 h ARG 240 CO 0.11 0.92 0.15 -0.07 -1.51 0.00 0.00 179.97 179.57 3gh1 h LEU 241 N 1.20 0.68 -0.78 3.80 3.38 -1.01 0.74 115.31 123.32 3gh1 h LEU 241 Ca 0.29 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 3gh1 h LEU 241 Cb 0.09 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 3gh1 h LEU 241 CO -0.04 0.70 0.06 -0.08 0.09 0.00 0.00 178.44 179.17 3gh1 h GLU 242 N 0.63 0.98 -0.26 1.13 4.81 -1.14 -2.30 114.58 118.42 3gh1 h GLU 242 Ca 0.15 -0.26 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 3gh1 h GLU 242 Cb 0.26 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 3gh1 h GLU 242 CO -0.01 0.93 0.17 0.00 -0.73 0.00 0.00 179.01 179.37 3gh1 h ALA 243 N 1.14 0.33 -0.48 2.92 0.00 -0.28 -1.54 119.26 121.36 3gh1 h ALA 243 Ca 0.18 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.14 3gh1 h ALA 243 Cb 0.46 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 3gh1 h ALA 243 CO 0.02 -0.20 0.17 0.74 0.00 0.00 0.00 179.25 179.97 3gh1 h PHE 244 N 0.35 0.29 0.00 0.00 0.04 -0.60 -3.19 116.94 113.83 3gh1 h PHE 244 Ca 0.10 0.02 -0.16 0.00 2.80 0.00 0.00 57.97 60.74 3gh1 h PHE 244 Cb -0.03 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.03 3gh1 h PHE 244 CO -0.06 0.10 -0.92 -0.39 -0.60 0.00 0.00 178.31 176.43 3gh1 h VAL 245 N 0.34 0.96 0.00 -0.55 -1.51 -1.16 -0.79 116.25 113.54 3gh1 h VAL 245 Ca 0.23 -2.46 0.00 0.00 -1.23 0.00 0.00 66.70 63.24 3gh1 h VAL 245 Cb 0.24 2.42 0.00 0.00 -2.13 0.00 0.00 31.29 31.82 3gh1 h VAL 245 CO -0.24 0.55 0.00 0.54 -1.23 0.00 0.00 177.57 177.19 3gh1 n ARG 246 N -3.16 0.73 -1.09 5.19 1.74 -0.60 -4.89 116.66 114.58 3gh1 n ARG 246 Ca -0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 3gh1 n ARG 246 Cb 0.83 -1.24 0.00 0.00 -1.02 0.00 0.00 32.46 31.03 3gh1 n ARG 246 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3gh1 n ALA 248 N 0.42 -1.04 0.26 7.54 0.00 -0.30 -0.48 120.51 126.91 3gh1 n ALA 248 Ca 0.00 0.02 0.07 0.00 0.00 0.00 0.00 53.44 53.53 3gh1 n ALA 248 Cb 0.28 -0.54 -0.10 0.00 0.00 0.00 0.00 19.45 19.10 3gh1 n ALA 248 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3gh1 n HIS 249 N -0.80 0.00 -3.85 0.00 -0.00 -0.33 -4.97 115.22 105.27 3gh1 n HIS 249 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.72 57.65 3gh1 n HIS 249 Cb 0.00 -0.20 -0.02 0.00 -0.00 0.00 0.00 29.99 29.78 3gh1 n HIS 249 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.34 176.54 3gh1 s GLY 250 N -3.12 -0.09 -0.03 -1.41 0.00 -1.12 -4.18 107.32 97.38 3gh1 s GLY 250 Ca -0.01 -0.29 0.01 0.00 0.00 0.00 0.00 44.72 44.43 3gh1 s GLY 250 CO 0.59 -0.08 -0.04 -0.42 0.00 0.00 0.00 173.10 173.15 3gh1 s ILE 251 N -3.82 0.41 -0.09 0.90 1.01 -0.37 -0.54 121.20 118.70 3gh1 s ILE 251 Ca 0.11 -0.10 0.03 0.00 0.00 0.00 0.00 60.65 60.69 3gh1 s ILE 251 Cb -0.06 -0.42 -0.01 0.00 0.01 0.00 0.00 42.46 41.98 3gh1 s ILE 251 CO 0.07 0.17 -0.18 -0.63 0.00 0.00 0.00 174.94 174.37 3gh1 s ILE 252 N 0.60 2.65 -0.20 2.92 1.01 -0.08 -1.08 121.20 127.01 3gh1 s ILE 252 Ca -0.07 -0.83 0.01 0.00 0.00 0.00 0.00 60.65 59.75 3gh1 s ILE 252 Cb -0.10 -2.05 0.05 0.00 0.01 0.00 0.00 42.46 40.36 3gh1 s ILE 252 CO -0.00 0.56 -0.08 -0.63 0.00 0.00 0.00 174.94 174.78 3gh1 s ILE 253 N -0.02 1.55 0.63 2.92 1.01 -0.18 -0.74 121.20 126.36 3gh1 s ILE 253 Ca -0.05 -1.01 -0.05 0.00 0.00 0.00 0.00 60.65 59.54 3gh1 s ILE 253 Cb -0.15 -1.68 0.04 0.00 0.01 0.00 0.00 42.46 40.68 3gh1 s ILE 253 CO 0.05 0.10 0.92 -0.36 0.00 0.00 0.00 174.94 175.64 3gh1 s PHE 254 N 1.43 3.03 0.58 3.97 0.08 -0.33 -0.94 117.98 125.80 3gh1 s PHE 254 Ca -0.02 0.42 -0.20 0.00 0.12 0.00 0.00 56.93 57.24 3gh1 s PHE 254 Cb -0.17 -2.92 -0.04 0.00 -0.57 0.00 0.00 43.02 39.33 3gh1 s PHE 254 CO -0.08 -1.07 1.32 -2.14 -0.10 0.00 0.00 175.22 173.15 3gh1 s PRO 255 N -5.04 2.97 0.13 0.24 0.02 -1.26 -4.40 135.00 127.66 3gh1 s PRO 255 Ca 0.57 2.13 -0.08 0.00 0.02 0.00 0.00 61.00 63.64 3gh1 s PRO 255 Cb -0.11 -2.11 0.03 0.00 0.02 0.00 0.00 34.50 32.34 3gh1 s PRO 255 CO 0.43 -1.29 0.38 0.41 -0.33 0.00 0.00 177.00 176.61 3gh1 n GLY 256 N 0.75 1.31 0.00 0.52 0.00 -1.26 -1.49 105.19 105.01 3gh1 n GLY 256 Ca 0.12 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 45.07 3gh1 n GLY 256 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gh1 n GLY 257 N -0.26 1.61 0.22 -0.02 0.00 -1.26 -4.81 105.19 100.66 3gh1 n GLY 257 Ca -0.02 -1.74 0.03 0.00 0.00 0.00 0.00 46.02 44.29 3gh1 n GLY 257 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gh1 h PRO 258 N 0.00 0.15 -0.60 1.61 0.13 -1.91 -0.61 132.00 130.76 3gh1 h PRO 258 Ca 0.00 -0.04 -0.08 0.00 -0.87 0.00 0.00 66.00 65.01 3gh1 h PRO 258 Cb 0.00 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.09 3gh1 h PRO 258 CO 0.00 0.35 0.06 0.78 -0.23 0.00 0.00 178.00 178.96 3gh1 h GLY 259 N 0.79 1.11 1.61 1.56 0.00 -1.95 0.26 103.07 106.46 3gh1 h GLY 259 Ca 0.03 -0.77 -0.15 0.00 0.00 0.00 0.00 47.33 46.44 3gh1 h GLY 259 CO 0.03 0.71 -0.53 -0.84 0.00 0.00 0.00 176.54 175.91 3gh1 h THR 260 N 0.93 1.34 -0.21 4.70 2.02 -1.78 -2.64 112.91 117.26 3gh1 h THR 260 Ca 0.18 -1.80 -0.03 0.00 0.77 0.00 0.00 66.41 65.53 3gh1 h THR 260 Cb 0.48 1.81 -0.01 0.00 -1.74 0.00 0.00 68.15 68.70 3gh1 h THR 260 CO 0.02 0.55 0.02 0.00 0.37 0.00 0.00 175.52 176.47 3gh1 h ALA 261 N 1.11 0.28 -0.56 6.16 0.00 -0.69 -1.81 119.26 123.74 3gh1 h ALA 261 Ca 0.01 -0.19 0.11 0.00 0.00 0.00 0.00 54.91 54.84 3gh1 h ALA 261 Cb 1.04 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.66 3gh1 h ALA 261 CO 0.09 -0.02 -0.04 1.49 0.00 0.00 0.00 179.25 180.77 3gh1 h GLU 262 N 0.14 0.07 -0.71 0.00 4.81 -0.44 -1.37 114.58 117.07 3gh1 h GLU 262 Ca 0.06 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 3gh1 h GLU 262 Cb 0.36 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 3gh1 h GLU 262 CO 0.01 0.05 0.45 0.93 -0.73 0.00 0.00 179.01 179.72 3gh1 h GLU 263 N 0.08 0.95 -0.10 1.92 5.08 -1.19 -0.27 114.58 121.05 3gh1 h GLU 263 Ca 0.28 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.57 3gh1 h GLU 263 Cb 0.45 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 3gh1 h GLU 263 CO -0.51 0.66 0.04 1.25 -1.00 0.00 0.00 179.01 179.45 3gh1 h LEU 264 N 0.97 0.13 -0.57 1.33 5.85 -1.00 -0.85 115.31 121.17 3gh1 h LEU 264 Ca 0.26 -0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.87 3gh1 h LEU 264 Cb -0.07 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 40.88 3gh1 h LEU 264 CO -0.05 0.25 0.32 -0.07 -0.34 0.00 0.00 178.44 178.54 3gh1 h LEU 265 N 0.01 0.48 0.15 2.25 3.38 -1.18 0.38 115.31 120.78 3gh1 h LEU 265 Ca 0.03 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.04 3gh1 h LEU 265 Cb 0.16 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 3gh1 h LEU 265 CO -0.00 0.33 -0.39 0.22 0.09 0.00 0.00 178.44 178.68 3gh1 h TYR 266 N 0.61 -1.09 -0.58 1.13 3.20 -0.85 -0.32 116.97 119.06 3gh1 h TYR 266 Ca 0.25 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 62.06 3gh1 h TYR 266 Cb 0.11 0.46 -0.02 0.00 1.54 0.00 0.00 36.73 38.82 3gh1 h TYR 266 CO -0.08 -0.50 0.04 0.97 -1.64 0.00 0.00 178.16 176.95 3gh1 h ILE 267 N -0.65 1.26 -0.57 1.81 6.09 -0.82 -2.26 117.51 122.37 3gh1 h ILE 267 Ca 0.02 -1.05 -0.06 0.00 -1.37 0.00 0.00 64.86 62.40 3gh1 h ILE 267 Cb 0.66 0.76 -0.03 0.00 0.47 0.00 0.00 36.82 38.69 3gh1 h ILE 267 CO -0.21 0.38 0.13 -0.07 -3.07 0.00 0.00 178.15 175.31 3gh1 h LEU 268 N 0.90 0.84 -0.91 2.19 3.38 -0.05 -2.97 115.31 118.70 3gh1 h LEU 268 Ca 0.17 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3gh1 h LEU 268 Cb 0.47 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 3gh1 h LEU 268 CO 0.02 0.83 0.22 1.23 0.09 0.00 0.00 178.44 180.82 3gh1 h GLY 269 N 1.00 1.09 -7.48 0.83 0.00 -0.76 -3.44 103.07 94.32 3gh1 h GLY 269 Ca 0.18 -0.62 -0.39 0.00 0.00 0.00 0.00 47.33 46.51 3gh1 h GLY 269 CO 0.00 0.58 1.21 -0.42 0.00 0.00 0.00 176.54 177.91 3gh1 s ILE 270 N -5.37 3.63 0.00 2.60 -1.09 -0.88 -4.74 121.20 115.36 3gh1 s ILE 270 Ca -0.11 -1.00 0.00 0.00 -2.23 0.00 0.00 60.65 57.31 3gh1 s ILE 270 Cb 0.16 -4.61 0.00 0.00 -1.58 0.00 0.00 42.46 36.42 3gh1 s ILE 270 CO 0.82 -1.17 0.00 1.57 -1.23 0.00 0.00 174.94 174.93 3gh1 n HIS 273 N 13.29 0.00 0.13 3.97 -0.00 -1.26 -4.78 115.22 126.57 3gh1 n HIS 273 Ca 0.45 0.00 0.10 0.00 -0.00 0.00 0.00 57.72 58.27 3gh1 n HIS 273 Cb 0.47 0.00 0.60 0.00 -0.00 0.00 0.00 29.99 31.06 3gh1 n HIS 273 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 3gh1 h PRO 274 N 0.00 0.12 0.00 1.57 0.11 -2.00 -0.14 132.00 131.66 3gh1 h PRO 274 Ca 0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 3gh1 h PRO 274 Cb 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.08 3gh1 h PRO 274 CO 0.00 0.08 0.00 0.39 -0.21 0.00 0.00 178.00 178.26 3gh1 n GLU 275 N -4.49 0.14 -0.57 1.05 1.02 -1.26 -2.84 120.64 113.69 3gh1 n GLU 275 Ca 0.02 0.31 0.09 0.00 -0.02 0.00 0.00 57.16 57.56 3gh1 n GLU 275 Cb 0.22 -1.74 0.34 0.00 -0.02 0.00 0.00 31.44 30.24 3gh1 n GLU 275 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3gh1 n ASN 276 N -1.99 4.58 0.22 1.62 3.02 -0.06 -4.58 115.26 118.06 3gh1 n ASN 276 Ca 0.03 -2.45 0.07 0.00 -0.03 0.00 0.00 54.58 52.20 3gh1 n ASN 276 Cb 0.25 -0.55 0.51 0.00 -0.61 0.00 0.00 39.78 39.39 3gh1 n ASN 276 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gh1 h ALA 277 N 3.80 1.44 -0.00 5.41 0.00 -1.60 -1.76 119.26 126.55 3gh1 h ALA 277 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3gh1 h ALA 277 Cb 1.40 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.15 3gh1 h ALA 277 CO 0.21 0.29 -0.02 -0.40 0.00 0.00 0.00 179.25 179.33 3gh1 n ASP 278 N -4.01 0.02 -4.69 0.00 5.75 -1.26 -4.93 116.55 107.43 3gh1 n ASP 278 Ca -0.02 0.45 -0.42 0.00 -0.01 0.00 0.00 54.79 54.79 3gh1 n ASP 278 Cb 0.31 -0.46 -0.03 0.00 -1.03 0.00 0.00 41.12 39.91 3gh1 n ASP 278 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 3gh1 s GLN 279 N -2.98 4.33 -0.08 0.11 -1.52 -0.66 -5.06 119.66 113.79 3gh1 s GLN 279 Ca 0.14 1.78 -0.19 0.00 -1.95 0.00 0.00 55.36 55.14 3gh1 s GLN 279 Cb 0.19 -3.56 -0.04 0.00 -0.22 0.00 0.00 33.01 29.38 3gh1 s GLN 279 CO 0.53 -0.49 0.52 -1.25 -0.25 0.00 0.00 175.29 174.35 3gh1 s PRO 280 N 2.25 4.31 0.02 2.91 0.04 -1.26 -5.12 135.00 138.16 3gh1 s PRO 280 Ca 0.59 0.54 0.01 0.00 0.04 0.00 0.00 61.00 62.18 3gh1 s PRO 280 Cb -0.27 -3.40 -0.02 0.00 0.04 0.00 0.00 34.50 30.85 3gh1 s PRO 280 CO 0.24 0.23 -0.04 -1.25 0.04 0.00 0.00 177.00 176.22 3gh1 s PRO 282 N 0.35 0.35 -0.13 0.56 0.04 -1.26 -4.88 135.00 130.03 3gh1 s PRO 282 Ca 0.28 -0.56 0.01 0.00 0.04 0.00 0.00 61.00 60.77 3gh1 s PRO 282 Cb -0.16 -0.06 0.02 0.00 0.04 0.00 0.00 34.50 34.34 3gh1 s PRO 282 CO 0.13 -0.00 -0.14 0.42 0.04 0.00 0.00 177.00 177.45 3gh1 s ILE 283 N -1.18 1.48 -0.13 0.56 1.01 -1.26 -1.23 121.20 120.44 3gh1 s ILE 283 Ca -0.11 -0.59 0.01 0.00 0.00 0.00 0.00 60.65 59.96 3gh1 s ILE 283 Cb -0.08 -1.39 0.02 0.00 0.01 0.00 0.00 42.46 41.01 3gh1 s ILE 283 CO -0.00 0.44 -0.17 -0.69 0.00 0.00 0.00 174.94 174.52 3gh1 s VAL 284 N 1.38 1.70 -0.05 2.92 1.01 -0.25 -1.34 120.40 125.78 3gh1 s VAL 284 Ca 0.02 -0.75 -0.14 0.00 0.00 0.00 0.00 61.98 61.11 3gh1 s VAL 284 Cb -0.13 -1.55 -0.05 0.00 0.00 0.00 0.00 36.38 34.64 3gh1 s VAL 284 CO -0.08 0.48 0.36 -0.76 0.00 0.00 0.00 175.10 175.10 3gh1 s LEU 285 N 1.10 4.42 -0.04 3.92 1.02 0.32 -1.01 118.68 128.39 3gh1 s LEU 285 Ca -0.03 0.82 -0.24 0.00 0.02 0.00 0.00 54.13 54.70 3gh1 s LEU 285 Cb -0.14 -2.49 0.05 0.00 0.02 0.00 0.00 46.19 43.63 3gh1 s LEU 285 CO -0.05 0.29 0.53 0.28 0.02 0.00 0.00 176.35 177.42 3gh1 s THR 286 N -0.75 0.02 0.08 5.49 -1.32 -0.12 -0.41 115.64 118.63 3gh1 s THR 286 Ca 0.22 -0.18 -0.24 0.00 -1.21 0.00 0.00 61.69 60.28 3gh1 s THR 286 Cb -0.15 -0.84 0.08 0.00 -1.51 0.00 0.00 72.50 70.08 3gh1 s THR 286 CO 0.11 -0.10 1.11 0.61 -2.21 0.00 0.00 174.62 174.13 3gh1 n GLY 287 N 1.15 0.43 3.75 6.08 0.00 -1.21 -4.08 105.19 111.32 3gh1 n GLY 287 Ca -0.20 -1.09 -0.30 0.00 0.00 0.00 0.00 46.02 44.44 3gh1 n GLY 287 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3gh1 s PRO 288 N -2.03 1.49 0.33 1.61 0.04 -1.26 -0.39 135.00 134.78 3gh1 s PRO 288 Ca 0.25 0.69 0.10 0.00 0.04 0.00 0.00 61.00 62.09 3gh1 s PRO 288 Cb -0.02 -1.85 0.99 0.00 0.04 0.00 0.00 34.50 33.66 3gh1 s PRO 288 CO 0.02 -2.05 1.60 -0.22 0.04 0.00 0.00 177.00 176.40 3gh1 h LYS 289 N -1.40 0.09 0.00 4.56 1.63 -1.92 0.01 116.57 119.54 3gh1 h LYS 289 Ca -0.49 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.30 3gh1 h LYS 289 Cb 1.29 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.90 3gh1 h LYS 289 CO 0.57 0.06 0.00 0.00 -3.45 0.00 0.00 179.45 176.63 3gh1 n GLN 290 N -5.30 0.33 -0.23 1.90 10.64 -1.26 -1.86 117.38 121.60 3gh1 n GLN 290 Ca 0.29 0.09 0.11 0.00 -1.83 0.00 0.00 57.00 55.66 3gh1 n GLN 290 Cb 0.95 -1.50 0.26 0.00 -0.86 0.00 0.00 30.24 29.09 3gh1 n GLN 290 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.06 174.10 3gh1 n SER 291 N -1.20 3.26 -0.13 2.61 3.41 -0.01 -4.54 113.62 117.02 3gh1 n SER 291 Ca 0.09 -1.96 -0.06 0.00 -0.26 0.00 0.00 58.87 56.68 3gh1 n SER 291 Cb 0.11 -0.30 0.01 0.00 -0.26 0.00 0.00 64.21 63.76 3gh1 n SER 291 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 3gh1 h GLU 292 N 3.95 -0.15 -0.60 4.33 4.81 -1.51 -1.12 114.58 124.28 3gh1 h GLU 292 Ca 0.00 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.26 3gh1 h GLU 292 Cb 0.88 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 30.26 3gh1 h GLU 292 CO 0.00 -0.10 0.37 0.00 -0.73 0.00 0.00 179.01 178.55 3gh1 h ALA 293 N 1.07 0.77 -0.32 2.92 0.00 -1.86 0.14 119.26 121.98 3gh1 h ALA 293 Ca 0.20 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.15 3gh1 h ALA 293 Cb 0.47 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 3gh1 h ALA 293 CO -0.51 0.12 -0.09 -0.92 0.00 0.00 0.00 179.25 177.85 3gh1 h TYR 294 N 0.74 -0.19 -0.11 0.00 3.20 -1.75 -0.29 116.97 118.57 3gh1 h TYR 294 Ca 0.24 0.03 -0.16 0.00 3.14 0.00 0.00 58.73 61.98 3gh1 h TYR 294 Cb 0.00 0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.40 3gh1 h TYR 294 CO -0.05 -0.15 -0.61 0.74 -1.64 0.00 0.00 178.16 176.46 3gh1 h PHE 295 N -0.01 0.50 -0.12 -3.82 0.04 -0.63 0.77 116.94 113.67 3gh1 h PHE 295 Ca 0.15 -0.19 0.04 0.00 2.80 0.00 0.00 57.97 60.77 3gh1 h PHE 295 Cb 0.24 -0.09 -0.05 0.00 2.20 0.00 0.00 35.95 38.26 3gh1 h PHE 295 CO -0.31 0.90 -0.18 0.00 -0.60 0.00 0.00 178.31 178.12 3gh1 h ARG 296 N 0.29 -0.22 -0.49 1.51 3.08 -0.48 -0.02 114.38 118.05 3gh1 h ARG 296 Ca -0.01 0.02 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 3gh1 h ARG 296 Cb 1.14 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 31.22 3gh1 h ARG 296 CO 0.10 -0.15 -0.04 1.03 -1.07 0.00 0.00 179.97 179.85 3gh1 h SER 297 N -0.23 0.82 -0.29 7.04 0.87 -0.79 -0.96 113.55 120.00 3gh1 h SER 297 Ca 0.09 -0.22 -0.04 0.00 -1.23 0.00 0.00 61.79 60.40 3gh1 h SER 297 Cb 0.36 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.09 3gh1 h SER 297 CO -0.25 0.91 0.04 0.25 -0.53 0.00 0.00 176.83 177.25 3gh1 h LEU 298 N 0.78 0.47 -0.80 2.23 5.85 -0.73 -1.54 115.31 121.56 3gh1 h LEU 298 Ca 0.14 -0.26 -0.07 0.00 0.84 0.00 0.00 57.88 58.53 3gh1 h LEU 298 Cb 0.52 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 3gh1 h LEU 298 CO 0.03 0.61 0.15 -0.78 -0.34 0.00 0.00 178.44 178.11 3gh1 h ASP 299 N 0.31 0.99 -0.57 1.25 3.58 -0.87 -0.87 116.42 120.23 3gh1 h ASP 299 Ca 0.09 -0.21 -0.09 0.00 0.42 0.00 0.00 57.03 57.24 3gh1 h ASP 299 Cb 0.35 -0.26 -0.02 0.00 1.72 0.00 0.00 39.33 41.11 3gh1 h ASP 299 CO 0.01 0.96 -0.00 0.50 -2.88 0.00 0.00 179.24 177.82 3gh1 h LYS 300 N 0.99 1.01 -0.26 0.28 3.64 -1.15 -1.37 116.57 119.72 3gh1 h LYS 300 Ca 0.21 -0.32 0.01 0.00 -1.27 0.00 0.00 60.65 59.27 3gh1 h LYS 300 Cb 0.37 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 3gh1 h LYS 300 CO 0.00 1.01 0.16 0.35 -2.27 0.00 0.00 179.45 178.70 3gh1 h PHE 301 N 0.90 0.31 0.19 1.91 3.57 -0.89 -0.07 116.94 122.86 3gh1 h PHE 301 Ca 0.16 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.66 3gh1 h PHE 301 Cb 0.55 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.19 3gh1 h PHE 301 CO 0.04 0.19 -0.10 0.82 -2.23 0.00 0.00 178.31 177.03 3gh1 h ILE 302 N 0.33 0.80 0.00 1.41 1.08 -1.00 -2.43 117.51 117.70 3gh1 h ILE 302 Ca 0.10 0.00 -0.13 0.00 -0.39 0.00 0.00 64.86 64.44 3gh1 h ILE 302 Cb -0.03 0.80 -0.02 0.00 -3.07 0.00 0.00 36.82 34.51 3gh1 h ILE 302 CO -0.03 0.00 -0.62 0.71 -0.69 0.00 0.00 178.15 177.52 3gh1 h THR 303 N -0.26 1.34 -0.54 -0.27 1.35 -1.13 0.02 112.91 113.42 3gh1 h THR 303 Ca -0.02 -2.22 -0.09 0.00 -0.55 0.00 0.00 66.41 63.53 3gh1 h THR 303 Cb 0.20 2.23 -0.02 0.00 -1.73 0.00 0.00 68.15 68.84 3gh1 h THR 303 CO 0.04 0.61 -0.02 0.44 -0.25 0.00 0.00 175.52 176.34 3gh1 h ASP 304 N 0.00 0.90 0.00 5.36 5.19 -1.01 -2.19 116.42 124.66 3gh1 h ASP 304 Ca -0.01 -0.24 -0.15 0.00 -0.62 0.00 0.00 57.03 56.01 3gh1 h ASP 304 Cb 1.18 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 40.43 3gh1 h ASP 304 CO 0.08 0.97 -1.01 0.35 -3.12 0.00 0.00 179.24 176.52 3gh1 n THR 305 N -4.19 1.49 0.72 0.35 -2.24 -0.92 -4.37 114.28 105.13 3gh1 n THR 305 Ca 0.03 0.06 0.12 0.00 -2.27 0.00 0.00 64.05 61.98 3gh1 n THR 305 Cb 0.33 -2.17 0.18 0.00 -2.10 0.00 0.00 70.33 66.58 3gh1 n THR 305 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3gh1 n LEU 306 N -4.50 0.61 0.00 3.22 4.77 -0.03 -5.00 117.00 116.07 3gh1 n LEU 306 Ca -0.23 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 3gh1 n LEU 306 Cb 0.53 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.42 3gh1 n LEU 306 CO 0.15 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.85 3gh1 n GLY 307 N 1.40 2.45 0.41 -0.72 0.00 -0.83 -4.59 105.19 103.32 3gh1 n GLY 307 Ca 0.04 -1.91 0.23 0.00 0.00 0.00 0.00 46.02 44.37 3gh1 n GLY 307 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3gh1 h GLU 308 N 0.00 0.00 0.00 1.61 4.39 -1.90 -1.71 114.58 116.97 3gh1 h GLU 308 Ca 0.00 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 3gh1 h GLU 308 Cb 0.00 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3gh1 h GLU 308 CO 0.00 0.00 -0.02 0.00 -1.16 0.00 0.00 179.01 177.83 3gh1 h ALA 309 N 1.44 1.04 0.00 3.43 0.00 -1.92 -2.82 119.26 120.44 3gh1 h ALA 309 Ca 0.26 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 3gh1 h ALA 309 Cb 1.34 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.12 3gh1 h ALA 309 CO -0.00 0.03 -0.15 0.00 0.00 0.00 0.00 179.25 179.12 3gh1 h ALA 310 N 1.98 0.93 0.00 0.00 0.00 -1.55 -3.26 119.26 117.36 3gh1 h ALA 310 Ca -0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 3gh1 h ALA 310 Cb 0.28 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 3gh1 h ALA 310 CO 0.00 0.19 -0.15 -0.09 0.00 0.00 0.00 179.25 179.21 3gh1 h ARG 311 N 0.00 0.00 0.00 0.00 9.65 -1.68 -1.59 114.38 120.75 3gh1 h ARG 311 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3gh1 h ARG 311 Cb 0.96 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.54 3gh1 h ARG 311 CO 0.02 0.15 0.00 0.36 2.80 0.00 0.00 179.97 183.30 3gh1 n LYS 312 N -3.74 0.03 0.00 0.20 2.85 -1.23 -3.11 118.16 113.16 3gh1 n LYS 312 Ca -0.02 0.15 0.13 0.00 -1.05 0.00 0.00 58.31 57.51 3gh1 n LYS 312 Cb 0.26 -1.50 0.29 0.00 -0.65 0.00 0.00 35.03 33.43 3gh1 n LYS 312 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 3gh1 n HIS 313 N -1.48 0.00 -4.05 5.58 8.25 -0.60 -4.96 115.22 117.96 3gh1 n HIS 313 Ca 0.05 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.41 3gh1 n HIS 313 Cb 0.23 -0.08 -0.07 0.00 1.12 0.00 0.00 29.99 31.20 3gh1 n HIS 313 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 3gh1 s TYR 314 N -2.44 0.59 0.18 4.41 -0.85 -1.18 -4.19 117.35 113.88 3gh1 s TYR 314 Ca 0.24 -0.92 0.01 0.00 -0.52 0.00 0.00 57.07 55.89 3gh1 s TYR 314 Cb 0.19 -0.06 -0.05 0.00 0.38 0.00 0.00 41.96 42.42 3gh1 s TYR 314 CO 0.51 -0.85 0.03 -1.54 -1.52 0.00 0.00 175.55 172.18 3gh1 s SER 315 N -3.05 0.99 -0.06 -0.18 1.04 -0.45 -4.94 113.70 107.04 3gh1 s SER 315 Ca 0.26 -1.22 0.03 0.00 0.48 0.00 0.00 55.95 55.50 3gh1 s SER 315 Cb 0.02 0.17 0.01 0.00 0.10 0.00 0.00 66.02 66.32 3gh1 s SER 315 CO 0.08 -0.64 -0.15 -0.63 0.98 0.00 0.00 173.24 172.88 3gh1 s ILE 316 N -3.77 1.36 -0.25 -1.02 1.01 -1.26 -0.52 121.20 116.75 3gh1 s ILE 316 Ca 0.27 -0.63 -0.02 0.00 0.00 0.00 0.00 60.65 60.27 3gh1 s ILE 316 Cb 0.07 -1.20 0.08 0.00 0.01 0.00 0.00 42.46 41.41 3gh1 s ILE 316 CO 0.05 0.40 0.06 0.00 0.00 0.00 0.00 174.94 175.45 3gh1 s ALA 317 N 0.41 1.33 -0.01 9.38 0.00 0.45 -4.94 121.76 128.37 3gh1 s ALA 317 Ca -0.12 -1.21 -0.11 0.00 0.00 0.00 0.00 51.96 50.52 3gh1 s ALA 317 Cb -0.15 -1.41 -0.05 0.00 0.00 0.00 0.00 23.12 21.51 3gh1 s ALA 317 CO 0.04 -1.41 0.32 0.42 0.00 0.00 0.00 175.76 175.13 3gh1 s ILE 318 N 1.71 5.19 -1.25 0.00 -1.09 -1.26 -3.32 121.20 121.18 3gh1 s ILE 318 Ca 0.04 0.52 -0.07 0.00 -2.23 0.00 0.00 60.65 58.91 3gh1 s ILE 318 Cb -0.17 -3.60 0.01 0.00 -1.58 0.00 0.00 42.46 37.11 3gh1 s ILE 318 CO -0.16 0.51 0.87 -0.67 -1.23 0.00 0.00 174.94 174.25 3gh1 n ASP 319 N 1.60 -5.76 -2.83 3.58 2.03 0.48 -4.93 116.55 110.72 3gh1 n ASP 319 Ca -0.14 -0.40 -0.07 0.00 0.52 0.00 0.00 54.79 54.71 3gh1 n ASP 319 Cb 0.53 -4.44 0.00 0.00 -0.72 0.00 0.00 41.12 36.49 3gh1 n ASP 319 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 3gh1 n ASN 320 N -2.29 -3.09 -0.32 1.67 2.85 -1.26 -4.94 115.26 107.88 3gh1 n ASN 320 Ca -0.03 -2.89 -0.04 0.00 -0.11 0.00 0.00 54.58 51.52 3gh1 n ASN 320 Cb 0.57 1.50 0.08 0.00 1.24 0.00 0.00 39.78 43.18 3gh1 n ASN 320 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 3gh1 h PRO 321 N 4.99 1.17 -0.81 1.20 0.11 -1.93 -2.34 132.00 134.41 3gh1 h PRO 321 Ca 0.07 -0.10 -0.03 0.00 0.11 0.00 0.00 66.00 66.06 3gh1 h PRO 321 Cb 1.08 -0.25 -0.04 0.00 0.11 0.00 0.00 31.00 31.90 3gh1 h PRO 321 CO 0.07 0.81 0.40 0.00 -0.21 0.00 0.00 178.00 179.07 3gh1 h ALA 322 N 1.30 1.04 -0.71 -0.75 0.00 -1.95 -2.77 119.26 115.42 3gh1 h ALA 322 Ca 0.32 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3gh1 h ALA 322 Cb -0.08 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.36 3gh1 h ALA 322 CO -0.06 0.59 0.40 1.49 0.00 0.00 0.00 179.25 181.67 3gh1 h GLU 323 N 1.14 0.98 -0.49 0.00 4.57 -1.85 0.89 114.58 119.81 3gh1 h GLU 323 Ca 0.28 -0.10 0.00 0.00 -1.18 0.00 0.00 59.36 58.36 3gh1 h GLU 323 Cb 0.10 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.47 3gh1 h GLU 323 CO -0.04 0.72 0.32 0.00 -1.18 0.00 0.00 179.01 178.83 3gh1 h ALA 324 N 1.21 0.62 -0.77 2.92 0.00 -1.22 -0.38 119.26 121.63 3gh1 h ALA 324 Ca 0.25 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 3gh1 h ALA 324 Cb 0.01 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 3gh1 h ALA 324 CO -0.04 0.07 0.33 0.00 0.00 0.00 0.00 179.25 179.61 3gh1 h ALA 325 N 1.17 1.13 -0.69 0.00 0.00 -1.30 -2.98 119.26 116.59 3gh1 h ALA 325 Ca 0.18 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 3gh1 h ALA 325 Cb -0.07 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.39 3gh1 h ALA 325 CO -0.04 0.64 0.16 -0.09 0.00 0.00 0.00 179.25 179.92 3gh1 h ARG 326 N 1.11 1.11 -0.79 0.00 2.43 -0.37 -0.49 114.38 117.38 3gh1 h ARG 326 Ca 0.26 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3gh1 h ARG 326 Cb 0.17 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 3gh1 h ARG 326 CO -0.03 0.98 0.00 -0.89 -1.51 0.00 0.00 179.97 178.52 3gh1 n ILE 327 N -4.23 0.00 0.00 1.20 5.41 -0.19 -0.91 119.36 120.63 3gh1 n ILE 327 Ca 0.05 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.80 3gh1 n ILE 327 Cb 0.26 -0.20 0.00 0.00 -0.71 0.00 0.00 39.64 38.99 3gh1 n ILE 327 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 3gh1 n SER 329 N 0.70 0.00 0.17 4.38 2.88 -0.19 -2.48 113.62 119.08 3gh1 n SER 329 Ca 0.00 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.67 3gh1 n SER 329 Cb 0.00 0.00 0.40 0.00 -0.75 0.00 0.00 64.21 63.86 3gh1 n SER 329 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 3gh1 h ASN 330 N 0.00 0.00 -0.55 -3.46 2.35 -1.29 -3.42 115.58 109.21 3gh1 h ASN 330 Ca 0.00 0.00 -0.71 0.00 -0.55 0.00 0.00 56.30 55.04 3gh1 h ASN 330 Cb 0.00 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.32 3gh1 h ASN 330 CO 0.00 0.00 3.07 0.00 -1.65 0.00 0.00 177.43 178.85 3gh1 n ALA 331 N -1.92 6.81 0.00 -0.83 0.00 -1.03 -4.64 120.51 118.91 3gh1 n ALA 331 Ca 0.04 -3.85 0.00 0.00 0.00 0.00 0.00 53.44 49.62 3gh1 n ALA 331 Cb 0.40 -3.15 0.00 0.00 0.00 0.00 0.00 19.45 16.70 3gh1 n ALA 331 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3gh1 n PRO 333 N 3.30 0.00 -0.09 0.00 -0.02 -1.26 -1.57 135.00 135.35 3gh1 n PRO 333 Ca 0.65 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 62.02 3gh1 n PRO 333 Cb 0.27 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.71 3gh1 n PRO 333 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3gh1 h LEU 334 N 0.00 0.49 -0.76 2.45 3.38 -1.97 -1.25 115.31 117.65 3gh1 h LEU 334 Ca 0.00 -0.34 -0.05 0.00 0.09 0.00 0.00 57.88 57.58 3gh1 h LEU 334 Cb 0.00 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 3gh1 h LEU 334 CO 0.00 0.71 0.28 0.58 0.09 0.00 0.00 178.44 180.11 3gh1 h VAL 335 N 0.25 1.26 -0.47 1.22 2.07 -1.63 0.11 116.25 119.07 3gh1 h VAL 335 Ca 0.07 -0.84 -0.05 0.00 0.82 0.00 0.00 66.70 66.71 3gh1 h VAL 335 Cb 0.48 0.38 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 3gh1 h VAL 335 CO 0.02 0.34 0.11 0.03 0.02 0.00 0.00 177.57 178.08 3gh1 h ARG 336 N 1.10 0.75 -0.56 1.57 3.08 -1.78 -1.42 114.38 117.12 3gh1 h ARG 336 Ca 0.25 -0.18 -0.10 0.00 0.07 0.00 0.00 59.98 60.01 3gh1 h ARG 336 Cb 0.24 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 3gh1 h ARG 336 CO -0.02 0.74 -0.05 0.37 -1.07 0.00 0.00 179.97 179.94 3gh1 h GLN 337 N 0.63 1.02 -0.54 0.04 5.75 -0.76 -1.89 115.11 119.36 3gh1 h GLN 337 Ca 0.15 -0.34 -0.10 0.00 -0.15 0.00 0.00 58.65 58.20 3gh1 h GLN 337 Cb 0.34 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.78 3gh1 h GLN 337 CO 0.00 1.03 -0.07 1.25 -2.65 0.00 0.00 178.83 178.40 3gh1 h HIS 338 N 0.92 1.09 -0.48 3.99 2.76 -0.62 -1.46 115.15 121.34 3gh1 h HIS 338 Ca 0.15 -0.20 0.03 0.00 -2.20 0.00 0.00 60.37 58.15 3gh1 h HIS 338 Cb 0.61 -0.28 -0.03 0.00 1.55 0.00 0.00 27.41 29.26 3gh1 h HIS 338 CO 0.04 1.00 0.28 0.00 -1.30 0.00 0.00 177.93 177.95 3gh1 h ARG 339 N 0.89 0.54 -0.66 5.26 2.47 -1.05 -2.31 114.38 119.51 3gh1 h ARG 339 Ca 0.15 -0.03 -0.04 0.00 -1.26 0.00 0.00 59.98 58.79 3gh1 h ARG 339 Cb 0.61 -0.12 -0.03 0.00 -1.65 0.00 0.00 29.97 28.78 3gh1 h ARG 339 CO 0.04 0.36 0.25 0.87 0.56 0.00 0.00 179.97 182.05 3gh1 h LYS 340 N 0.55 0.99 -0.92 0.04 1.57 -1.19 -1.09 116.57 116.52 3gh1 h LYS 340 Ca 0.20 -0.17 0.05 0.00 -1.87 0.00 0.00 60.65 58.86 3gh1 h LYS 340 Cb 0.04 -0.16 -0.06 0.00 0.08 0.00 0.00 32.23 32.13 3gh1 h LYS 340 CO -0.10 0.81 0.59 -0.44 -0.57 0.00 0.00 179.45 179.74 3gh1 h ASP 341 N 0.96 0.96 -0.23 0.86 3.32 -1.06 -2.62 116.42 118.61 3gh1 h ASP 341 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.28 3gh1 h ASP 341 Cb 0.21 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3gh1 h ASP 341 CO -0.02 0.63 0.00 0.29 -1.72 0.00 0.00 179.24 178.43 3gh1 n LYS 342 N -4.54 1.80 -3.98 3.56 4.76 -0.89 -4.93 118.16 113.94 3gh1 n LYS 342 Ca 0.13 -1.22 -0.30 0.00 -2.87 0.00 0.00 58.31 54.05 3gh1 n LYS 342 Cb 0.13 -1.37 0.00 0.00 -1.84 0.00 0.00 35.03 31.95 3gh1 n LYS 342 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 3gh1 n GLU 343 N 0.45 -4.27 -3.75 1.97 1.02 -0.96 -4.96 120.64 110.13 3gh1 n GLU 343 Ca 0.15 0.49 -0.21 0.00 -0.02 0.00 0.00 57.16 57.57 3gh1 n GLU 343 Cb 0.34 -5.12 -0.04 0.00 -0.02 0.00 0.00 31.44 26.61 3gh1 n GLU 343 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3gh1 s ASP 344 N -3.70 5.10 0.24 1.62 -1.08 -0.45 -5.04 116.67 113.36 3gh1 s ASP 344 Ca 0.44 -0.65 -0.30 0.00 -0.52 0.00 0.00 52.55 51.53 3gh1 s ASP 344 Cb -0.23 -0.77 -0.09 0.00 -1.46 0.00 0.00 42.92 40.37 3gh1 s ASP 344 CO 0.87 -0.48 0.98 0.00 0.52 0.00 0.00 175.17 177.07 3gh1 s ALA 345 N -2.40 3.35 0.26 3.66 0.00 -1.25 -4.56 121.76 120.82 3gh1 s ALA 345 Ca 0.43 0.69 -0.04 0.00 0.00 0.00 0.00 51.96 53.05 3gh1 s ALA 345 Cb -0.04 -3.25 0.37 0.00 0.00 0.00 0.00 23.12 20.21 3gh1 s ALA 345 CO 0.27 0.10 1.87 1.88 0.00 0.00 0.00 175.76 179.87 3gh1 h TYR 346 N 4.16 1.12 0.00 0.00 0.05 -1.90 -3.30 116.97 117.11 3gh1 h TYR 346 Ca -0.45 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.36 3gh1 h TYR 346 Cb 1.20 -0.37 0.00 0.00 1.01 0.00 0.00 36.73 38.58 3gh1 h TYR 346 CO 0.61 0.58 -0.62 0.43 -1.05 0.00 0.00 178.16 178.10 3gh1 n SER 347 N -4.54 0.62 -3.61 3.88 7.64 -1.26 -4.77 113.62 111.58 3gh1 n SER 347 Ca 0.14 -0.01 -0.15 0.00 1.01 0.00 0.00 58.87 59.86 3gh1 n SER 347 Cb 0.17 0.24 -0.14 0.00 -1.01 0.00 0.00 64.21 63.48 3gh1 n SER 347 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 3gh1 s PHE 348 N -3.12 -0.33 -1.01 1.43 5.36 -1.24 -4.90 117.98 114.17 3gh1 s PHE 348 Ca 0.07 0.67 -0.20 0.00 -0.96 0.00 0.00 56.93 56.52 3gh1 s PHE 348 Cb 0.15 -0.18 0.10 0.00 -0.34 0.00 0.00 43.02 42.74 3gh1 s PHE 348 CO 0.72 -0.41 1.32 1.21 -1.46 0.00 0.00 175.22 176.59 3gh1 s ASN 349 N 2.37 6.62 0.32 6.13 3.84 0.36 -3.94 114.94 130.64 3gh1 s ASN 349 Ca 0.04 -1.88 0.16 0.00 0.21 0.00 0.00 52.86 51.38 3gh1 s ASN 349 Cb -0.13 -2.48 0.43 0.00 -0.55 0.00 0.00 41.25 38.52 3gh1 s ASN 349 CO -0.09 -1.23 1.62 -0.50 -2.79 0.00 0.00 177.10 174.11 3gh1 h TRP 350 N 9.05 0.00 0.00 0.43 4.06 -1.88 -3.30 115.95 124.32 3gh1 h TRP 350 Ca 0.20 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 61.11 3gh1 h TRP 350 Cb 1.00 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.15 3gh1 h TRP 350 CO 1.22 0.49 -0.21 0.66 -3.56 0.00 0.00 178.44 177.04 3gh1 h SER 351 N 0.00 0.00 -2.63 -3.49 4.64 -1.94 -3.44 113.55 106.68 3gh1 h SER 351 Ca -0.00 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.78 3gh1 h SER 351 Cb 1.10 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 63.25 3gh1 h SER 351 CO 0.06 0.21 0.97 -0.11 -0.87 0.00 0.00 176.83 177.09 3gh1 n LEU 352 N -3.44 3.87 -4.59 5.97 7.94 -1.24 -4.93 117.00 120.57 3gh1 n LEU 352 Ca -0.00 1.07 -0.42 0.00 -1.11 0.00 0.00 56.01 55.55 3gh1 n LEU 352 Cb 0.40 -1.55 -0.05 0.00 0.53 0.00 0.00 43.42 42.74 3gh1 n LEU 352 CO 0.33 0.10 0.59 -0.75 -1.11 0.00 0.00 177.39 176.55 3gh1 s LYS 353 N 1.00 3.76 -0.30 1.96 2.47 -1.26 -5.01 119.74 122.36 3gh1 s LYS 353 Ca 0.75 0.33 -0.01 0.00 -1.56 0.00 0.00 55.97 55.48 3gh1 s LYS 353 Cb -0.53 -3.81 0.05 0.00 -1.46 0.00 0.00 37.83 32.08 3gh1 s LYS 353 CO 0.34 -0.86 -0.02 0.42 0.16 0.00 0.00 175.35 175.40 3gh1 s ILE 354 N 3.13 2.85 0.69 5.43 1.01 -1.26 -4.91 121.20 128.13 3gh1 s ILE 354 Ca 0.32 -1.44 -0.13 0.00 0.00 0.00 0.00 60.65 59.39 3gh1 s ILE 354 Cb -0.13 -2.65 0.01 0.00 0.01 0.00 0.00 42.46 39.70 3gh1 s ILE 354 CO 0.17 -0.11 1.09 -1.61 0.00 0.00 0.00 174.94 174.48 3gh1 s GLU 355 N 1.22 2.76 0.48 2.79 2.02 -1.26 -4.91 118.70 121.80 3gh1 s GLU 355 Ca -0.06 1.21 0.18 0.00 0.02 0.00 0.00 54.97 56.33 3gh1 s GLU 355 Cb -0.20 -1.96 1.19 0.00 0.10 0.00 0.00 34.13 33.26 3gh1 s GLU 355 CO -0.02 -1.26 2.01 -1.35 0.02 0.00 0.00 175.26 174.67 3gh1 h PRO 356 N -0.37 0.20 -0.28 0.39 0.11 -1.99 0.38 132.00 130.45 3gh1 h PRO 356 Ca -0.45 -0.01 0.08 0.00 0.11 0.00 0.00 66.00 65.73 3gh1 h PRO 356 Cb 1.23 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 3gh1 h PRO 356 CO 0.54 0.13 0.23 1.49 -0.21 0.00 0.00 178.00 180.19 3gh1 h GLU 357 N 0.21 0.00 0.00 1.05 4.57 -1.96 0.15 114.58 118.60 3gh1 h GLU 357 Ca 0.22 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.40 3gh1 h GLU 357 Cb 0.61 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.20 3gh1 h GLU 357 CO -0.04 0.00 -0.46 1.19 -1.18 0.00 0.00 179.01 178.52 3gh1 n PHE 358 N -4.20 0.32 -0.07 0.92 3.72 0.12 -4.29 117.46 113.98 3gh1 n PHE 358 Ca 0.04 0.09 -0.05 0.00 -0.05 0.00 0.00 57.45 57.49 3gh1 n PHE 358 Cb 0.39 -0.52 -0.14 0.00 -0.94 0.00 0.00 39.48 38.27 3gh1 n PHE 358 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3gh1 n GLN 359 N -1.84 0.98 -1.85 -1.08 6.02 0.32 -4.96 117.38 114.97 3gh1 n GLN 359 Ca 0.05 -0.05 -0.42 0.00 -0.01 0.00 0.00 57.00 56.57 3gh1 n GLN 359 Cb 0.39 -1.46 -0.03 0.00 1.02 0.00 0.00 30.24 30.17 3gh1 n GLN 359 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 3gh1 s LEU 360 N -5.09 4.38 0.24 1.08 2.96 0.01 -4.88 118.68 117.38 3gh1 s LEU 360 Ca -0.08 2.44 -0.31 0.00 -0.22 0.00 0.00 54.13 55.96 3gh1 s LEU 360 Cb 0.07 -3.53 -0.11 0.00 0.50 0.00 0.00 46.19 43.12 3gh1 s LEU 360 CO 0.74 -0.99 1.55 -2.84 -1.32 0.00 0.00 176.35 173.50 3gh1 s PRO 361 N 4.24 4.19 -0.23 0.98 0.02 -1.26 -4.96 135.00 137.98 3gh1 s PRO 361 Ca 0.80 2.44 -0.07 0.00 0.02 0.00 0.00 61.00 64.20 3gh1 s PRO 361 Cb -0.38 -3.08 -0.03 0.00 0.02 0.00 0.00 34.50 31.03 3gh1 s PRO 361 CO 0.35 -0.57 0.07 0.12 -0.33 0.00 0.00 177.00 176.64 3gh1 s PHE 362 N 0.36 3.13 -0.49 6.54 5.36 -1.26 -5.07 117.98 126.55 3gh1 s PHE 362 Ca 0.65 -0.24 -0.13 0.00 -0.96 0.00 0.00 56.93 56.25 3gh1 s PHE 362 Cb -0.45 -2.18 0.11 0.00 -0.34 0.00 0.00 43.02 40.16 3gh1 s PHE 362 CO 0.41 -0.18 0.39 -1.21 -1.46 0.00 0.00 175.22 173.17 3gh1 s GLU 363 N 1.18 2.75 -0.02 10.12 0.41 -1.26 -5.03 118.70 126.85 3gh1 s GLU 363 Ca 0.04 -1.63 -0.30 0.00 -0.41 0.00 0.00 54.97 52.67 3gh1 s GLU 363 Cb -0.14 -4.07 -0.04 0.00 -1.78 0.00 0.00 34.13 28.10 3gh1 s GLU 363 CO 0.03 -1.18 1.25 -2.14 -0.49 0.00 0.00 175.26 172.74 3gh1 s PRO 364 N 1.50 4.35 0.37 0.39 0.02 -1.26 -4.75 135.00 135.62 3gh1 s PRO 364 Ca 0.04 1.76 -0.06 0.00 0.02 0.00 0.00 61.00 62.77 3gh1 s PRO 364 Cb -0.27 -3.52 0.02 0.00 0.02 0.00 0.00 34.50 30.75 3gh1 s PRO 364 CO 0.02 -0.45 0.57 0.54 -0.33 0.00 0.00 177.00 177.36 3gh1 s ASN 365 N 1.50 0.75 0.42 2.53 2.20 -1.26 -4.84 114.94 116.24 3gh1 s ASN 365 Ca 0.58 -1.43 0.09 0.00 -0.94 0.00 0.00 52.86 51.16 3gh1 s ASN 365 Cb -0.27 0.73 0.90 0.00 -2.00 0.00 0.00 41.25 40.61 3gh1 s ASN 365 CO 0.24 -1.43 2.03 0.45 -2.94 0.00 0.00 177.10 175.44 3gh1 h HIS 366 N 2.06 0.35 0.10 1.54 3.86 -1.95 -2.87 115.15 118.24 3gh1 h HIS 366 Ca -0.29 -0.01 -0.19 0.00 -1.16 0.00 0.00 60.37 58.72 3gh1 h HIS 366 Cb 1.24 -0.11 0.02 0.00 1.06 0.00 0.00 27.41 29.62 3gh1 h HIS 366 CO 1.56 0.29 -0.81 1.49 0.86 0.00 0.00 177.93 181.33 3gh1 h GLU 367 N 0.36 0.36 -1.69 2.45 4.81 -1.96 -2.66 114.58 116.25 3gh1 h GLU 367 Ca 0.09 -0.53 0.00 0.00 -0.13 0.00 0.00 59.36 58.79 3gh1 h GLU 367 Cb 0.09 0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.65 3gh1 h GLU 367 CO -0.01 1.22 0.00 -1.13 -0.73 0.00 0.00 179.01 178.36 3gh1 n SER 368 N -4.12 1.55 0.00 1.04 3.41 -1.08 -1.35 113.62 113.08 3gh1 n SER 368 Ca -0.13 -1.06 0.00 0.00 -0.26 0.00 0.00 58.87 57.42 3gh1 n SER 368 Cb 0.80 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 3gh1 n SER 368 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gh1 n ALA 370 N 1.06 0.00 1.80 7.33 0.00 -1.01 -3.02 120.51 126.68 3gh1 n ALA 370 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.60 3gh1 n ALA 370 Cb 0.21 0.00 0.87 0.00 0.00 0.00 0.00 19.45 20.54 3gh1 n ALA 370 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3gh1 n ASN 371 N 0.00 0.05 -4.72 0.00 5.15 -0.46 -4.84 115.26 110.45 3gh1 n ASN 371 Ca 0.00 -0.75 -0.42 0.00 -0.60 0.00 0.00 54.58 52.81 3gh1 n ASN 371 Cb 0.00 -0.08 -0.03 0.00 -0.53 0.00 0.00 39.78 39.14 3gh1 n ASN 371 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3gh1 s LEU 372 N -2.18 4.38 -1.07 1.20 1.43 -1.17 -4.95 118.68 116.33 3gh1 s LEU 372 Ca 0.42 2.35 -0.19 0.00 -1.03 0.00 0.00 54.13 55.68 3gh1 s LEU 372 Cb 0.21 -3.59 0.11 0.00 0.03 0.00 0.00 46.19 42.95 3gh1 s LEU 372 CO 0.40 -0.65 1.36 -0.62 0.23 0.00 0.00 176.35 177.08 3gh1 s ASP 373 N 1.00 6.72 -0.87 2.29 2.15 -1.26 -4.83 116.67 121.87 3gh1 s ASP 373 Ca 0.64 -2.16 0.01 0.00 0.43 0.00 0.00 52.55 51.47 3gh1 s ASP 373 Cb -0.37 -2.47 0.29 0.00 -0.30 0.00 0.00 42.92 40.07 3gh1 s ASP 373 CO 0.31 -1.12 1.18 0.18 -0.17 0.00 0.00 175.17 175.55 3gh1 n LEU 374 N 7.22 5.32 -4.25 -1.34 4.77 -1.26 -4.84 117.00 122.62 3gh1 n LEU 374 Ca 0.33 -5.35 -0.25 0.00 -0.03 0.00 0.00 56.01 50.71 3gh1 n LEU 374 Cb 0.48 -0.98 -0.14 0.00 -2.33 0.00 0.00 43.42 40.45 3gh1 n LEU 374 CO 0.61 1.90 -0.51 -1.00 -1.33 0.00 0.00 177.39 177.06 3gh1 s HIS 375 N -2.81 1.74 -0.75 -1.77 3.76 -1.26 -1.40 115.29 112.80 3gh1 s HIS 375 Ca 0.36 -0.38 0.26 0.00 -0.15 0.00 0.00 55.06 55.15 3gh1 s HIS 375 Cb 0.11 -1.02 0.78 0.00 1.11 0.00 0.00 32.58 33.56 3gh1 s HIS 375 CO 0.03 0.11 1.72 1.28 -0.85 0.00 0.00 174.74 177.03 3gh1 n LEU 376 N 1.70 0.71 -3.99 0.89 4.77 -1.26 -4.21 117.00 115.61 3gh1 n LEU 376 Ca -0.18 0.51 -0.43 0.00 -0.03 0.00 0.00 56.01 55.88 3gh1 n LEU 376 Cb 0.53 -0.32 0.01 0.00 -2.33 0.00 0.00 43.42 41.31 3gh1 n LEU 376 CO 0.23 -0.14 1.64 -3.20 -1.33 0.00 0.00 177.39 174.59 3gh1 n ASN 377 N -2.15 5.46 -3.82 -1.43 5.15 -1.26 -4.89 115.26 112.31 3gh1 n ASN 377 Ca 0.05 -3.17 -0.07 0.00 -0.60 0.00 0.00 54.58 50.80 3gh1 n ASN 377 Cb 0.42 -1.43 -0.02 0.00 -0.53 0.00 0.00 39.78 38.22 3gh1 n ASN 377 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3gh1 s GLN 378 N -0.35 1.68 0.13 1.20 -2.07 -1.26 -5.13 119.66 113.86 3gh1 s GLN 378 Ca 0.37 -0.92 -0.35 0.00 -1.82 0.00 0.00 55.36 52.65 3gh1 s GLN 378 Cb 0.06 0.58 -0.16 0.00 -1.09 0.00 0.00 33.01 32.40 3gh1 s GLN 378 CO 0.03 -0.77 1.31 0.54 -1.32 0.00 0.00 175.29 175.07 3gh1 n ARG 379 N -0.46 1.32 0.14 9.60 1.74 -1.26 -4.81 116.66 122.93 3gh1 n ARG 379 Ca -0.05 0.47 0.18 0.00 -0.77 0.00 0.00 57.85 57.68 3gh1 n ARG 379 Cb 0.60 -2.08 0.77 0.00 -1.02 0.00 0.00 32.46 30.73 3gh1 n ARG 379 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3gh1 h PRO 380 N 4.25 0.00 -0.63 5.56 0.11 -1.92 -0.82 132.00 138.55 3gh1 h PRO 380 Ca -0.46 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.57 3gh1 h PRO 380 Cb 1.33 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.41 3gh1 h PRO 380 CO 0.76 0.00 0.07 0.93 -0.21 0.00 0.00 178.00 179.55 3gh1 h GLU 381 N 0.00 1.05 0.00 1.05 3.07 -1.88 -0.14 114.58 117.73 3gh1 h GLU 381 Ca 0.14 -0.29 -0.18 0.00 -0.50 0.00 0.00 59.36 58.53 3gh1 h GLU 381 Cb 0.69 -0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 28.46 3gh1 h GLU 381 CO -0.00 0.99 -0.85 0.28 -1.40 0.00 0.00 179.01 178.03 3gh1 h VAL 382 N 0.98 1.42 -0.35 3.13 2.07 -1.56 -0.15 116.25 121.78 3gh1 h VAL 382 Ca 0.19 -3.01 -0.01 0.00 0.82 0.00 0.00 66.70 64.68 3gh1 h VAL 382 Cb 0.47 2.70 -0.02 0.00 -1.52 0.00 0.00 31.29 32.92 3gh1 h VAL 382 CO 0.02 0.81 0.17 0.25 0.02 0.00 0.00 177.57 178.83 3gh1 h LEU 383 N 0.00 0.46 -0.45 2.57 5.85 -0.90 -1.58 115.31 121.26 3gh1 h LEU 383 Ca -0.01 -0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.59 3gh1 h LEU 383 Cb 1.65 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 42.53 3gh1 h LEU 383 CO 0.11 0.46 0.27 0.00 -0.34 0.00 0.00 178.44 178.94 3gh1 h ALA 384 N 1.02 0.57 -0.78 1.25 0.00 -0.75 -0.18 119.26 120.38 3gh1 h ALA 384 Ca 0.12 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.11 3gh1 h ALA 384 Cb 0.13 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 3gh1 h ALA 384 CO -0.01 -0.04 0.44 0.00 0.00 0.00 0.00 179.25 179.63 3gh1 h ALA 385 N 1.19 1.10 -0.38 0.00 0.00 -0.89 0.67 119.26 120.95 3gh1 h ALA 385 Ca 0.18 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 3gh1 h ALA 385 Cb -0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3gh1 h ALA 385 CO -0.07 0.07 -0.23 -0.91 0.00 0.00 0.00 179.25 178.10 3gh1 h ASN 386 N 0.74 0.87 -0.39 0.00 2.35 -0.81 -2.46 115.58 115.89 3gh1 h ASN 386 Ca 0.37 -0.42 -0.09 0.00 -0.55 0.00 0.00 56.30 55.61 3gh1 h ASN 386 Cb 0.33 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.44 3gh1 h ASN 386 CO -0.24 1.10 -0.07 -0.07 -1.65 0.00 0.00 177.43 176.50 3gh1 h LEU 387 N 0.64 0.80 -0.12 1.61 3.38 -0.74 -1.90 115.31 118.98 3gh1 h LEU 387 Ca 0.08 -0.23 0.05 0.00 0.09 0.00 0.00 57.88 57.87 3gh1 h LEU 387 Cb 0.80 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.27 3gh1 h LEU 387 CO 0.07 0.91 -0.30 -0.09 0.09 0.00 0.00 178.44 179.11 3gh1 h ARG 388 N 0.75 -0.37 -0.92 1.13 1.12 -0.80 -0.69 114.38 114.60 3gh1 h ARG 388 Ca 0.13 0.02 0.05 0.00 -1.11 0.00 0.00 59.98 59.08 3gh1 h ARG 388 Cb 0.55 0.08 -0.06 0.00 -0.01 0.00 0.00 29.97 30.54 3gh1 h ARG 388 CO 0.03 -0.24 0.60 0.00 -3.11 0.00 0.00 179.97 177.25 3gh1 h ARG 389 N -0.38 1.06 -0.27 0.20 3.08 -1.33 -1.03 114.38 115.71 3gh1 h ARG 389 Ca 0.09 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 3gh1 h ARG 389 Cb 0.52 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 3gh1 h ARG 389 CO -0.33 0.70 0.01 0.00 -1.07 0.00 0.00 179.97 179.28 3gh1 h ALA 390 N 1.49 0.36 -0.58 0.04 0.00 -0.46 -1.60 119.26 118.50 3gh1 h ALA 390 Ca 0.39 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 3gh1 h ALA 390 Cb 0.13 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3gh1 h ALA 390 CO -0.14 0.08 0.14 0.74 0.00 0.00 0.00 179.25 180.07 3gh1 h PHE 391 N 0.26 0.94 -0.97 0.00 0.04 -1.01 -1.98 116.94 114.21 3gh1 h PHE 391 Ca 0.08 -0.09 0.16 0.00 2.80 0.00 0.00 57.97 60.91 3gh1 h PHE 391 Cb 0.40 -0.27 -0.10 0.00 2.20 0.00 0.00 35.95 38.18 3gh1 h PHE 391 CO 0.03 0.78 0.58 1.03 -0.60 0.00 0.00 178.31 180.14 3gh1 h SER 392 N 0.87 0.78 -0.29 2.17 0.87 -0.98 0.10 113.55 117.08 3gh1 h SER 392 Ca 0.19 0.08 -0.13 0.00 -1.23 0.00 0.00 61.79 60.70 3gh1 h SER 392 Cb 0.32 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.20 3gh1 h SER 392 CO -0.00 0.34 -0.27 1.23 -0.53 0.00 0.00 176.83 177.59 3gh1 h GLY 393 N 0.81 0.85 1.02 5.77 0.00 -0.53 0.23 103.07 111.23 3gh1 h GLY 393 Ca 0.53 -0.77 -0.04 0.00 0.00 0.00 0.00 47.33 47.05 3gh1 h GLY 393 CO -0.34 0.70 0.28 -2.08 0.00 0.00 0.00 176.54 175.10 3gh1 h VAL 394 N 0.67 1.25 -0.08 4.60 2.07 -1.10 0.39 116.25 124.05 3gh1 h VAL 394 Ca 0.08 -0.77 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 3gh1 h VAL 394 Cb 0.80 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 31.00 3gh1 h VAL 394 CO 0.07 0.31 0.04 0.58 0.02 0.00 0.00 177.57 178.59 3gh1 h VAL 395 N 1.01 1.10 -0.45 2.57 2.07 -0.48 -2.16 116.25 119.92 3gh1 h VAL 395 Ca 0.24 -0.29 0.04 0.00 0.82 0.00 0.00 66.70 67.50 3gh1 h VAL 395 Cb 0.21 1.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 3gh1 h VAL 395 CO -0.02 0.09 0.22 0.00 0.02 0.00 0.00 177.57 177.88 3gh1 h ALA 396 N 0.92 0.56 0.00 1.67 0.00 -0.13 -1.05 119.26 121.23 3gh1 h ALA 396 Ca 0.03 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3gh1 h ALA 396 Cb 0.11 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 3gh1 h ALA 396 CO -0.00 -0.14 -0.16 0.78 0.00 0.00 0.00 179.25 179.73 3gh1 h GLY 397 N 0.44 0.00 0.86 0.00 0.00 -0.16 -1.04 103.07 103.16 3gh1 h GLY 397 Ca 0.20 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 47.19 3gh1 h GLY 397 CO -0.14 0.00 -1.81 3.43 0.00 0.00 0.00 176.54 178.02 3gh1 h ASN 398 N 0.00 0.36 0.00 0.19 2.35 -0.89 -3.32 115.58 114.27 3gh1 h ASN 398 Ca -0.00 -0.68 0.00 0.00 -0.55 0.00 0.00 56.30 55.06 3gh1 h ASN 398 Cb 0.30 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.55 3gh1 h ASN 398 CO 0.02 1.60 -0.82 1.33 -1.65 0.00 0.00 177.43 177.91 3gh1 n VAL 399 N -3.41 0.00 -3.29 2.81 0.24 -0.44 -4.87 118.33 109.37 3gh1 n VAL 399 Ca -0.25 0.00 -0.38 0.00 -2.04 0.00 0.00 64.34 61.67 3gh1 n VAL 399 Cb 1.05 0.31 -0.06 0.00 -1.47 0.00 0.00 33.84 33.67 3gh1 n VAL 399 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 3gh1 s LYS 400 N -1.66 4.32 0.16 7.34 1.02 -0.41 -4.50 119.74 126.01 3gh1 s LYS 400 Ca 0.00 0.52 -0.26 0.00 0.02 0.00 0.00 55.97 56.25 3gh1 s LYS 400 Cb 0.00 -3.41 0.02 0.00 -0.52 0.00 0.00 37.83 33.92 3gh1 s LYS 400 CO 0.00 0.22 1.57 0.00 -0.92 0.00 0.00 175.35 176.22 3gh1 h ALA 401 N 6.44 -0.37 0.28 5.17 0.00 -1.84 0.57 119.26 129.51 3gh1 h ALA 401 Ca -0.42 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3gh1 h ALA 401 Cb 1.19 0.91 -0.02 0.00 0.00 0.00 0.00 17.79 19.86 3gh1 h ALA 401 CO 0.74 -0.84 -0.30 1.05 0.00 0.00 0.00 179.25 179.90 3gh1 h GLU 402 N -0.28 -0.59 -0.21 0.00 9.09 -1.93 -1.30 114.58 119.34 3gh1 h GLU 402 Ca 0.16 0.04 0.05 0.00 0.05 0.00 0.00 59.36 59.66 3gh1 h GLU 402 Cb 0.57 0.14 -0.05 0.00 -1.65 0.00 0.00 28.75 27.75 3gh1 h GLU 402 CO -0.62 -0.40 -0.13 0.78 0.05 0.00 0.00 179.01 178.69 3gh1 h GLY 403 N -0.62 0.03 -0.06 1.06 0.00 -1.49 -0.87 103.07 101.13 3gh1 h GLY 403 Ca -0.01 0.16 0.22 0.00 0.00 0.00 0.00 47.33 47.71 3gh1 h GLY 403 CO -0.07 -0.14 0.56 -2.22 0.00 0.00 0.00 176.54 174.66 3gh1 h ILE 404 N -0.12 0.58 -0.48 2.60 2.04 0.34 -0.56 117.51 121.92 3gh1 h ILE 404 Ca 0.12 -0.21 -0.02 0.00 1.00 0.00 0.00 64.86 65.75 3gh1 h ILE 404 Cb 0.30 -0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.29 3gh1 h ILE 404 CO -0.29 0.11 0.21 0.03 0.00 0.00 0.00 178.15 178.22 3gh1 h ARG 405 N 0.61 0.70 -0.98 2.37 -0.00 -0.02 -0.67 114.38 116.37 3gh1 h ARG 405 Ca 0.60 -0.11 0.11 0.00 -0.50 0.00 0.00 59.98 60.08 3gh1 h ARG 405 Cb 1.08 -0.12 -0.08 0.00 0.00 0.00 0.00 29.97 30.85 3gh1 h ARG 405 CO -0.45 0.60 0.62 0.93 0.00 0.00 0.00 179.97 181.68 3gh1 h GLU 406 N 0.63 0.95 -0.00 0.04 4.39 0.16 -1.52 114.58 119.22 3gh1 h GLU 406 Ca 0.16 -0.06 -0.25 0.00 0.34 0.00 0.00 59.36 59.56 3gh1 h GLU 406 Cb 0.15 -0.21 0.01 0.00 -0.10 0.00 0.00 28.75 28.60 3gh1 h GLU 406 CO -0.02 0.63 -0.99 0.82 -1.16 0.00 0.00 179.01 178.29 3gh1 h ILE 407 N 0.98 1.34 -0.93 3.13 2.04 -1.01 -1.14 117.51 121.92 3gh1 h ILE 407 Ca 0.48 -2.34 0.05 0.00 1.00 0.00 0.00 64.86 64.05 3gh1 h ILE 407 Cb 0.46 2.39 -0.06 0.00 -0.74 0.00 0.00 36.82 38.87 3gh1 h ILE 407 CO -0.24 0.71 0.60 -0.33 0.00 0.00 0.00 178.15 178.89 3gh1 h GLU 408 N 0.32 1.08 0.00 2.37 5.08 -0.77 0.80 114.58 123.47 3gh1 h GLU 408 Ca -0.10 -0.07 -0.14 0.00 -1.00 0.00 0.00 59.36 58.05 3gh1 h GLU 408 Cb 1.64 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 30.62 3gh1 h GLU 408 CO 0.18 0.72 -1.36 2.89 -1.00 0.00 0.00 179.01 180.44 3gh1 n ARG 409 N -4.53 0.62 0.00 2.33 1.85 -0.61 -4.57 116.66 111.75 3gh1 n ARG 409 Ca 0.13 0.20 0.00 0.00 -1.00 0.00 0.00 57.85 57.18 3gh1 n ARG 409 Cb 0.14 -1.81 0.00 0.00 -1.05 0.00 0.00 32.46 29.74 3gh1 n ARG 409 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 3gh1 n HIS 410 N -2.85 0.00 -3.64 2.89 8.25 -0.43 -5.11 115.22 114.33 3gh1 n HIS 410 Ca -0.08 -0.25 0.02 0.00 -0.26 0.00 0.00 57.72 57.15 3gh1 n HIS 410 Cb 0.79 -0.02 -0.00 0.00 1.12 0.00 0.00 29.99 31.87 3gh1 n HIS 410 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3gh1 n GLY 411 N -0.25 -1.74 3.74 -1.41 0.00 0.27 -4.91 105.19 100.89 3gh1 n GLY 411 Ca 0.00 -1.28 -0.36 0.00 0.00 0.00 0.00 46.02 44.38 3gh1 n GLY 411 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3gh1 s PRO 412 N -0.29 2.64 0.02 1.61 0.02 -1.26 -4.38 135.00 133.34 3gh1 s PRO 412 Ca 0.00 1.84 -0.30 0.00 0.02 0.00 0.00 61.00 62.56 3gh1 s PRO 412 Cb 0.00 -1.88 -0.08 0.00 0.02 0.00 0.00 34.50 32.56 3gh1 s PRO 412 CO 0.00 -1.47 1.81 -0.06 -0.33 0.00 0.00 177.00 176.95 3gh1 s PHE 413 N -1.69 1.71 0.79 6.54 2.99 0.41 -4.74 117.98 123.99 3gh1 s PHE 413 Ca 0.77 -0.12 -0.04 0.00 0.00 0.00 0.00 56.93 57.54 3gh1 s PHE 413 Cb -0.31 -4.10 0.15 0.00 0.00 0.00 0.00 43.02 38.77 3gh1 s PHE 413 CO 0.38 -4.74 1.09 -1.21 -0.00 0.00 0.00 175.22 170.73 3gh1 s GLU 414 N 3.98 1.35 0.00 0.44 2.02 -1.26 -1.56 118.70 123.67 3gh1 s GLU 414 Ca 0.81 -1.02 0.00 0.00 0.02 0.00 0.00 54.97 54.78 3gh1 s GLU 414 Cb -0.39 -2.21 0.00 0.00 0.10 0.00 0.00 34.13 31.62 3gh1 s GLU 414 CO 0.36 -1.74 0.00 -2.39 0.02 0.00 0.00 175.26 171.51 3gh1 n HIS 416 N -3.08 0.00 -2.55 1.61 1.44 -1.26 -3.58 115.22 107.80 3gh1 n HIS 416 Ca 0.16 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.87 3gh1 n HIS 416 Cb 0.60 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.71 3gh1 n HIS 416 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3gh1 n GLY 417 N -0.39 -0.57 3.63 -1.39 0.00 -1.26 -4.36 105.19 100.84 3gh1 n GLY 417 Ca 0.00 -0.71 -0.54 0.00 0.00 0.00 0.00 46.02 44.77 3gh1 n GLY 417 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3gh1 n ASP 418 N 0.00 1.91 0.25 1.61 9.92 -0.49 -4.88 116.55 124.87 3gh1 n ASP 418 Ca 0.00 1.10 0.09 0.00 -0.53 0.00 0.00 54.79 55.45 3gh1 n ASP 418 Cb 0.00 -1.18 0.65 0.00 -0.64 0.00 0.00 41.12 39.95 3gh1 n ASP 418 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 3gh1 h PRO 419 N 5.44 0.00 0.17 -0.24 0.13 -1.97 -2.24 132.00 133.29 3gh1 h PRO 419 Ca -0.47 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 3gh1 h PRO 419 Cb 1.33 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.46 3gh1 h PRO 419 CO 0.84 0.07 -0.10 0.28 -0.23 0.00 0.00 178.00 178.85 3gh1 h VAL 420 N 0.00 0.78 0.00 1.56 2.07 -1.99 -2.20 116.25 116.47 3gh1 h VAL 420 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3gh1 h VAL 420 Cb 0.14 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 3gh1 h VAL 420 CO 0.01 0.00 0.00 -0.11 0.02 0.00 0.00 177.57 177.49 3gh1 n LEU 421 N -5.22 0.61 0.00 2.57 7.94 -0.84 -3.14 117.00 118.92 3gh1 n LEU 421 Ca -0.08 -0.31 0.00 0.00 -1.11 0.00 0.00 56.01 54.51 3gh1 n LEU 421 Cb 0.14 -0.14 0.00 0.00 0.53 0.00 0.00 43.42 43.94 3gh1 n LEU 421 CO 0.33 0.11 0.00 1.17 -1.11 0.00 0.00 177.39 177.90 3gh1 n LYS 423 N 0.63 0.00 0.00 1.96 3.00 -0.83 -4.57 118.16 118.35 3gh1 n LYS 423 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 3gh1 n LYS 423 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.14 3gh1 n LYS 423 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 3gh1 n LYS 424 N 0.00 0.31 0.00 1.64 4.76 -1.19 -1.29 118.16 122.40 3gh1 n LYS 424 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 3gh1 n LYS 424 Cb 0.00 -1.16 0.00 0.00 -1.84 0.00 0.00 35.03 32.03 3gh1 n LYS 424 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 3gh1 n ASP 426 N 0.36 0.00 0.30 4.39 2.03 -1.26 -0.85 116.55 121.52 3gh1 n ASP 426 Ca 0.00 0.00 -0.17 0.00 0.52 0.00 0.00 54.79 55.14 3gh1 n ASP 426 Cb 0.08 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.40 3gh1 n ASP 426 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 3gh1 h GLN 427 N 0.00 -0.70 -0.42 -0.67 5.75 -1.58 -0.09 115.11 117.39 3gh1 h GLN 427 Ca 0.00 0.05 0.09 0.00 -0.15 0.00 0.00 58.65 58.63 3gh1 h GLN 427 Cb 0.00 0.16 -0.09 0.00 1.07 0.00 0.00 27.48 28.62 3gh1 h GLN 427 CO 0.00 -0.47 -0.28 1.25 -2.65 0.00 0.00 178.83 176.69 3gh1 h LEU 428 N -0.73 -0.93 -0.98 -2.39 5.85 -1.25 0.17 115.31 115.05 3gh1 h LEU 428 Ca -0.07 0.18 0.08 0.00 0.84 0.00 0.00 57.88 58.91 3gh1 h LEU 428 Cb 0.56 0.46 -0.07 0.00 0.37 0.00 0.00 40.66 41.98 3gh1 h LEU 428 CO 0.11 -0.29 0.62 -0.07 -0.34 0.00 0.00 178.44 178.48 3gh1 h LEU 429 N -0.20 0.97 -0.49 2.25 3.38 -1.80 -0.56 115.31 118.86 3gh1 h LEU 429 Ca 0.19 0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.21 3gh1 h LEU 429 Cb 0.50 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 3gh1 h LEU 429 CO -0.54 0.59 0.28 0.78 0.09 0.00 0.00 178.44 179.65 3gh1 h ASN 430 N 1.09 0.45 -0.75 -0.43 2.35 0.58 -2.11 115.58 116.76 3gh1 h ASN 430 Ca 0.44 0.01 0.08 0.00 -0.55 0.00 0.00 56.30 56.28 3gh1 h ASN 430 Cb 0.27 -0.08 -0.06 0.00 0.05 0.00 0.00 38.32 38.49 3gh1 h ASN 430 CO -0.20 0.32 0.42 0.44 -1.65 0.00 0.00 177.43 176.76 3gh1 h ASP 431 N 0.57 0.61 -0.85 5.81 3.32 -0.19 -0.98 116.42 124.71 3gh1 h ASP 431 Ca 0.20 0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.31 3gh1 h ASP 431 Cb 0.04 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.47 3gh1 h ASP 431 CO -0.10 0.37 0.56 -0.26 -1.72 0.00 0.00 179.24 178.09 3gh1 h PHE 432 N 0.74 1.07 0.03 4.55 0.04 -0.64 0.53 116.94 123.26 3gh1 h PHE 432 Ca 0.35 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 61.14 3gh1 h PHE 432 Cb 0.28 -0.36 0.00 0.00 2.20 0.00 0.00 35.95 38.07 3gh1 h PHE 432 CO -0.07 0.66 -0.01 0.28 -0.60 0.00 0.00 178.31 178.56 3gh1 h VAL 433 N 1.14 1.19 0.00 -0.55 2.07 -1.00 0.24 116.25 119.35 3gh1 h VAL 433 Ca 0.32 -0.71 -0.03 0.00 0.82 0.00 0.00 66.70 67.11 3gh1 h VAL 433 Cb -0.11 1.67 -0.00 0.00 -1.52 0.00 0.00 31.29 31.32 3gh1 h VAL 433 CO -0.08 0.18 -0.12 0.00 0.02 0.00 0.00 177.57 177.57 3gh1 h ALA 434 N 0.61 1.54 -0.28 1.67 0.00 -1.02 -1.89 119.26 119.89 3gh1 h ALA 434 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3gh1 h ALA 434 Cb 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3gh1 h ALA 434 CO 0.01 0.15 0.00 1.04 0.00 0.00 0.00 179.25 180.45 3gh1 n GLN 435 N -4.02 1.82 -3.30 0.00 6.02 0.16 -4.93 117.38 113.13 3gh1 n GLN 435 Ca -0.02 -1.25 -0.22 0.00 -0.01 0.00 0.00 57.00 55.50 3gh1 n GLN 435 Cb 0.21 -1.34 0.06 0.00 1.02 0.00 0.00 30.24 30.19 3gh1 n GLN 435 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3gh1 n ASN 436 N 0.49 -5.98 -2.46 1.08 3.02 -0.71 -4.94 115.26 105.76 3gh1 n ASN 436 Ca 0.14 -0.41 -0.30 0.00 -0.03 0.00 0.00 54.58 53.99 3gh1 n ASN 436 Cb 0.33 -4.68 0.01 0.00 -0.61 0.00 0.00 39.78 34.83 3gh1 n ASN 436 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3gh1 n ARG 437 N -4.34 2.43 -0.36 3.52 1.74 0.05 -4.71 116.66 114.99 3gh1 n ARG 437 Ca -0.04 -2.67 -0.14 0.00 -0.77 0.00 0.00 57.85 54.23 3gh1 n ARG 437 Cb 0.58 -2.10 -0.02 0.00 -1.02 0.00 0.00 32.46 29.90 3gh1 n ARG 437 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 3gh1 n LYS 439 N 0.07 0.00 -2.17 5.56 4.81 -1.26 -4.56 118.16 120.61 3gh1 n LYS 439 Ca 0.49 0.00 -0.37 0.00 -0.87 0.00 0.00 58.31 57.57 3gh1 n LYS 439 Cb 0.49 -0.34 0.01 0.00 0.02 0.00 0.00 35.03 35.21 3gh1 n LYS 439 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 3gh1 s LEU 440 N 0.17 3.87 0.75 3.14 1.43 -1.26 -4.97 118.68 121.80 3gh1 s LEU 440 Ca 0.21 2.34 -0.14 0.00 -1.03 0.00 0.00 54.13 55.50 3gh1 s LEU 440 Cb -0.29 -4.39 0.05 0.00 0.03 0.00 0.00 46.19 41.59 3gh1 s LEU 440 CO 0.14 -1.17 1.18 -2.16 0.23 0.00 0.00 176.35 174.57 3gh1 s PRO 441 N -2.97 2.09 0.00 1.29 0.04 -1.26 -4.66 135.00 129.53 3gh1 s PRO 441 Ca 0.69 1.66 0.00 0.00 0.04 0.00 0.00 61.00 63.39 3gh1 s PRO 441 Cb -0.29 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.41 3gh1 s PRO 441 CO 0.34 -1.85 0.00 0.41 0.04 0.00 0.00 177.00 175.94 3gh1 n GLY 442 N 0.18 1.75 0.00 0.56 0.00 -1.26 -4.97 105.19 101.45 3gh1 n GLY 442 Ca 0.13 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.90 3gh1 n GLY 442 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gh1 n GLY 443 N 0.00 -0.73 0.00 -0.02 0.00 -1.26 -5.09 105.19 98.09 3gh1 n GLY 443 Ca 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.81 3gh1 n GLY 443 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3gh1 n SER 444 N 0.00 0.00 -4.68 1.61 3.41 -1.26 -5.05 113.62 107.64 3gh1 n SER 444 Ca 0.00 -0.83 -0.40 0.00 -0.26 0.00 0.00 58.87 57.38 3gh1 n SER 444 Cb 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 63.97 3gh1 n SER 444 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gh1 n ALA 445 N -3.00 1.05 -2.01 7.33 0.00 -1.26 -4.92 120.51 117.70 3gh1 n ALA 445 Ca 0.00 0.20 -0.42 0.00 0.00 0.00 0.00 53.44 53.22 3gh1 n ALA 445 Cb 0.00 -2.24 -0.03 0.00 0.00 0.00 0.00 19.45 17.19 3gh1 n ALA 445 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3gh1 s TYR 446 N -1.26 2.64 -0.36 0.00 6.14 -1.26 -5.01 117.35 118.24 3gh1 s TYR 446 Ca 0.65 0.50 -0.11 0.00 0.64 0.00 0.00 57.07 58.75 3gh1 s TYR 446 Cb -0.49 -3.88 0.01 0.00 0.42 0.00 0.00 41.96 38.03 3gh1 s TYR 446 CO 0.55 -3.42 0.21 -1.83 0.64 0.00 0.00 175.55 171.70 3gh1 s GLU 447 N 2.30 3.06 0.04 4.97 -1.05 -1.26 -5.07 118.70 121.70 3gh1 s GLU 447 Ca 0.71 -0.93 -0.38 0.00 -0.15 0.00 0.00 54.97 54.23 3gh1 s GLU 447 Cb -0.38 -3.73 -0.17 0.00 -0.44 0.00 0.00 34.13 29.41 3gh1 s GLU 447 CO 0.31 -0.60 1.34 -2.30 0.95 0.00 0.00 175.26 174.95 3gh1 n PRO 448 N 5.03 0.99 -0.22 -4.83 -0.02 -1.26 -4.89 135.00 129.79 3gh1 n PRO 448 Ca -0.12 0.36 0.08 0.00 -2.02 0.00 0.00 63.50 61.80 3gh1 n PRO 448 Cb 0.47 -1.98 0.23 0.00 -0.02 0.00 0.00 33.50 32.20 3gh1 n PRO 448 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3gh1 s TYR 450 N -1.41 1.56 -0.09 0.00 1.13 -1.26 -0.44 117.35 116.84 3gh1 s TYR 450 Ca 0.33 -0.63 -0.04 0.00 -1.41 0.00 0.00 57.07 55.32 3gh1 s TYR 450 Cb 0.17 -0.75 0.04 0.00 -1.10 0.00 0.00 41.96 40.33 3gh1 s TYR 450 CO 0.23 0.27 0.20 0.21 -2.51 0.00 0.00 175.55 173.95 3gh1 s LYS 451 N -3.64 0.14 -0.34 -3.49 2.20 -0.60 -4.81 119.74 109.20 3gh1 s LYS 451 Ca 0.20 0.48 -0.13 0.00 -0.36 0.00 0.00 55.97 56.17 3gh1 s LYS 451 Cb 0.00 -0.15 -0.02 0.00 -1.51 0.00 0.00 37.83 36.15 3gh1 s LYS 451 CO 0.05 -0.18 0.24 0.42 -0.36 0.00 0.00 175.35 175.51 3gh1 s ILE 452 N 1.37 5.29 0.21 5.43 1.01 -1.26 -4.25 121.20 129.00 3gh1 s ILE 452 Ca -0.08 -0.19 0.04 0.00 0.00 0.00 0.00 60.65 60.43 3gh1 s ILE 452 Cb -0.11 -3.70 -0.03 0.00 0.01 0.00 0.00 42.46 38.62 3gh1 s ILE 452 CO -0.07 0.01 0.33 -0.69 0.00 0.00 0.00 174.94 174.51 3gh1 s VAL 453 N 1.73 5.24 0.69 2.92 1.01 -1.26 -5.02 120.40 125.70 3gh1 s VAL 453 Ca 0.06 -0.92 -0.12 0.00 0.00 0.00 0.00 61.98 61.01 3gh1 s VAL 453 Cb -0.17 -3.80 0.18 0.00 0.00 0.00 0.00 36.38 32.58 3gh1 s VAL 453 CO 0.11 -0.26 0.47 0.35 0.00 0.00 0.00 175.10 175.77 3gh1 n THR 454 N -1.13 0.00 -1.32 3.92 -2.24 -1.26 -4.40 114.28 107.86 3gh1 n THR 454 Ca -0.08 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 3gh1 n THR 454 Cb 0.56 -0.72 0.00 0.00 -2.10 0.00 0.00 70.33 68.07 3gh1 n THR 454 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 3gh1 n HIS 459 N -4.15 0.00 0.00 4.78 -0.00 -1.26 -4.92 115.22 109.67 3gh1 n HIS 459 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.79 3gh1 n HIS 459 Cb 0.30 0.02 0.00 0.00 -0.00 0.00 0.00 29.99 30.31 3gh1 n HIS 459 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 3gh1 n HIS 460 N 0.00 0.00 0.00 1.57 8.25 -1.26 -4.67 115.22 119.12 3gh1 n HIS 460 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3gh1 n HIS 460 Cb 0.28 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.39 3gh1 n HIS 460 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3gh1 n HIS 461 N 0.00 0.00 0.68 4.41 8.25 -1.26 -5.43 115.22 121.87 3gh1 n HIS 461 Ca 0.00 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.51 3gh1 n HIS 461 Cb 0.00 0.00 0.32 0.00 1.12 0.00 0.00 29.99 31.43 3gh1 n HIS 461 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59