#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x2g n THR 2 N 0.00 0.00 -4.92 0.44 -2.24 -1.26 -4.98 114.28 101.32 1x2g n THR 2 Ca 0.00 -0.40 -0.31 0.00 -2.27 0.00 0.00 64.05 61.07 1x2g n THR 2 Cb 0.00 1.14 -0.14 0.00 -2.10 0.00 0.00 70.33 69.23 1x2g n THR 2 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1x2g s LEU 3 N -2.05 2.42 -0.06 3.22 1.43 -1.26 -0.29 118.68 122.09 1x2g s LEU 3 Ca 0.30 -0.41 0.06 0.00 -1.03 0.00 0.00 54.13 53.05 1x2g s LEU 3 Cb 0.20 -1.44 -0.01 0.00 0.03 0.00 0.00 46.19 44.97 1x2g s LEU 3 CO 0.33 0.29 -0.24 -0.13 0.23 0.00 0.00 176.35 176.84 1x2g s ARG 4 N -1.03 2.51 -0.22 1.70 1.81 0.05 -4.89 118.95 118.87 1x2g s ARG 4 Ca 0.12 -0.88 0.01 0.00 -1.72 0.00 0.00 55.73 53.27 1x2g s ARG 4 Cb -0.10 -2.11 0.05 0.00 -0.45 0.00 0.00 34.95 32.34 1x2g s ARG 4 CO 0.02 0.36 -0.09 -1.17 -0.68 0.00 0.00 175.30 173.73 1x2g s LEU 5 N -0.11 2.58 -0.12 2.53 2.96 -1.26 -0.96 118.68 124.29 1x2g s LEU 5 Ca -0.05 -1.06 -0.01 0.00 -0.22 0.00 0.00 54.13 52.79 1x2g s LEU 5 Cb -0.14 -1.28 -0.02 0.00 0.50 0.00 0.00 46.19 45.25 1x2g s LEU 5 CO 0.04 -0.18 -0.09 -0.76 -1.32 0.00 0.00 176.35 174.05 1x2g s LEU 6 N 1.34 3.00 -0.16 -0.68 1.43 0.16 -1.09 118.68 122.67 1x2g s LEU 6 Ca -0.04 -0.19 -0.00 0.00 -1.03 0.00 0.00 54.13 52.87 1x2g s LEU 6 Cb -0.18 -1.69 0.04 0.00 0.03 0.00 0.00 46.19 44.40 1x2g s LEU 6 CO -0.07 0.21 -0.07 -0.63 0.23 0.00 0.00 176.35 176.02 1x2g s ILE 7 N 0.10 1.22 -0.09 -0.59 -1.09 -0.47 -1.06 121.20 119.22 1x2g s ILE 7 Ca -0.03 -0.65 -0.26 0.00 -2.23 0.00 0.00 60.65 57.47 1x2g s ILE 7 Cb -0.14 -1.34 -0.03 0.00 -1.58 0.00 0.00 42.46 39.37 1x2g s ILE 7 CO 0.04 0.19 0.84 -0.55 -1.23 0.00 0.00 174.94 174.22 1x2g s SER 8 N 1.59 7.09 -0.13 3.58 0.15 -0.45 -1.19 113.70 124.35 1x2g s SER 8 Ca 0.01 1.33 0.16 0.00 0.70 0.00 0.00 55.95 58.14 1x2g s SER 8 Cb -0.15 -2.48 0.67 0.00 -1.71 0.00 0.00 66.02 62.36 1x2g s SER 8 CO -0.08 -0.28 1.56 -0.67 1.20 0.00 0.00 173.24 174.98 1x2g n ASP 9 N 4.41 4.55 -4.42 5.45 2.03 0.23 -4.71 116.55 124.08 1x2g n ASP 9 Ca 0.03 -2.49 -0.31 0.00 0.52 0.00 0.00 54.79 52.54 1x2g n ASP 9 Cb 0.50 -0.58 -0.14 0.00 -0.72 0.00 0.00 41.12 40.19 1x2g n ASP 9 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1x2g s SER 10 N -0.82 3.64 0.00 1.67 0.15 -1.26 -4.95 113.70 112.14 1x2g s SER 10 Ca 0.47 -0.40 0.14 0.00 0.70 0.00 0.00 55.95 56.86 1x2g s SER 10 Cb 0.31 -0.58 0.42 0.00 -1.71 0.00 0.00 66.02 64.47 1x2g s SER 10 CO 0.21 0.29 1.34 -1.22 1.20 0.00 0.00 173.24 175.06 1x2g n TYR 11 N 1.91 0.54 -2.49 3.44 4.01 -1.26 -4.58 117.16 118.73 1x2g n TYR 11 Ca -0.16 -0.27 -0.43 0.00 -0.16 0.00 0.00 57.90 56.87 1x2g n TYR 11 Cb 0.52 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.53 1x2g n TYR 11 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1x2g s ASP 12 N -1.07 6.71 0.51 7.72 -1.08 -1.26 -1.70 116.67 126.51 1x2g s ASP 12 Ca 0.30 1.07 0.30 0.00 -0.52 0.00 0.00 52.55 53.69 1x2g s ASP 12 Cb 0.16 -2.54 1.28 0.00 -1.46 0.00 0.00 42.92 40.35 1x2g s ASP 12 CO 0.21 -1.07 1.96 1.55 0.52 0.00 0.00 175.17 178.34 1x2g h PRO 13 N 9.06 0.00 0.21 4.34 0.13 -1.90 -0.65 132.00 143.20 1x2g h PRO 13 Ca -0.24 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.57 1x2g h PRO 13 Cb 1.08 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.25 1x2g h PRO 13 CO 1.05 0.10 -1.40 -1.49 -0.23 0.00 0.00 178.00 176.03 1x2g h TRP 14 N 0.00 0.92 0.22 1.56 6.55 -1.91 -0.73 115.95 122.57 1x2g h TRP 14 Ca -0.00 -0.65 -0.01 0.00 0.95 0.00 0.00 58.89 59.18 1x2g h TRP 14 Cb 0.54 -0.05 0.00 0.00 -0.86 0.00 0.00 29.16 28.80 1x2g h TRP 14 CO 0.00 1.50 -0.11 0.35 -1.05 0.00 0.00 178.44 179.14 1x2g h PHE 15 N 0.17 -0.27 -0.62 0.49 3.57 -1.86 -0.55 116.94 117.86 1x2g h PHE 15 Ca -0.22 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.26 1x2g h PHE 15 Cb 2.09 0.09 -0.03 0.00 2.79 0.00 0.00 35.95 40.89 1x2g h PHE 15 CO 0.12 -0.14 0.33 -0.91 -2.23 0.00 0.00 178.31 175.48 1x2g h ASN 16 N -0.33 0.77 0.51 0.41 2.35 -1.15 -1.72 115.58 116.41 1x2g h ASN 16 Ca -0.03 -0.06 -0.17 0.00 -0.55 0.00 0.00 56.30 55.49 1x2g h ASN 16 Cb 0.26 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 1x2g h ASN 16 CO 0.05 0.62 -0.75 -0.07 -1.65 0.00 0.00 177.43 175.63 1x2g h LEU 17 N 0.87 0.24 -0.57 1.61 3.38 -1.03 -2.61 115.31 117.20 1x2g h LEU 17 Ca 0.22 -0.17 -0.12 0.00 0.09 0.00 0.00 57.88 57.90 1x2g h LEU 17 Cb 0.03 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1x2g h LEU 17 CO -0.04 0.90 -0.16 0.00 0.09 0.00 0.00 178.44 179.24 1x2g h ALA 18 N 1.09 0.76 -0.05 1.53 0.00 -0.69 0.07 119.26 121.98 1x2g h ALA 18 Ca -0.03 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 54.53 1x2g h ALA 18 Cb 1.33 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1x2g h ALA 18 CO 0.11 0.67 -0.07 0.28 0.00 0.00 0.00 179.25 180.25 1x2g h VAL 19 N 0.86 0.82 -0.83 0.00 2.07 -1.24 -0.73 116.25 117.19 1x2g h VAL 19 Ca 0.12 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.80 1x2g h VAL 19 Cb 0.73 0.82 -0.10 0.00 -1.52 0.00 0.00 31.29 31.22 1x2g h VAL 19 CO 0.06 0.00 0.40 -0.33 0.02 0.00 0.00 177.57 177.72 1x2g h GLU 20 N -0.09 0.54 -0.71 1.57 5.08 -1.19 0.37 114.58 120.15 1x2g h GLU 20 Ca 0.04 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.33 1x2g h GLU 20 Cb 0.15 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 1x2g h GLU 20 CO -0.10 0.36 0.27 1.49 -1.00 0.00 0.00 179.01 180.03 1x2g h GLU 21 N 0.56 1.06 -0.59 2.33 4.57 -0.58 -1.58 114.58 120.36 1x2g h GLU 21 Ca 0.46 -0.19 -0.07 0.00 -1.18 0.00 0.00 59.36 58.38 1x2g h GLU 21 Cb 0.68 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 29.08 1x2g h GLU 21 CO -0.39 0.87 0.08 0.00 -1.18 0.00 0.00 179.01 178.39 1x2g h ILE 23 N 0.89 0.97 -0.27 0.00 2.04 -0.82 0.37 117.51 120.68 1x2g h ILE 23 Ca 0.18 -0.20 -0.19 0.00 1.00 0.00 0.00 64.86 65.65 1x2g h ILE 23 Cb 0.45 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 36.86 1x2g h ILE 23 CO 0.01 0.11 -0.57 0.15 0.00 0.00 0.00 178.15 177.85 1x2g h PHE 24 N 0.58 1.08 0.00 1.37 3.57 -1.20 -3.40 116.94 118.94 1x2g h PHE 24 Ca 0.25 -0.39 0.00 0.00 3.53 0.00 0.00 57.97 61.36 1x2g h PHE 24 Cb 0.14 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 38.68 1x2g h PHE 24 CO -0.09 1.22 -0.53 2.89 -2.23 0.00 0.00 178.31 179.57 1x2g n ARG 25 N -4.00 2.56 -1.03 1.11 1.85 -0.72 -5.06 116.66 111.37 1x2g n ARG 25 Ca -0.05 0.00 -0.07 0.00 -1.00 0.00 0.00 57.85 56.74 1x2g n ARG 25 Cb 0.64 -0.73 0.30 0.00 -1.05 0.00 0.00 32.46 31.62 1x2g n ARG 25 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1x2g n GLN 26 N -0.96 3.68 -4.42 2.89 1.13 0.13 -5.04 117.38 114.79 1x2g n GLN 26 Ca 0.00 -3.04 -0.34 0.00 -1.94 0.00 0.00 57.00 51.68 1x2g n GLN 26 Cb 0.00 -2.22 -0.10 0.00 0.11 0.00 0.00 30.24 28.04 1x2g n GLN 26 CO 0.00 0.00 0.00 -2.14 -1.44 0.00 0.00 177.06 173.48 1x2g s PRO 28 N -2.97 2.86 0.00 -1.09 0.02 -1.26 -4.77 135.00 127.79 1x2g s PRO 28 Ca 0.55 -0.50 0.00 0.00 0.02 0.00 0.00 61.00 61.06 1x2g s PRO 28 Cb 0.44 -2.70 0.00 0.00 0.02 0.00 0.00 34.50 32.26 1x2g s PRO 28 CO 0.13 0.67 0.83 0.00 -0.33 0.00 0.00 177.00 178.30 1x2g n ALA 29 N 1.95 2.36 0.03 -1.55 0.00 -1.26 -3.89 120.51 118.15 1x2g n ALA 29 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1x2g n ALA 29 Cb 0.53 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.97 1x2g n ALA 29 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1x2g n THR 30 N 0.69 0.00 -4.52 0.00 5.66 -1.26 -2.79 114.28 112.06 1x2g n THR 30 Ca 0.00 -0.50 -0.25 0.00 -3.05 0.00 0.00 64.05 60.25 1x2g n THR 30 Cb 0.38 1.01 -0.09 0.00 -1.55 0.00 0.00 70.33 70.09 1x2g n THR 30 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 1x2g s GLN 31 N -0.21 1.87 -0.19 1.09 -0.21 -1.25 -5.00 119.66 115.76 1x2g s GLN 31 Ca 0.01 -2.12 -0.04 0.00 0.02 0.00 0.00 55.36 53.23 1x2g s GLN 31 Cb 0.01 -0.82 -0.02 0.00 1.00 0.00 0.00 33.01 33.17 1x2g s GLN 31 CO 0.01 -0.36 -0.02 1.03 -2.12 0.00 0.00 175.29 173.83 1x2g s ARG 32 N -3.79 3.60 -0.11 2.91 3.00 0.60 -4.33 118.95 120.83 1x2g s ARG 32 Ca 0.26 -0.53 0.01 0.00 0.00 0.00 0.00 55.73 55.46 1x2g s ARG 32 Cb 0.05 -3.02 -0.02 0.00 0.00 0.00 0.00 34.95 31.96 1x2g s ARG 32 CO 0.13 0.05 -0.14 0.08 0.00 0.00 0.00 175.30 175.43 1x2g s VAL 33 N 0.88 3.00 -0.09 3.52 1.01 -1.26 -0.77 120.40 126.69 1x2g s VAL 33 Ca 0.00 -0.69 0.03 0.00 0.00 0.00 0.00 61.98 61.32 1x2g s VAL 33 Cb -0.14 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 34.00 1x2g s VAL 33 CO 0.02 0.54 -0.20 -0.22 0.00 0.00 0.00 175.10 175.24 1x2g s LEU 34 N 0.15 1.94 -0.08 3.92 2.96 -0.14 -4.17 118.68 123.27 1x2g s LEU 34 Ca -0.07 -0.47 0.03 0.00 -0.22 0.00 0.00 54.13 53.40 1x2g s LEU 34 Cb -0.15 -1.22 0.01 0.00 0.50 0.00 0.00 46.19 45.33 1x2g s LEU 34 CO 0.05 0.12 -0.17 0.12 -1.32 0.00 0.00 176.35 175.14 1x2g s PHE 35 N 0.46 1.92 -0.08 5.38 5.36 0.71 -0.67 117.98 131.07 1x2g s PHE 35 Ca -0.17 -0.74 0.02 0.00 -0.96 0.00 0.00 56.93 55.08 1x2g s PHE 35 Cb -0.17 -1.34 0.01 0.00 -0.34 0.00 0.00 43.02 41.18 1x2g s PHE 35 CO 0.07 -0.32 -0.15 -0.51 -1.46 0.00 0.00 175.22 172.85 1x2g s LEU 36 N 0.48 1.72 0.23 6.12 1.43 -0.22 -0.44 118.68 128.01 1x2g s LEU 36 Ca -0.15 -0.37 -0.21 0.00 -1.03 0.00 0.00 54.13 52.36 1x2g s LEU 36 Cb -0.16 -0.98 0.04 0.00 0.03 0.00 0.00 46.19 45.12 1x2g s LEU 36 CO 0.06 0.05 0.66 -1.66 0.23 0.00 0.00 176.35 175.68 1x2g s TRP 37 N 0.71 -0.29 0.15 0.29 1.48 -0.66 -1.33 118.94 119.29 1x2g s TRP 37 Ca -0.13 -0.08 -0.11 0.00 -1.06 0.00 0.00 56.10 54.72 1x2g s TRP 37 Cb -0.16 0.63 0.00 0.00 -1.16 0.00 0.00 33.47 32.78 1x2g s TRP 37 CO 0.03 -1.08 0.33 -0.98 -4.06 0.00 0.00 176.95 171.19 1x2g s ARG 38 N -3.86 1.14 0.10 3.25 1.70 -1.26 -0.50 118.95 119.52 1x2g s ARG 38 Ca 0.08 -1.03 0.08 0.00 -0.47 0.00 0.00 55.73 54.39 1x2g s ARG 38 Cb -0.04 0.41 -0.04 0.00 -0.57 0.00 0.00 34.95 34.71 1x2g s ARG 38 CO -0.00 -0.43 -0.16 -0.80 -1.08 0.00 0.00 175.30 172.83 1x2g s ASN 39 N -2.92 4.00 1.03 -2.89 0.01 -1.26 -4.24 114.94 108.68 1x2g s ASN 39 Ca 0.12 -0.49 -0.16 0.00 -0.71 0.00 0.00 52.86 51.62 1x2g s ASN 39 Cb 0.03 -0.64 0.22 0.00 0.41 0.00 0.00 41.25 41.27 1x2g s ASN 39 CO -0.03 0.20 1.21 0.00 -1.51 0.00 0.00 177.10 176.96 1x2g s ALA 40 N -1.12 1.60 -0.38 0.60 0.00 -0.69 -2.88 121.76 118.89 1x2g s ALA 40 Ca 0.18 -0.99 -0.44 0.00 0.00 0.00 0.00 51.96 50.72 1x2g s ALA 40 Cb -0.11 -2.86 -0.18 0.00 0.00 0.00 0.00 23.12 19.97 1x2g s ALA 40 CO 0.10 -2.79 1.65 -0.25 0.00 0.00 0.00 175.76 174.47 1x2g n ASP 41 N -4.10 1.73 -3.70 0.00 8.00 -1.24 -4.57 116.55 112.66 1x2g n ASP 41 Ca 0.13 1.14 -0.13 0.00 0.71 0.00 0.00 54.79 56.63 1x2g n ASP 41 Cb 0.59 -1.00 -0.09 0.00 -0.02 0.00 0.00 41.12 40.60 1x2g n ASP 41 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1x2g s THR 42 N 3.17 -0.00 -0.24 -3.53 2.01 -0.54 -2.01 115.64 114.51 1x2g s THR 42 Ca 1.02 0.00 -0.11 0.00 0.31 0.00 0.00 61.69 62.91 1x2g s THR 42 Cb -1.30 -0.70 -0.05 0.00 0.01 0.00 0.00 72.50 70.46 1x2g s THR 42 CO 0.74 0.00 0.18 -0.69 -0.69 0.00 0.00 174.62 174.16 1x2g s VAL 43 N 0.29 5.34 -0.25 3.82 1.01 0.04 -0.88 120.40 129.77 1x2g s VAL 43 Ca -0.00 0.23 -0.09 0.00 0.00 0.00 0.00 61.98 62.12 1x2g s VAL 43 Cb -0.04 -3.52 -0.04 0.00 0.00 0.00 0.00 36.38 32.78 1x2g s VAL 43 CO 0.00 0.33 0.11 -0.69 0.00 0.00 0.00 175.10 174.86 1x2g s VAL 44 N 1.11 4.70 0.18 2.92 1.01 -0.55 -0.67 120.40 129.10 1x2g s VAL 44 Ca 0.09 -0.04 0.05 0.00 0.00 0.00 0.00 61.98 62.08 1x2g s VAL 44 Cb -0.14 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 1x2g s VAL 44 CO 0.05 0.32 0.16 0.27 0.00 0.00 0.00 175.10 175.89 1x2g s ILE 45 N 1.56 4.55 1.01 2.22 -4.36 -0.15 -1.14 121.20 124.89 1x2g s ILE 45 Ca 0.06 -1.10 -0.13 0.00 -0.26 0.00 0.00 60.65 59.23 1x2g s ILE 45 Cb -0.15 -3.34 0.19 0.00 1.25 0.00 0.00 42.46 40.41 1x2g s ILE 45 CO 0.06 -0.14 1.11 -0.83 0.24 0.00 0.00 174.94 175.38 1x2g s GLY 46 N -3.22 1.57 0.46 6.27 0.00 -1.21 -1.29 107.32 109.91 1x2g s GLY 46 Ca 0.31 -0.50 0.26 0.00 0.00 0.00 0.00 44.72 44.79 1x2g s GLY 46 CO 0.24 0.14 1.84 0.07 0.00 0.00 0.00 173.10 175.39 1x2g h ARG 47 N -1.91 0.00 -0.59 2.90 0.11 -0.39 -3.06 114.38 111.44 1x2g h ARG 47 Ca -0.53 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.55 1x2g h ARG 47 Cb 1.33 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.41 1x2g h ARG 47 CO 0.56 0.16 0.00 0.00 0.10 0.00 0.00 179.97 180.79 1x2g n ALA 48 N -2.18 3.05 -2.55 0.08 0.00 -1.26 -5.00 120.51 112.65 1x2g n ALA 48 Ca 0.01 -1.66 -0.27 0.00 0.00 0.00 0.00 53.44 51.52 1x2g n ALA 48 Cb 0.42 -0.94 -0.03 0.00 0.00 0.00 0.00 19.45 18.90 1x2g n ALA 48 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1x2g s GLN 49 N -1.93 3.59 -0.38 0.00 -0.21 -1.16 -0.45 119.66 119.13 1x2g s GLN 49 Ca 0.48 -0.08 -0.07 0.00 0.02 0.00 0.00 55.36 55.72 1x2g s GLN 49 Cb 0.32 -2.64 0.06 0.00 1.00 0.00 0.00 33.01 31.75 1x2g s GLN 49 CO 0.22 0.18 0.17 1.21 -2.12 0.00 0.00 175.29 174.95 1x2g s ASN 50 N -3.42 5.42 0.42 5.90 2.47 -1.26 -4.92 114.94 119.55 1x2g s ASN 50 Ca 0.43 -1.39 0.29 0.00 0.42 0.00 0.00 52.86 52.62 1x2g s ASN 50 Cb -0.10 -1.90 1.29 0.00 -1.45 0.00 0.00 41.25 39.08 1x2g s ASN 50 CO 0.32 -0.43 1.88 1.55 -3.72 0.00 0.00 177.10 176.70 1x2g h PRO 51 N 8.26 0.00 0.00 0.43 0.13 -1.92 -1.68 132.00 137.23 1x2g h PRO 51 Ca -0.22 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.83 1x2g h PRO 51 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1x2g h PRO 51 CO 0.67 0.00 -0.37 -1.49 -0.23 0.00 0.00 178.00 176.57 1x2g h TRP 52 N 0.00 0.00 0.11 1.56 4.06 -1.93 -0.63 115.95 119.13 1x2g h TRP 52 Ca 0.00 0.00 -0.27 0.00 2.06 0.00 0.00 58.89 60.68 1x2g h TRP 52 Cb 0.36 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.51 1x2g h TRP 52 CO 0.00 0.37 -1.39 -0.22 -3.56 0.00 0.00 178.44 173.65 1x2g h LYS 53 N 0.00 0.24 -0.03 0.49 3.64 -1.88 -3.41 116.57 115.61 1x2g h LYS 53 Ca -0.00 -0.41 -0.21 0.00 -1.27 0.00 0.00 60.65 58.76 1x2g h LYS 53 Cb 1.27 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 33.25 1x2g h LYS 53 CO 0.05 1.19 -0.88 0.93 -2.27 0.00 0.00 179.45 178.47 1x2g h GLU 54 N -0.32 0.42 -6.25 1.90 4.39 -1.30 -3.41 114.58 110.01 1x2g h GLU 54 Ca -0.30 -0.41 -0.68 0.00 0.34 0.00 0.00 59.36 58.31 1x2g h GLU 54 Cb 1.74 0.11 -0.17 0.00 -0.10 0.00 0.00 28.75 30.33 1x2g h GLU 54 CO 0.06 1.07 -0.70 0.00 -1.16 0.00 0.00 179.01 178.28 1x2g s ASN 56 N -1.28 6.47 0.16 0.00 3.84 0.12 -4.68 114.94 119.56 1x2g s ASN 56 Ca 0.16 -1.46 -0.05 0.00 0.21 0.00 0.00 52.86 51.72 1x2g s ASN 56 Cb -0.11 -2.51 0.01 0.00 -0.55 0.00 0.00 41.25 38.09 1x2g s ASN 56 CO 0.06 -1.42 1.42 0.71 -2.79 0.00 0.00 177.10 175.08 1x2g h THR 57 N 6.35 1.34 -0.07 -5.21 1.35 -1.88 -3.03 112.91 111.77 1x2g h THR 57 Ca 0.08 -2.01 0.03 0.00 -0.55 0.00 0.00 66.41 63.97 1x2g h THR 57 Cb 1.02 1.98 -0.03 0.00 -1.73 0.00 0.00 68.15 69.40 1x2g h THR 57 CO 1.30 0.62 -0.11 -0.09 -0.25 0.00 0.00 175.52 176.98 1x2g h ARG 58 N 0.39 -0.15 -1.50 4.72 9.65 -1.99 -1.19 114.38 124.31 1x2g h ARG 58 Ca -0.03 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 1x2g h ARG 58 Cb 1.28 0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.89 1x2g h ARG 58 CO 0.13 -0.10 0.00 -2.13 2.80 0.00 0.00 179.97 180.67 1x2g n ARG 59 N -5.25 0.00 0.00 0.20 0.63 -1.15 -1.46 116.66 109.63 1x2g n ARG 59 Ca -0.04 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.89 1x2g n ARG 59 Cb 0.17 -1.28 0.00 0.00 0.45 0.00 0.00 32.46 31.80 1x2g n ARG 59 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1x2g n GLU 61 N 0.83 0.00 -0.21 -0.14 1.02 -0.45 -0.08 120.64 121.61 1x2g n GLU 61 Ca 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.12 1x2g n GLU 61 Cb 0.00 0.00 0.19 0.00 -0.02 0.00 0.00 31.44 31.61 1x2g n GLU 61 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1x2g h GLU 62 N 0.00 0.99 -0.16 3.49 5.08 -1.52 -2.37 114.58 120.09 1x2g h GLU 62 Ca 0.00 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1x2g h GLU 62 Cb 0.00 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.06 1x2g h GLU 62 CO 0.00 0.75 0.00 -0.25 -1.00 0.00 0.00 179.01 178.51 1x2g n ASP 63 N -4.35 2.17 -3.58 1.42 8.00 0.89 -4.96 116.55 116.14 1x2g n ASP 63 Ca 0.07 -1.76 -0.22 0.00 0.71 0.00 0.00 54.79 53.59 1x2g n ASP 63 Cb 0.11 -0.10 0.07 0.00 -0.02 0.00 0.00 41.12 41.19 1x2g n ASP 63 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1x2g n ASN 64 N 0.67 -4.14 -4.77 -2.24 5.03 -0.89 -5.02 115.26 103.90 1x2g n ASN 64 Ca 0.17 -0.62 -0.36 0.00 0.87 0.00 0.00 54.58 54.64 1x2g n ASN 64 Cb 0.43 -4.85 -0.07 0.00 -1.02 0.00 0.00 39.78 34.26 1x2g n ASN 64 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1x2g s VAL 65 N -3.37 5.43 0.49 2.41 1.01 -1.26 -4.89 120.40 120.22 1x2g s VAL 65 Ca 0.33 0.21 -0.11 0.00 0.00 0.00 0.00 61.98 62.41 1x2g s VAL 65 Cb -0.15 -3.46 -0.06 0.00 0.00 0.00 0.00 36.38 32.72 1x2g s VAL 65 CO 0.75 0.49 0.87 -0.13 0.00 0.00 0.00 175.10 177.08 1x2g s ARG 66 N -0.03 3.74 -0.13 2.72 0.52 -0.85 -4.55 118.95 120.36 1x2g s ARG 66 Ca 0.10 0.58 -0.01 0.00 -0.52 0.00 0.00 55.73 55.89 1x2g s ARG 66 Cb -0.11 -2.27 -0.02 0.00 0.52 0.00 0.00 34.95 33.07 1x2g s ARG 66 CO -0.00 -0.23 -0.12 -1.17 0.02 0.00 0.00 175.30 173.81 1x2g s LEU 67 N -4.33 2.80 -0.01 2.53 2.96 -1.26 -0.78 118.68 120.59 1x2g s LEU 67 Ca 0.53 -0.29 0.04 0.00 -0.22 0.00 0.00 54.13 54.19 1x2g s LEU 67 Cb -0.10 -1.64 -0.01 0.00 0.50 0.00 0.00 46.19 44.94 1x2g s LEU 67 CO 0.38 0.17 -0.14 0.00 -1.32 0.00 0.00 176.35 175.44 1x2g s ALA 68 N 0.31 1.21 -0.20 5.97 0.00 0.16 -4.93 121.76 124.28 1x2g s ALA 68 Ca -0.09 -0.61 -0.07 0.00 0.00 0.00 0.00 51.96 51.19 1x2g s ALA 68 Cb -0.15 -0.32 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 1x2g s ALA 68 CO 0.05 0.28 0.06 0.50 0.00 0.00 0.00 175.76 176.65 1x2g s ARG 69 N -0.27 3.88 0.56 0.00 3.52 -1.26 -0.98 118.95 124.40 1x2g s ARG 69 Ca 0.04 -0.39 0.01 0.00 -0.13 0.00 0.00 55.73 55.27 1x2g s ARG 69 Cb -0.06 -3.22 0.04 0.00 -1.56 0.00 0.00 34.95 30.14 1x2g s ARG 69 CO -0.00 0.16 0.78 -0.98 -0.81 0.00 0.00 175.30 174.45 1x2g s ARG 70 N 0.66 2.51 0.00 5.12 1.70 -0.41 -4.91 118.95 123.62 1x2g s ARG 70 Ca 0.03 -0.80 0.23 0.00 -0.47 0.00 0.00 55.73 54.71 1x2g s ARG 70 Cb -0.13 -2.48 0.07 0.00 -0.57 0.00 0.00 34.95 31.84 1x2g s ARG 70 CO 0.02 -0.74 1.12 -1.13 -1.08 0.00 0.00 175.30 173.48 1x2g n SER 71 N -2.36 1.08 -4.95 -2.89 3.41 -1.26 -2.76 113.62 103.89 1x2g n SER 71 Ca 0.08 -0.91 -0.24 0.00 -0.26 0.00 0.00 58.87 57.54 1x2g n SER 71 Cb 0.60 0.65 0.05 0.00 -0.26 0.00 0.00 64.21 65.24 1x2g n SER 71 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1x2g s SER 72 N -2.86 5.11 0.00 4.04 1.04 -1.26 -4.70 113.70 115.08 1x2g s SER 72 Ca 0.12 0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.82 1x2g s SER 72 Cb 0.17 -1.07 0.00 0.00 0.10 0.00 0.00 66.02 65.22 1x2g s SER 72 CO 0.74 -1.33 0.00 0.61 0.98 0.00 0.00 173.24 174.24 1x2g n GLY 73 N -2.62 -1.34 0.45 7.32 0.00 -1.25 -0.19 105.19 107.57 1x2g n GLY 73 Ca 0.07 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.61 1x2g n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x2g n GLY 74 N 3.59 -3.32 0.00 -0.02 0.00 0.62 -4.46 105.19 101.59 1x2g n GLY 74 Ca 0.00 -1.97 0.00 0.00 0.00 0.00 0.00 46.02 44.05 1x2g n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x2g n GLY 75 N -0.17 2.23 3.76 -0.02 0.00 -1.23 -3.31 105.19 106.46 1x2g n GLY 75 Ca 0.00 -2.12 -0.39 0.00 0.00 0.00 0.00 46.02 43.51 1x2g n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x2g s ALA 76 N -2.00 3.30 0.06 4.61 0.00 -1.26 -3.83 121.76 122.63 1x2g s ALA 76 Ca 0.00 0.65 0.06 0.00 0.00 0.00 0.00 51.96 52.67 1x2g s ALA 76 Cb 0.00 -3.23 -0.03 0.00 0.00 0.00 0.00 23.12 19.86 1x2g s ALA 76 CO 0.00 0.10 -0.17 0.08 0.00 0.00 0.00 175.76 175.76 1x2g s VAL 77 N -1.33 1.39 -0.10 0.00 1.01 -0.29 -4.97 120.40 116.11 1x2g s VAL 77 Ca 0.45 -1.20 0.01 0.00 0.00 0.00 0.00 61.98 61.25 1x2g s VAL 77 Cb -0.25 -1.25 -0.02 0.00 0.00 0.00 0.00 36.38 34.86 1x2g s VAL 77 CO 0.31 0.03 -0.11 0.12 0.00 0.00 0.00 175.10 175.45 1x2g s PHE 78 N -0.94 2.84 0.00 5.22 5.36 -1.26 -1.48 117.98 127.72 1x2g s PHE 78 Ca 0.04 -0.30 0.08 0.00 -0.96 0.00 0.00 56.93 55.79 1x2g s PHE 78 Cb -0.09 -1.77 -0.02 0.00 -0.34 0.00 0.00 43.02 40.80 1x2g s PHE 78 CO 0.02 0.05 -0.26 -1.01 -1.46 0.00 0.00 175.22 172.56 1x2g s HIS 79 N -0.22 2.33 0.00 10.12 3.76 -0.06 -4.99 115.29 126.23 1x2g s HIS 79 Ca 0.02 -0.43 0.00 0.00 -0.15 0.00 0.00 55.06 54.50 1x2g s HIS 79 Cb -0.13 -1.46 0.00 0.00 1.11 0.00 0.00 32.58 32.10 1x2g s HIS 79 CO 0.03 0.02 0.00 -0.40 -0.85 0.00 0.00 174.74 173.54 1x2g n ASP 80 N 2.21 0.00 0.01 1.40 5.68 -1.25 -1.46 116.55 123.14 1x2g n ASP 80 Ca -0.16 -0.65 0.14 0.00 -0.50 0.00 0.00 54.79 53.62 1x2g n ASP 80 Cb 0.51 0.00 0.60 0.00 -1.14 0.00 0.00 41.12 41.09 1x2g n ASP 80 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1x2g n LEU 81 N 0.00 0.09 -0.44 -2.12 4.77 -1.14 -2.33 117.00 115.82 1x2g n LEU 81 Ca 0.00 0.51 0.08 0.00 -0.03 0.00 0.00 56.01 56.57 1x2g n LEU 81 Cb 0.00 -0.48 0.31 0.00 -2.33 0.00 0.00 43.42 40.92 1x2g n LEU 81 CO 0.00 -0.02 0.72 0.61 -1.33 0.00 0.00 177.39 177.37 1x2g n GLY 82 N 1.47 0.07 3.62 -0.72 0.00 -1.26 -4.73 105.19 103.64 1x2g n GLY 82 Ca 0.07 -0.32 -0.34 0.00 0.00 0.00 0.00 46.02 45.42 1x2g n GLY 82 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1x2g s ASN 83 N -1.36 5.29 -0.12 1.61 -0.87 -0.98 -0.62 114.94 117.89 1x2g s ASN 83 Ca 0.26 0.05 0.02 0.00 -1.57 0.00 0.00 52.86 51.62 1x2g s ASN 83 Cb 0.14 -1.76 -0.01 0.00 -0.02 0.00 0.00 41.25 39.59 1x2g s ASN 83 CO 0.20 0.24 -0.17 -0.89 -2.57 0.00 0.00 177.10 173.91 1x2g s THR 84 N -0.07 2.67 0.16 1.60 2.01 -0.51 -4.64 115.64 116.86 1x2g s THR 84 Ca 0.04 -0.80 0.10 0.00 0.31 0.00 0.00 61.69 61.35 1x2g s THR 84 Cb -0.13 -2.09 -0.04 0.00 0.01 0.00 0.00 72.50 70.26 1x2g s THR 84 CO 0.02 0.54 -0.24 0.00 -0.69 0.00 0.00 174.62 174.25 1x2g s PHE 86 N -1.49 0.09 -0.06 0.00 -0.12 -0.53 -1.66 117.98 114.22 1x2g s PHE 86 Ca 0.16 -0.18 -0.01 0.00 -0.05 0.00 0.00 56.93 56.85 1x2g s PHE 86 Cb -0.08 -0.07 0.03 0.00 -0.63 0.00 0.00 43.02 42.26 1x2g s PHE 86 CO 0.08 -0.11 -0.00 0.99 -0.05 0.00 0.00 175.22 176.12 1x2g s THR 87 N -0.69 0.34 0.41 -4.49 2.01 0.42 -1.93 115.64 111.71 1x2g s THR 87 Ca -0.08 0.09 0.03 0.00 0.31 0.00 0.00 61.69 62.05 1x2g s THR 87 Cb -0.05 -0.47 0.03 0.00 0.01 0.00 0.00 72.50 72.03 1x2g s THR 87 CO -0.00 0.23 0.29 0.49 -0.69 0.00 0.00 174.62 174.94 1x2g n PHE 88 N 4.79 -0.70 0.00 4.92 3.01 0.98 -0.21 117.46 130.25 1x2g n PHE 88 Ca -0.13 -1.77 0.00 0.00 1.01 0.00 0.00 57.45 56.56 1x2g n PHE 88 Cb 0.50 -0.33 0.00 0.00 -0.01 0.00 0.00 39.48 39.64 1x2g n PHE 88 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1x2g n ALA 90 N -2.11 0.00 -1.70 4.37 0.00 -0.75 -0.47 120.51 119.85 1x2g n ALA 90 Ca -0.13 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 52.96 1x2g n ALA 90 Cb 0.47 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.94 1x2g n ALA 90 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1x2g s GLY 91 N 0.00 2.51 0.48 0.00 0.00 -1.12 -0.71 107.32 108.48 1x2g s GLY 91 Ca 0.00 0.75 -0.06 0.00 0.00 0.00 0.00 44.72 45.41 1x2g s GLY 91 CO 0.00 1.11 0.79 0.54 0.00 0.00 0.00 173.10 175.54 1x2g s LYS 92 N -3.50 3.57 0.31 2.90 1.02 -0.57 -2.36 119.74 121.11 1x2g s LYS 92 Ca 0.71 0.25 0.26 0.00 0.02 0.00 0.00 55.97 57.21 1x2g s LYS 92 Cb -0.23 -2.37 0.76 0.00 -0.52 0.00 0.00 37.83 35.47 1x2g s LYS 92 CO 0.31 -0.20 1.74 -1.00 -0.92 0.00 0.00 175.35 175.28 1x2g h PRO 93 N 0.33 0.00 -0.96 -1.68 0.13 -1.96 -3.47 132.00 124.40 1x2g h PRO 93 Ca -0.47 0.00 0.31 0.00 -0.87 0.00 0.00 66.00 64.97 1x2g h PRO 93 Cb 1.20 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.17 1x2g h PRO 93 CO 0.62 0.00 0.34 1.49 -0.23 0.00 0.00 178.00 180.22 1x2g h GLU 94 N 0.00 0.13 -6.01 0.86 4.81 -1.95 -3.42 114.58 108.99 1x2g h GLU 94 Ca 0.00 -0.01 -0.63 0.00 -0.13 0.00 0.00 59.36 58.59 1x2g h GLU 94 Cb 0.73 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 30.02 1x2g h GLU 94 CO 0.00 0.09 -0.54 -0.47 -0.73 0.00 0.00 179.01 177.35 1x2g s TYR 95 N -5.78 3.38 0.25 0.92 5.04 -0.99 -5.08 117.35 115.08 1x2g s TYR 95 Ca -0.11 0.19 -0.10 0.00 -2.44 0.00 0.00 57.07 54.61 1x2g s TYR 95 Cb 0.30 -1.71 -0.01 0.00 0.35 0.00 0.00 41.96 40.89 1x2g s TYR 95 CO 0.78 0.57 0.44 0.16 -1.34 0.00 0.00 175.55 176.15 1x2g s ASP 96 N -2.34 0.03 0.62 4.32 1.47 -1.26 -4.81 116.67 114.70 1x2g s ASP 96 Ca 0.31 -1.04 0.33 0.00 1.18 0.00 0.00 52.55 53.33 1x2g s ASP 96 Cb -0.13 0.57 1.90 0.00 -0.34 0.00 0.00 42.92 44.93 1x2g s ASP 96 CO 0.24 -1.13 2.20 0.50 0.68 0.00 0.00 175.17 177.66 1x2g h LYS 97 N 2.28 0.00 -0.29 2.11 3.64 -2.00 -3.12 116.57 119.19 1x2g h LYS 97 Ca -0.28 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 58.98 1x2g h LYS 97 Cb 1.25 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.06 1x2g h LYS 97 CO 0.38 0.00 -0.34 1.79 -2.27 0.00 0.00 179.45 179.01 1x2g h THR 98 N 0.00 1.29 0.15 1.00 1.35 -1.99 -2.94 112.91 111.76 1x2g h THR 98 Ca 0.03 -1.48 -0.00 0.00 -0.55 0.00 0.00 66.41 64.41 1x2g h THR 98 Cb 0.23 1.43 -0.01 0.00 -1.73 0.00 0.00 68.15 68.07 1x2g h THR 98 CO -0.00 0.48 -0.21 0.40 -0.25 0.00 0.00 175.52 175.94 1x2g h ILE 99 N 0.55 0.00 -0.80 6.82 2.04 -1.98 -0.06 117.51 124.08 1x2g h ILE 99 Ca 0.06 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.02 1x2g h ILE 99 Cb 0.85 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.85 1x2g h ILE 99 CO 0.07 0.00 0.45 0.77 0.00 0.00 0.00 178.15 179.44 1x2g h SER 100 N -0.37 0.63 -0.41 1.72 4.64 -1.77 0.83 113.55 118.82 1x2g h SER 100 Ca -0.02 0.05 0.03 0.00 -0.47 0.00 0.00 61.79 61.39 1x2g h SER 100 Cb 0.34 -0.07 -0.03 0.00 -0.31 0.00 0.00 62.40 62.33 1x2g h SER 100 CO -0.06 0.35 0.20 0.74 -0.87 0.00 0.00 176.83 177.20 1x2g h THR 101 N 0.75 0.97 -0.84 2.95 2.02 -1.46 -1.68 112.91 115.63 1x2g h THR 101 Ca 0.39 -0.14 -0.03 0.00 0.77 0.00 0.00 66.41 67.40 1x2g h THR 101 Cb 0.38 0.53 -0.04 0.00 -1.74 0.00 0.00 68.15 67.28 1x2g h THR 101 CO -0.26 0.07 0.39 -1.28 0.37 0.00 0.00 175.52 174.82 1x2g h SER 102 N 0.41 1.10 -0.60 4.18 0.87 -0.20 -1.25 113.55 118.05 1x2g h SER 102 Ca 0.17 -0.14 0.02 0.00 -1.23 0.00 0.00 61.79 60.61 1x2g h SER 102 Cb 0.08 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.72 1x2g h SER 102 CO -0.12 0.93 0.39 0.40 -0.53 0.00 0.00 176.83 177.89 1x2g h ILE 103 N 1.19 1.12 -0.41 2.23 2.04 -0.26 -0.37 117.51 123.05 1x2g h ILE 103 Ca 0.29 -0.27 -0.15 0.00 1.00 0.00 0.00 64.86 65.73 1x2g h ILE 103 Cb 0.13 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 1x2g h ILE 103 CO -0.03 0.14 -0.33 0.58 0.00 0.00 0.00 178.15 178.51 1x2g h VAL 104 N 0.77 1.27 -0.73 1.67 2.07 -1.09 -1.14 116.25 119.08 1x2g h VAL 104 Ca 0.23 -1.50 0.02 0.00 0.82 0.00 0.00 66.70 66.27 1x2g h VAL 104 Cb -0.04 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 30.99 1x2g h VAL 104 CO -0.07 0.51 0.47 -0.07 0.02 0.00 0.00 177.57 178.42 1x2g h LEU 105 N 0.79 0.79 -0.80 2.57 3.38 -1.03 0.44 115.31 121.45 1x2g h LEU 105 Ca 0.08 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.95 1x2g h LEU 105 Cb 0.92 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 1x2g h LEU 105 CO 0.09 0.56 -0.06 0.78 0.09 0.00 0.00 178.44 179.90 1x2g h ASN 106 N 0.93 0.82 -0.22 -0.43 2.35 -0.89 0.44 115.58 118.59 1x2g h ASN 106 Ca 0.28 -0.23 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1x2g h ASN 106 Cb -0.04 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.10 1x2g h ASN 106 CO -0.09 0.92 0.13 0.00 -1.65 0.00 0.00 177.43 176.75 1x2g h ALA 107 N 1.16 0.28 -0.31 -0.83 0.00 -0.64 0.23 119.26 119.16 1x2g h ALA 107 Ca 0.14 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1x2g h ALA 107 Cb 0.54 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1x2g h ALA 107 CO 0.03 -0.21 0.12 -0.07 0.00 0.00 0.00 179.25 179.13 1x2g h LEU 108 N 0.27 0.43 -0.45 0.00 3.38 -0.55 -2.33 115.31 116.06 1x2g h LEU 108 Ca 0.08 -0.17 0.09 0.00 0.09 0.00 0.00 57.88 57.97 1x2g h LEU 108 Cb 0.03 -0.11 -0.09 0.00 0.09 0.00 0.00 40.66 40.57 1x2g h LEU 108 CO -0.01 0.49 -0.15 -1.13 0.09 0.00 0.00 178.44 177.72 1x2g h ASN 109 N 0.36 -0.53 0.00 -0.43 -0.73 -0.58 -0.73 115.58 112.94 1x2g h ASN 109 Ca 0.10 0.15 0.00 0.00 1.87 0.00 0.00 56.30 58.42 1x2g h ASN 109 Cb 0.19 0.32 0.00 0.00 0.27 0.00 0.00 38.32 39.10 1x2g h ASN 109 CO -0.01 -0.19 0.05 0.00 -0.37 0.00 0.00 177.43 176.92 1x2g h ALA 110 N 1.36 1.04 0.00 1.57 0.00 0.00 -0.01 119.26 123.22 1x2g h ALA 110 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1x2g h ALA 110 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1x2g h ALA 110 CO -0.49 -0.04 -0.91 1.28 0.00 0.00 0.00 179.25 179.08 1x2g n LEU 111 N -2.72 0.69 0.00 0.00 4.77 -0.62 -4.94 117.00 114.18 1x2g n LEU 111 Ca -0.02 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 1x2g n LEU 111 Cb 0.10 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1x2g n LEU 111 CO 0.15 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 1x2g n GLY 112 N 1.44 1.26 3.34 -0.72 0.00 -0.02 -5.07 105.19 105.43 1x2g n GLY 112 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 1x2g n GLY 112 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x2g s VAL 113 N -2.00 3.00 -0.60 1.61 1.01 -0.38 -4.99 120.40 118.05 1x2g s VAL 113 Ca 0.00 -0.67 -0.23 0.00 0.00 0.00 0.00 61.98 61.08 1x2g s VAL 113 Cb 0.00 -2.27 0.05 0.00 0.00 0.00 0.00 36.38 34.16 1x2g s VAL 113 CO 0.00 0.51 0.93 -0.94 0.00 0.00 0.00 175.10 175.60 1x2g s SER 114 N 0.61 6.26 0.28 3.32 1.04 -1.26 -2.46 113.70 121.49 1x2g s SER 114 Ca -0.07 -0.67 0.10 0.00 0.48 0.00 0.00 55.95 55.78 1x2g s SER 114 Cb -0.16 -2.42 -0.05 0.00 0.10 0.00 0.00 66.02 63.49 1x2g s SER 114 CO 0.03 -1.30 -0.15 0.00 0.98 0.00 0.00 173.24 172.80 1x2g s ALA 115 N 3.91 2.64 0.03 5.32 0.00 -1.26 -3.71 121.76 128.68 1x2g s ALA 115 Ca 0.26 -1.90 -0.08 0.00 0.00 0.00 0.00 51.96 50.23 1x2g s ALA 115 Cb -0.15 -0.13 0.00 0.00 0.00 0.00 0.00 23.12 22.84 1x2g s ALA 115 CO 0.15 0.16 0.17 -2.00 0.00 0.00 0.00 175.76 174.23 1x2g s GLU 116 N -3.58 0.63 0.57 0.00 2.12 0.12 -4.95 118.70 113.60 1x2g s GLU 116 Ca 0.29 -0.60 -0.20 0.00 0.36 0.00 0.00 54.97 54.82 1x2g s GLU 116 Cb -0.01 0.26 -0.04 0.00 0.26 0.00 0.00 34.13 34.59 1x2g s GLU 116 CO 0.14 -0.17 1.26 0.00 -0.54 0.00 0.00 175.26 175.95 1x2g s ALA 117 N -2.32 2.67 -0.28 6.30 0.00 -1.26 -0.95 121.76 125.93 1x2g s ALA 117 Ca -0.07 1.13 0.00 0.00 0.00 0.00 0.00 51.96 53.02 1x2g s ALA 117 Cb -0.02 -3.49 0.14 0.00 0.00 0.00 0.00 23.12 19.75 1x2g s ALA 117 CO -0.03 -1.21 0.35 0.45 0.00 0.00 0.00 175.76 175.32 1x2g s SER 118 N -1.33 0.91 0.00 0.00 0.15 -0.66 -4.82 113.70 107.95 1x2g s SER 118 Ca 0.74 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.96 1x2g s SER 118 Cb -0.34 0.84 0.00 0.00 -1.71 0.00 0.00 66.02 64.81 1x2g s SER 118 CO 0.39 -0.36 0.00 0.61 1.20 0.00 0.00 173.24 175.08 1x2g n GLY 119 N 5.34 -1.89 0.17 9.45 0.00 -1.26 -3.14 105.19 113.86 1x2g n GLY 119 Ca -0.01 -1.66 0.12 0.00 0.00 0.00 0.00 46.02 44.47 1x2g n GLY 119 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1x2g h ARG 120 N 0.00 0.00 0.00 1.61 3.08 -2.01 -3.40 114.38 113.66 1x2g h ARG 120 Ca 0.00 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 1x2g h ARG 120 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 1x2g h ARG 120 CO 0.00 0.00 -1.41 0.09 -1.07 0.00 0.00 179.97 177.58 1x2g n ASN 121 N -2.78 3.46 -4.93 7.04 3.02 -1.26 -4.98 115.26 114.83 1x2g n ASN 121 Ca 0.04 -0.03 -0.26 0.00 -0.03 0.00 0.00 54.58 54.29 1x2g n ASN 121 Cb 0.50 -0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.65 1x2g n ASN 121 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1x2g s ASP 122 N -4.56 6.36 0.03 6.41 1.01 -1.19 -3.24 116.67 121.49 1x2g s ASP 122 Ca -0.09 0.55 0.08 0.00 0.71 0.00 0.00 52.55 53.80 1x2g s ASP 122 Cb 0.02 -2.08 -0.03 0.00 1.01 0.00 0.00 42.92 41.85 1x2g s ASP 122 CO 0.18 -0.24 -0.22 -0.76 0.21 0.00 0.00 175.17 174.34 1x2g s LEU 123 N -3.93 2.38 0.00 1.23 1.43 -0.91 -1.66 118.68 117.23 1x2g s LEU 123 Ca 0.41 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 53.03 1x2g s LEU 123 Cb -0.10 -1.41 -0.01 0.00 0.03 0.00 0.00 46.19 44.71 1x2g s LEU 123 CO 0.33 0.27 -0.02 0.54 0.23 0.00 0.00 176.35 177.71 1x2g s VAL 124 N -0.83 0.11 -0.17 -1.59 0.11 -0.12 -1.17 120.40 116.73 1x2g s VAL 124 Ca 0.13 -0.24 -0.09 0.00 -2.93 0.00 0.00 61.98 58.85 1x2g s VAL 124 Cb -0.10 -0.13 -0.05 0.00 -1.53 0.00 0.00 36.38 34.57 1x2g s VAL 124 CO 0.03 -0.08 0.13 0.68 -3.33 0.00 0.00 175.10 172.52 1x2g s VAL 125 N -0.33 5.41 0.12 2.04 -7.23 0.15 0.12 120.40 120.68 1x2g s VAL 125 Ca -0.03 0.18 -0.30 0.00 -1.81 0.00 0.00 61.98 60.02 1x2g s VAL 125 Cb -0.02 -3.43 -0.07 0.00 0.56 0.00 0.00 36.38 33.42 1x2g s VAL 125 CO -0.00 0.50 1.20 -0.54 -0.31 0.00 0.00 175.10 175.94 1x2g s LYS 126 N -0.09 4.47 0.06 4.82 -0.14 -1.24 -1.58 119.74 126.03 1x2g s LYS 126 Ca 0.10 1.82 0.03 0.00 -1.36 0.00 0.00 55.97 56.55 1x2g s LYS 126 Cb -0.11 -3.30 -0.03 0.00 -1.68 0.00 0.00 37.83 32.71 1x2g s LYS 126 CO -0.00 -0.17 -0.08 0.99 -0.76 0.00 0.00 175.35 175.33 1x2g s THR 127 N 0.52 0.67 0.23 2.17 2.01 -1.19 -4.97 115.64 115.08 1x2g s THR 127 Ca 0.56 -1.33 -0.07 0.00 0.31 0.00 0.00 61.69 61.16 1x2g s THR 127 Cb -0.31 -0.95 0.19 0.00 0.01 0.00 0.00 72.50 71.44 1x2g s THR 127 CO 0.33 -0.48 1.72 0.58 -0.69 0.00 0.00 174.62 176.07 1x2g h VAL 128 N 4.07 0.66 -0.08 3.82 2.07 -2.03 -0.29 116.25 124.47 1x2g h VAL 128 Ca -0.36 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 1x2g h VAL 128 Cb 1.19 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 1x2g h VAL 128 CO 0.47 0.07 0.02 -0.62 0.02 0.00 0.00 177.57 177.52 1x2g n GLU 129 N -5.05 1.43 0.00 1.57 4.71 -1.26 -5.02 120.64 117.02 1x2g n GLU 129 Ca 0.12 -0.39 0.00 0.00 -0.01 0.00 0.00 57.16 56.87 1x2g n GLU 129 Cb 0.36 -1.51 0.00 0.00 -1.01 0.00 0.00 31.44 29.28 1x2g n GLU 129 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1x2g n GLY 130 N 0.12 -0.23 3.71 0.62 0.00 -0.12 -4.98 105.19 104.30 1x2g n GLY 130 Ca 0.04 -1.81 -0.42 0.00 0.00 0.00 0.00 46.02 43.83 1x2g n GLY 130 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x2g s ASP 131 N -1.62 6.41 -0.13 1.61 1.11 -1.26 -3.17 116.67 119.62 1x2g s ASP 131 Ca 0.00 2.81 0.03 0.00 0.18 0.00 0.00 52.55 55.57 1x2g s ASP 131 Cb 0.00 -2.58 0.01 0.00 1.07 0.00 0.00 42.92 41.41 1x2g s ASP 131 CO 0.00 -0.98 -0.22 -0.13 1.18 0.00 0.00 175.17 175.02 1x2g s ARG 132 N 1.90 3.04 0.01 8.23 1.81 -0.62 -4.81 118.95 128.52 1x2g s ARG 132 Ca 0.77 -0.86 -0.30 0.00 -1.72 0.00 0.00 55.73 53.63 1x2g s ARG 132 Cb -0.48 -2.40 -0.05 0.00 -0.45 0.00 0.00 34.95 31.57 1x2g s ARG 132 CO 0.34 0.05 1.21 0.21 -0.68 0.00 0.00 175.30 176.43 1x2g s LYS 133 N 0.65 4.39 0.00 3.54 2.36 0.19 -0.67 119.74 130.20 1x2g s LYS 133 Ca -0.11 1.74 0.01 0.00 -2.55 0.00 0.00 55.97 55.06 1x2g s LYS 133 Cb -0.16 -3.45 -0.00 0.00 -1.05 0.00 0.00 37.83 33.17 1x2g s LYS 133 CO 0.02 -0.35 0.29 1.33 1.55 0.00 0.00 175.35 178.19 1x2g n VAL 134 N 4.25 0.00 -3.68 4.02 0.24 -0.31 -0.83 118.33 122.01 1x2g n VAL 134 Ca 0.10 -0.49 -0.11 0.00 -2.04 0.00 0.00 64.34 61.80 1x2g n VAL 134 Cb 0.46 1.01 -0.09 0.00 -1.47 0.00 0.00 33.84 33.75 1x2g n VAL 134 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1x2g s SER 135 N -0.57 -0.66 0.18 -1.34 0.15 -1.17 -1.19 113.70 109.10 1x2g s SER 135 Ca 0.01 1.15 0.08 0.00 0.70 0.00 0.00 55.95 57.89 1x2g s SER 135 Cb 0.01 1.09 -0.04 0.00 -1.71 0.00 0.00 66.02 65.36 1x2g s SER 135 CO 0.02 -0.21 -0.06 -0.83 1.20 0.00 0.00 173.24 173.36 1x2g s GLY 136 N 0.99 1.73 0.36 9.45 0.00 -1.07 -2.15 107.32 116.62 1x2g s GLY 136 Ca -0.06 -1.44 -0.12 0.00 0.00 0.00 0.00 44.72 43.10 1x2g s GLY 136 CO -0.09 -1.46 0.68 -1.35 0.00 0.00 0.00 173.10 170.88 1x2g s SER 137 N -2.88 0.24 -0.04 1.64 1.04 -1.20 -0.82 113.70 111.69 1x2g s SER 137 Ca 0.26 -1.20 -0.12 0.00 0.48 0.00 0.00 55.95 55.37 1x2g s SER 137 Cb -0.09 0.78 0.02 0.00 0.10 0.00 0.00 66.02 66.83 1x2g s SER 137 CO 0.16 -1.54 0.27 0.00 0.98 0.00 0.00 173.24 173.11 1x2g s ALA 138 N -2.70 -0.66 -0.03 5.32 0.00 0.05 -4.84 121.76 118.90 1x2g s ALA 138 Ca 0.20 0.41 0.05 0.00 0.00 0.00 0.00 51.96 52.61 1x2g s ALA 138 Cb -0.04 -0.12 -0.01 0.00 0.00 0.00 0.00 23.12 22.96 1x2g s ALA 138 CO 0.14 -0.20 -0.17 -0.47 0.00 0.00 0.00 175.76 175.05 1x2g s TYR 139 N -0.80 1.61 0.03 0.00 5.04 -1.26 -2.04 117.35 119.93 1x2g s TYR 139 Ca -0.09 -0.39 0.03 0.00 -2.44 0.00 0.00 57.07 54.18 1x2g s TYR 139 Cb -0.05 -1.07 -0.02 0.00 0.35 0.00 0.00 41.96 41.18 1x2g s TYR 139 CO 0.02 -0.10 -0.09 1.03 -1.34 0.00 0.00 175.55 175.07 1x2g s ARG 140 N -0.15 0.62 0.13 4.97 1.81 -0.07 -5.00 118.95 121.28 1x2g s ARG 140 Ca 0.01 -0.61 0.11 0.00 -1.72 0.00 0.00 55.73 53.51 1x2g s ARG 140 Cb -0.09 -0.52 -0.04 0.00 -0.45 0.00 0.00 34.95 33.84 1x2g s ARG 140 CO 0.01 0.12 -0.25 -1.21 -0.68 0.00 0.00 175.30 173.29 1x2g s GLU 141 N -1.07 1.36 0.14 3.54 2.02 -1.26 -0.85 118.70 122.58 1x2g s GLU 141 Ca -0.03 -1.34 0.00 0.00 0.02 0.00 0.00 54.97 53.62 1x2g s GLU 141 Cb -0.07 -1.79 -0.00 0.00 0.10 0.00 0.00 34.13 32.37 1x2g s GLU 141 CO 0.01 0.42 0.01 2.41 0.02 0.00 0.00 175.26 178.12 1x2g n THR 142 N 0.84 0.00 -0.02 3.63 -1.04 -0.40 -5.01 114.28 112.28 1x2g n THR 142 Ca -0.17 -0.69 -0.17 0.00 -2.04 0.00 0.00 64.05 60.97 1x2g n THR 142 Cb 0.54 0.16 -0.08 0.00 -1.82 0.00 0.00 70.33 69.13 1x2g n THR 142 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 1x2g h LYS 143 N 0.00 0.72 0.00 -2.82 1.57 -2.01 -3.37 116.57 110.66 1x2g h LYS 143 Ca -0.11 -0.60 0.00 0.00 -1.87 0.00 0.00 60.65 58.06 1x2g h LYS 143 Cb 0.36 0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.80 1x2g h LYS 143 CO 0.19 1.21 -0.77 -0.40 -0.57 0.00 0.00 179.45 179.11 1x2g n ASP 144 N -4.01 0.76 -3.86 0.86 5.75 -1.26 -4.85 116.55 109.94 1x2g n ASP 144 Ca -0.08 -0.64 -0.09 0.00 -0.01 0.00 0.00 54.79 53.97 1x2g n ASP 144 Cb 0.72 0.65 -0.05 0.00 -1.03 0.00 0.00 41.12 41.41 1x2g n ASP 144 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1x2g s ARG 145 N -3.00 1.41 0.17 0.11 1.70 -1.26 -1.51 118.95 116.57 1x2g s ARG 145 Ca 0.09 -1.03 0.11 0.00 -0.47 0.00 0.00 55.73 54.43 1x2g s ARG 145 Cb 0.17 0.48 -0.04 0.00 -0.57 0.00 0.00 34.95 34.99 1x2g s ARG 145 CO 0.79 -0.58 -0.24 0.20 -1.08 0.00 0.00 175.30 174.38 1x2g s GLY 146 N -2.93 1.67 -0.12 3.88 0.00 0.11 -1.28 107.32 108.65 1x2g s GLY 146 Ca 0.14 -1.58 -0.05 0.00 0.00 0.00 0.00 44.72 43.23 1x2g s GLY 146 CO 0.01 -1.59 0.27 -0.12 0.00 0.00 0.00 173.10 171.68 1x2g s PHE 147 N -1.48 -0.40 -0.04 1.90 2.19 -0.03 -1.80 117.98 118.32 1x2g s PHE 147 Ca 0.19 0.92 -0.00 0.00 0.33 0.00 0.00 56.93 58.36 1x2g s PHE 147 Cb -0.09 0.04 0.03 0.00 -1.31 0.00 0.00 43.02 41.69 1x2g s PHE 147 CO 0.09 -0.29 0.00 -1.58 1.83 0.00 0.00 175.22 175.27 1x2g s HIS 148 N 1.75 0.42 -0.00 10.12 2.46 0.38 -0.89 115.29 129.53 1x2g s HIS 148 Ca -0.05 -0.03 -0.06 0.00 0.47 0.00 0.00 55.06 55.38 1x2g s HIS 148 Cb -0.11 -0.55 0.00 0.00 -0.13 0.00 0.00 32.58 31.79 1x2g s HIS 148 CO -0.09 -0.19 0.12 -3.38 -2.47 0.00 0.00 174.74 168.73 1x2g s HIS 149 N 1.39 0.05 0.08 3.88 -3.43 -0.86 -0.01 115.29 116.38 1x2g s HIS 149 Ca -0.04 -0.13 -0.11 0.00 -0.80 0.00 0.00 55.06 53.97 1x2g s HIS 149 Cb -0.13 -0.05 0.04 0.00 -1.43 0.00 0.00 32.58 31.00 1x2g s HIS 149 CO -0.02 -0.26 0.52 0.41 -2.00 0.00 0.00 174.74 173.39 1x2g n GLY 150 N 1.59 0.91 3.31 -1.38 0.00 -0.81 -0.77 105.19 108.05 1x2g n GLY 150 Ca -0.22 -1.03 -0.23 0.00 0.00 0.00 0.00 46.02 44.54 1x2g n GLY 150 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x2g s THR 151 N -2.30 1.76 -0.08 2.61 -4.23 0.00 -1.45 115.64 111.95 1x2g s THR 151 Ca 0.12 -1.73 0.02 0.00 -1.18 0.00 0.00 61.69 58.92 1x2g s THR 151 Cb -0.01 -1.70 -0.02 0.00 1.34 0.00 0.00 72.50 72.11 1x2g s THR 151 CO 0.03 -0.18 -0.13 -0.76 -0.54 0.00 0.00 174.62 173.04 1x2g s LEU 152 N -2.28 2.80 -0.56 4.79 1.43 0.17 -2.61 118.68 122.42 1x2g s LEU 152 Ca 0.11 -0.22 -0.22 0.00 -1.03 0.00 0.00 54.13 52.77 1x2g s LEU 152 Cb -0.08 -1.60 0.06 0.00 0.03 0.00 0.00 46.19 44.60 1x2g s LEU 152 CO 0.05 0.28 0.82 -0.76 0.23 0.00 0.00 176.35 176.97 1x2g s LEU 153 N -0.32 4.56 -0.23 1.79 1.43 -0.33 -1.42 118.68 124.16 1x2g s LEU 153 Ca 0.03 -0.76 -0.17 0.00 -1.03 0.00 0.00 54.13 52.20 1x2g s LEU 153 Cb -0.13 -2.57 -0.13 0.00 0.03 0.00 0.00 46.19 43.39 1x2g s LEU 153 CO 0.03 -1.15 -0.13 0.18 0.23 0.00 0.00 176.35 175.50 1x2g n LEU 154 N 6.99 1.90 -2.70 1.79 4.32 -0.02 -0.09 117.00 129.20 1x2g n LEU 154 Ca -0.03 0.40 -0.03 0.00 -0.02 0.00 0.00 56.01 56.33 1x2g n LEU 154 Cb 0.46 -0.87 0.11 0.00 -1.62 0.00 0.00 43.42 41.50 1x2g n LEU 154 CO 0.60 0.25 0.49 -3.20 -1.22 0.00 0.00 177.39 174.31 1x2g n ASN 155 N -4.38 -1.00 -4.76 -1.43 4.05 0.21 -1.59 115.26 106.35 1x2g n ASN 155 Ca -0.36 -2.26 -0.41 0.00 0.45 0.00 0.00 54.58 51.99 1x2g n ASN 155 Cb 0.70 0.54 -0.02 0.00 1.23 0.00 0.00 39.78 42.23 1x2g n ASN 155 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1x2g s ALA 156 N -0.55 3.55 -0.33 5.20 0.00 -1.11 -4.37 121.76 124.14 1x2g s ALA 156 Ca 0.15 1.29 -0.28 0.00 0.00 0.00 0.00 51.96 53.13 1x2g s ALA 156 Cb 0.42 -3.51 0.01 0.00 0.00 0.00 0.00 23.12 20.04 1x2g s ALA 156 CO -0.10 -0.69 1.01 0.34 0.00 0.00 0.00 175.76 176.32 1x2g s ASP 157 N -0.13 6.84 0.16 0.00 -1.08 -1.26 -4.90 116.67 116.30 1x2g s ASP 157 Ca 0.53 0.90 0.19 0.00 -0.52 0.00 0.00 52.55 53.65 1x2g s ASP 157 Cb -0.41 -2.51 -0.04 0.00 -1.46 0.00 0.00 42.92 38.50 1x2g s ASP 157 CO 0.49 -0.85 1.00 -0.07 0.52 0.00 0.00 175.17 176.26 1x2g h LEU 158 N 10.04 0.00 -0.33 -1.34 3.38 -2.01 -3.31 115.31 121.74 1x2g h LEU 158 Ca -0.21 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.56 1x2g h LEU 158 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1x2g h LEU 158 CO 1.01 0.30 -0.67 0.77 0.09 0.00 0.00 178.44 179.94 1x2g h SER 159 N 0.00 0.77 -1.00 -0.43 4.64 -2.05 -3.40 113.55 112.09 1x2g h SER 159 Ca -0.07 -0.47 0.22 0.00 -0.47 0.00 0.00 61.79 61.00 1x2g h SER 159 Cb 1.30 -0.22 -0.10 0.00 -0.31 0.00 0.00 62.40 63.06 1x2g h SER 159 CO 0.03 1.23 0.63 0.03 -0.87 0.00 0.00 176.83 177.87 1x2g h ARG 160 N 0.48 0.55 -0.38 4.77 2.47 -2.00 -3.09 114.38 117.18 1x2g h ARG 160 Ca -0.02 -0.03 0.08 0.00 -1.26 0.00 0.00 59.98 58.75 1x2g h ARG 160 Cb 1.26 -0.12 -0.08 0.00 -1.65 0.00 0.00 29.97 29.38 1x2g h ARG 160 CO 0.13 0.36 -0.16 1.25 0.56 0.00 0.00 179.97 182.12 1x2g h LEU 161 N 0.57 -0.54 -2.02 3.04 5.85 -1.83 -1.51 115.31 118.86 1x2g h LEU 161 Ca 0.58 0.14 0.14 0.00 0.84 0.00 0.00 57.88 59.57 1x2g h LEU 161 Cb 1.18 0.31 -0.02 0.00 0.37 0.00 0.00 40.66 42.50 1x2g h LEU 161 CO -0.34 -0.19 0.38 0.00 -0.34 0.00 0.00 178.44 177.95 1x2g h ALA 162 N 1.23 2.40 0.00 1.25 0.00 -1.87 0.73 119.26 123.00 1x2g h ALA 162 Ca 0.19 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1x2g h ALA 162 Cb 0.37 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1x2g h ALA 162 CO -0.44 -0.63 0.00 0.09 0.00 0.00 0.00 179.25 178.27 1x2g n ASN 163 N -4.24 0.00 -0.06 0.00 3.02 -0.57 -3.46 115.26 109.95 1x2g n ASN 163 Ca 0.09 0.46 0.01 0.00 -0.03 0.00 0.00 54.58 55.11 1x2g n ASN 163 Cb 0.59 -0.48 0.01 0.00 -0.61 0.00 0.00 39.78 39.29 1x2g n ASN 163 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1x2g n TYR 164 N -1.48 0.01 -4.17 3.10 4.01 0.24 -4.85 117.16 114.02 1x2g n TYR 164 Ca 0.04 -0.05 -0.33 0.00 -0.16 0.00 0.00 57.90 57.39 1x2g n TYR 164 Cb 0.16 -0.01 -0.08 0.00 -0.31 0.00 0.00 39.34 39.10 1x2g n TYR 164 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1x2g s LEU 165 N -0.22 3.73 0.50 7.72 1.43 -1.18 0.10 118.68 130.77 1x2g s LEU 165 Ca 0.02 0.07 -0.19 0.00 -1.03 0.00 0.00 54.13 53.00 1x2g s LEU 165 Cb 0.01 -2.17 -0.08 0.00 0.03 0.00 0.00 46.19 43.98 1x2g s LEU 165 CO 0.02 0.27 1.03 0.20 0.23 0.00 0.00 176.35 178.09 1x2g s ASN 166 N -1.69 6.34 0.31 2.29 0.01 0.22 -4.62 114.94 117.80 1x2g s ASN 166 Ca 0.22 1.85 -0.29 0.00 -0.71 0.00 0.00 52.86 53.92 1x2g s ASN 166 Cb -0.12 -2.55 -0.11 0.00 0.41 0.00 0.00 41.25 38.89 1x2g s ASN 166 CO 0.13 -0.78 1.45 -2.84 -1.51 0.00 0.00 177.10 173.54 1x2g s PRO 167 N -3.46 4.22 -0.48 -0.60 0.02 -1.26 -4.96 135.00 128.48 1x2g s PRO 167 Ca 0.65 2.40 -0.03 0.00 0.02 0.00 0.00 61.00 64.04 1x2g s PRO 167 Cb -0.15 -3.05 0.13 0.00 0.02 0.00 0.00 34.50 31.45 1x2g s PRO 167 CO 0.23 -0.43 0.28 0.34 -0.33 0.00 0.00 177.00 177.10 1x2g s ASP 168 N 0.05 5.26 0.24 2.53 -1.08 -1.26 -5.01 116.67 117.39 1x2g s ASP 168 Ca 0.56 -2.30 -0.05 0.00 -0.52 0.00 0.00 52.55 50.23 1x2g s ASP 168 Cb -0.44 -1.84 0.35 0.00 -1.46 0.00 0.00 42.92 39.54 1x2g s ASP 168 CO 0.51 -0.49 1.82 0.11 0.52 0.00 0.00 175.17 177.64 1x2g h LYS 169 N 7.72 0.79 -0.01 4.34 6.56 -1.98 0.16 116.57 134.15 1x2g h LYS 169 Ca -0.10 -0.05 -0.14 0.00 -1.06 0.00 0.00 60.65 59.30 1x2g h LYS 169 Cb 1.02 -0.18 -0.02 0.00 -0.57 0.00 0.00 32.23 32.48 1x2g h LYS 169 CO 0.71 0.52 -0.68 0.87 -2.06 0.00 0.00 179.45 178.81 1x2g h LYS 170 N 0.81 0.03 -0.53 3.15 1.57 -1.98 0.77 116.57 120.40 1x2g h LYS 170 Ca 0.37 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 59.05 1x2g h LYS 170 Cb 0.29 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 1x2g h LYS 170 CO -0.22 0.70 0.00 -0.22 -0.57 0.00 0.00 179.45 179.14 1x2g h LYS 171 N 0.02 0.93 -0.02 3.15 3.64 -1.79 -1.33 116.57 121.16 1x2g h LYS 171 Ca -0.01 -0.29 -0.00 0.00 -1.27 0.00 0.00 60.65 59.08 1x2g h LYS 171 Cb 1.20 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.94 1x2g h LYS 171 CO 0.09 0.94 0.01 -0.07 -2.27 0.00 0.00 179.45 178.15 1x2g h LEU 172 N 0.80 0.03 -0.53 5.20 3.38 -0.20 -3.16 115.31 120.83 1x2g h LEU 172 Ca 0.15 -0.16 0.09 0.00 0.09 0.00 0.00 57.88 58.05 1x2g h LEU 172 Cb 0.52 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.20 1x2g h LEU 172 CO 0.03 0.18 0.14 0.00 0.09 0.00 0.00 178.44 178.87 1x2g h ALA 173 N 0.85 0.62 -1.97 1.53 0.00 0.57 -3.42 119.26 117.45 1x2g h ALA 173 Ca 0.01 0.10 -0.40 0.00 0.00 0.00 0.00 54.91 54.61 1x2g h ALA 173 Cb 0.16 0.11 0.20 0.00 0.00 0.00 0.00 17.79 18.26 1x2g h ALA 173 CO -0.00 -0.27 0.04 0.00 0.00 0.00 0.00 179.25 179.02 1x2g s ALA 174 N -6.13 0.14 0.00 0.00 0.00 -0.51 -5.05 121.76 110.22 1x2g s ALA 174 Ca -0.13 -0.96 0.00 0.00 0.00 0.00 0.00 51.96 50.87 1x2g s ALA 174 Cb 0.16 -2.88 0.00 0.00 0.00 0.00 0.00 23.12 20.40 1x2g s ALA 174 CO 0.73 -4.00 0.00 1.17 0.00 0.00 0.00 175.76 173.67 1x2g n LYS 175 N -5.11 0.00 0.00 0.00 4.81 -1.26 -4.92 118.16 111.68 1x2g n LYS 175 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.58 1x2g n LYS 175 Cb 0.60 -0.04 0.00 0.00 0.02 0.00 0.00 35.03 35.61 1x2g n LYS 175 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1x2g n GLY 176 N -0.58 1.22 0.00 3.14 0.00 -1.26 -5.17 105.19 102.55 1x2g n GLY 176 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1x2g n GLY 176 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1x2g n ARG 183 N 0.00 0.00 -4.27 1.61 0.63 -1.26 -5.22 116.66 108.15 1x2g n ARG 183 Ca 0.00 0.00 -0.31 0.00 -0.92 0.00 0.00 57.85 56.62 1x2g n ARG 183 Cb 0.00 0.00 -0.09 0.00 0.45 0.00 0.00 32.46 32.82 1x2g n ARG 183 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1x2g s VAL 184 N 0.00 3.84 0.04 5.15 1.01 -1.26 0.52 120.40 129.70 1x2g s VAL 184 Ca 0.00 -0.89 0.02 0.00 0.00 0.00 0.00 61.98 61.11 1x2g s VAL 184 Cb 0.00 -2.75 -0.02 0.00 0.00 0.00 0.00 36.38 33.60 1x2g s VAL 184 CO 0.00 0.25 -0.08 -0.89 0.00 0.00 0.00 175.10 174.38 1x2g s THR 185 N -1.16 0.57 0.31 3.92 2.01 -0.01 -4.81 115.64 116.48 1x2g s THR 185 Ca 0.21 -0.99 -0.23 0.00 0.31 0.00 0.00 61.69 60.99 1x2g s THR 185 Cb -0.11 -0.61 -0.10 0.00 0.01 0.00 0.00 72.50 71.69 1x2g s THR 185 CO 0.13 -0.31 0.87 0.20 -0.69 0.00 0.00 174.62 174.82 1x2g s ASN 186 N -1.41 7.16 0.45 3.53 0.02 -1.26 -4.51 114.94 118.90 1x2g s ASN 186 Ca -0.08 1.66 0.22 0.00 -1.02 0.00 0.00 52.86 53.64 1x2g s ASN 186 Cb -0.09 -2.51 1.03 0.00 0.02 0.00 0.00 41.25 39.70 1x2g s ASN 186 CO 0.00 -0.10 1.89 -0.07 0.02 0.00 0.00 177.10 178.85 1x2g h LEU 187 N 2.96 0.00 -1.31 0.60 3.38 -0.18 -2.15 115.31 118.61 1x2g h LEU 187 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1x2g h LEU 187 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1x2g h LEU 187 CO 0.64 0.24 0.00 0.00 0.09 0.00 0.00 178.44 179.42 1x2g h THR 188 N 0.00 0.00 0.00 0.22 1.03 -1.47 0.22 112.91 112.91 1x2g h THR 188 Ca -0.00 -0.14 -0.10 0.00 -0.01 0.00 0.00 66.41 66.15 1x2g h THR 188 Cb 0.62 0.82 -0.01 0.00 -1.07 0.00 0.00 68.15 68.50 1x2g h THR 188 CO 0.03 0.00 -0.50 -0.33 -0.01 0.00 0.00 175.52 174.71 1x2g h GLU 189 N 0.00 0.00 0.00 0.00 4.39 -1.66 -3.28 114.58 114.04 1x2g h GLU 189 Ca 0.00 0.00 -0.42 0.00 0.34 0.00 0.00 59.36 59.28 1x2g h GLU 189 Cb 0.19 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 28.77 1x2g h GLU 189 CO 0.00 0.50 -2.47 1.28 -1.16 0.00 0.00 179.01 177.15 1x2g n LEU 190 N -3.69 2.59 -4.02 1.33 4.77 -0.30 -4.88 117.00 112.80 1x2g n LEU 190 Ca -0.01 0.05 -0.33 0.00 -0.03 0.00 0.00 56.01 55.69 1x2g n LEU 190 Cb 0.56 -0.89 -0.10 0.00 -2.33 0.00 0.00 43.42 40.66 1x2g n LEU 190 CO 0.39 0.80 0.04 -0.76 -1.33 0.00 0.00 177.39 176.54 1x2g s LEU 191 N -6.91 5.01 0.51 2.23 1.43 0.62 -4.97 118.68 116.60 1x2g s LEU 191 Ca -0.36 -3.30 0.25 0.00 -1.03 0.00 0.00 54.13 49.69 1x2g s LEU 191 Cb 0.11 -1.77 1.37 0.00 0.03 0.00 0.00 46.19 45.92 1x2g s LEU 191 CO 0.57 -0.24 2.05 1.55 0.23 0.00 0.00 176.35 180.51 1x2g h PRO 192 N 6.33 0.00 -0.01 1.29 0.13 -1.82 -2.17 132.00 135.76 1x2g h PRO 192 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1x2g h PRO 192 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1x2g h PRO 192 CO 0.74 0.13 -0.08 0.41 -0.23 0.00 0.00 178.00 178.98 1x2g n GLY 193 N -0.72 -0.63 3.73 1.56 0.00 -1.26 -4.97 105.19 102.90 1x2g n GLY 193 Ca -0.02 -0.33 -0.42 0.00 0.00 0.00 0.00 46.02 45.26 1x2g n GLY 193 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1x2g s ILE 194 N -2.25 3.08 0.37 -0.61 2.07 -0.81 -5.00 121.20 118.04 1x2g s ILE 194 Ca 0.34 0.86 0.08 0.00 -1.41 0.00 0.00 60.65 60.53 1x2g s ILE 194 Cb 0.21 -3.55 -0.06 0.00 0.13 0.00 0.00 42.46 39.19 1x2g s ILE 194 CO 0.42 0.11 0.03 0.42 -1.91 0.00 0.00 174.94 174.01 1x2g s THR 195 N 0.37 2.40 0.12 4.00 -4.23 -1.26 -4.96 115.64 112.08 1x2g s THR 195 Ca 0.60 -1.96 -0.20 0.00 -1.18 0.00 0.00 61.69 58.95 1x2g s THR 195 Cb -0.38 -2.85 -0.06 0.00 1.34 0.00 0.00 72.50 70.55 1x2g s THR 195 CO 0.37 -0.13 1.72 -0.74 -0.54 0.00 0.00 174.62 175.31 1x2g h HIS 196 N 1.76 -0.01 -0.83 3.99 2.76 -1.94 -2.29 115.15 118.59 1x2g h HIS 196 Ca -0.43 0.01 0.05 0.00 -2.20 0.00 0.00 60.37 57.80 1x2g h HIS 196 Cb 1.25 0.03 -0.05 0.00 1.55 0.00 0.00 27.41 30.19 1x2g h HIS 196 CO 0.70 -0.02 0.54 0.93 -1.30 0.00 0.00 177.93 178.78 1x2g h GLU 197 N 0.05 0.95 -0.47 5.26 3.07 -1.98 -0.16 114.58 121.31 1x2g h GLU 197 Ca 0.08 -0.06 -0.12 0.00 -0.50 0.00 0.00 59.36 58.76 1x2g h GLU 197 Cb 0.10 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 27.78 1x2g h GLU 197 CO -0.13 0.63 -0.18 1.96 -1.40 0.00 0.00 179.01 179.88 1x2g h GLN 198 N 0.98 0.92 -0.11 2.33 4.20 -1.85 -0.68 115.11 120.91 1x2g h GLN 198 Ca 0.34 -0.36 -0.23 0.00 0.06 0.00 0.00 58.65 58.45 1x2g h GLN 198 Cb 0.10 -0.05 0.01 0.00 0.30 0.00 0.00 27.48 27.85 1x2g h GLN 198 CO -0.11 1.02 -0.84 0.28 -0.67 0.00 0.00 178.83 178.51 1x2g h VAL 199 N 0.80 1.28 -0.19 -0.54 2.07 -1.12 -0.09 116.25 118.46 1x2g h VAL 199 Ca 0.11 -2.04 0.05 0.00 0.82 0.00 0.00 66.70 65.64 1x2g h VAL 199 Cb 0.73 2.11 -0.06 0.00 -1.52 0.00 0.00 31.29 32.55 1x2g h VAL 199 CO 0.06 0.64 -0.19 0.00 0.02 0.00 0.00 177.57 178.10 1x2g h GLU 201 N -0.21 -0.11 -0.85 0.00 5.08 -0.97 -0.92 114.58 116.60 1x2g h GLU 201 Ca 0.12 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.53 1x2g h GLU 201 Cb 0.39 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.61 1x2g h GLU 201 CO -0.32 -0.08 0.54 0.00 -1.00 0.00 0.00 179.01 178.16 1x2g h ALA 202 N 1.08 1.14 -0.26 3.43 0.00 -0.85 -2.23 119.26 121.57 1x2g h ALA 202 Ca 0.14 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 1x2g h ALA 202 Cb 0.33 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1x2g h ALA 202 CO -0.34 0.35 -0.40 0.82 0.00 0.00 0.00 179.25 179.68 1x2g h ILE 203 N 1.03 1.30 -0.34 0.00 2.04 -0.72 -2.31 117.51 118.51 1x2g h ILE 203 Ca 0.35 -1.59 0.06 0.00 1.00 0.00 0.00 64.86 64.68 1x2g h ILE 203 Cb 0.06 1.70 -0.06 0.00 -0.74 0.00 0.00 36.82 37.78 1x2g h ILE 203 CO -0.14 0.51 -0.01 0.74 0.00 0.00 0.00 178.15 179.25 1x2g h THR 204 N 0.46 0.74 -0.63 -0.27 2.02 -1.03 0.14 112.91 114.33 1x2g h THR 204 Ca 0.02 -0.03 0.03 0.00 0.77 0.00 0.00 66.41 67.20 1x2g h THR 204 Cb 0.99 0.65 -0.04 0.00 -1.74 0.00 0.00 68.15 68.01 1x2g h THR 204 CO 0.09 0.02 0.39 -0.33 0.37 0.00 0.00 175.52 176.06 1x2g h GLU 205 N 0.08 0.75 0.00 6.66 4.39 -1.40 0.22 114.58 125.28 1x2g h GLU 205 Ca 0.17 -0.04 -0.07 0.00 0.34 0.00 0.00 59.36 59.75 1x2g h GLU 205 Cb 0.23 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.70 1x2g h GLU 205 CO -0.29 0.49 -0.34 0.00 -1.16 0.00 0.00 179.01 177.72 1x2g h ALA 206 N 1.27 1.41 0.23 3.43 0.00 -1.08 0.17 119.26 124.68 1x2g h ALA 206 Ca 0.25 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1x2g h ALA 206 Cb 0.01 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1x2g h ALA 206 CO -0.10 0.43 -0.11 0.35 0.00 0.00 0.00 179.25 179.82 1x2g h PHE 207 N 0.00 -0.29 -0.50 0.00 3.57 -0.09 -2.40 116.94 117.23 1x2g h PHE 207 Ca -0.00 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.57 1x2g h PHE 207 Cb 0.62 0.09 -0.06 0.00 2.79 0.00 0.00 35.95 39.39 1x2g h PHE 207 CO 0.00 0.10 0.15 0.74 -2.23 0.00 0.00 178.31 177.06 1x2g h PHE 208 N -0.83 0.25 -0.87 0.41 0.04 -0.53 -2.67 116.94 112.74 1x2g h PHE 208 Ca -0.03 0.03 0.10 0.00 2.80 0.00 0.00 57.97 60.87 1x2g h PHE 208 Cb 0.51 -0.04 -0.06 0.00 2.20 0.00 0.00 35.95 38.56 1x2g h PHE 208 CO 0.06 0.05 0.56 0.00 -0.60 0.00 0.00 178.31 178.38 1x2g h ALA 209 N 1.36 1.68 -0.28 2.45 0.00 -0.73 -0.93 119.26 122.82 1x2g h ALA 209 Ca 0.25 -0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.99 1x2g h ALA 209 Cb 0.30 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1x2g h ALA 209 CO -0.28 0.13 -0.49 1.25 0.00 0.00 0.00 179.25 179.86 1x2g h HIS 210 N 0.83 0.94 -0.02 0.00 -0.00 -1.10 -3.27 115.15 112.54 1x2g h HIS 210 Ca 0.40 -0.31 0.00 0.00 -0.00 0.00 0.00 60.37 60.46 1x2g h HIS 210 Cb 0.45 -0.19 0.00 0.00 -0.00 0.00 0.00 27.41 27.67 1x2g h HIS 210 CO -0.00 1.10 -0.32 0.66 -0.00 0.00 0.00 177.93 179.37 1x2g n TYR 211 N -4.01 0.00 -2.06 5.26 4.01 -1.08 -4.96 117.16 114.32 1x2g n TYR 211 Ca -0.03 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.58 1x2g n TYR 211 Cb 0.59 -0.03 -0.02 0.00 -0.31 0.00 0.00 39.34 39.58 1x2g n TYR 211 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1x2g n GLY 212 N 1.38 0.15 3.24 2.72 0.00 -0.38 -4.98 105.19 107.32 1x2g n GLY 212 Ca 0.11 -0.38 -0.10 0.00 0.00 0.00 0.00 46.02 45.66 1x2g n GLY 212 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1x2g s GLU 213 N -4.31 0.89 0.04 1.61 2.12 -1.11 -5.05 118.70 112.88 1x2g s GLU 213 Ca 0.00 -0.78 0.03 0.00 0.36 0.00 0.00 54.97 54.57 1x2g s GLU 213 Cb 0.00 0.38 -0.02 0.00 0.26 0.00 0.00 34.13 34.74 1x2g s GLU 213 CO 0.00 -0.30 -0.09 1.03 -0.54 0.00 0.00 175.26 175.36 1x2g s ARG 214 N -3.52 0.57 0.05 4.30 0.52 -1.26 -4.40 118.95 115.21 1x2g s ARG 214 Ca 0.02 -0.76 -0.02 0.00 -0.52 0.00 0.00 55.73 54.46 1x2g s ARG 214 Cb 0.03 -0.39 -0.04 0.00 0.52 0.00 0.00 34.95 35.07 1x2g s ARG 214 CO -0.09 0.08 -0.01 0.14 0.02 0.00 0.00 175.30 175.43 1x2g s VAL 215 N -1.28 0.21 0.34 3.52 -7.23 -1.26 -5.03 120.40 109.66 1x2g s VAL 215 Ca -0.08 -1.74 -0.27 0.00 -1.81 0.00 0.00 61.98 58.08 1x2g s VAL 215 Cb -0.10 -1.48 -0.09 0.00 0.56 0.00 0.00 36.38 35.27 1x2g s VAL 215 CO 0.01 -0.96 1.11 -1.61 -0.31 0.00 0.00 175.10 173.34 1x2g s GLU 216 N -3.87 4.38 0.08 4.82 0.41 -1.26 -4.96 118.70 118.30 1x2g s GLU 216 Ca 0.06 1.76 -0.31 0.00 -0.41 0.00 0.00 54.97 56.07 1x2g s GLU 216 Cb 0.07 -2.91 -0.08 0.00 -1.78 0.00 0.00 34.13 29.44 1x2g s GLU 216 CO -0.10 -0.01 1.52 0.00 -0.49 0.00 0.00 175.26 176.18 1x2g s ALA 217 N -1.34 3.65 -0.43 5.21 0.00 -1.26 -4.51 121.76 123.09 1x2g s ALA 217 Ca 0.51 1.14 -0.25 0.00 0.00 0.00 0.00 51.96 53.35 1x2g s ALA 217 Cb -0.30 -3.62 0.02 0.00 0.00 0.00 0.00 23.12 19.23 1x2g s ALA 217 CO 0.38 -0.89 0.90 -1.21 0.00 0.00 0.00 175.76 174.94 1x2g s GLU 218 N 1.97 3.61 -0.19 0.00 2.02 -0.25 -5.00 118.70 120.86 1x2g s GLU 218 Ca 0.69 0.25 -0.19 0.00 0.02 0.00 0.00 54.97 55.73 1x2g s GLU 218 Cb -0.38 -3.89 -0.03 0.00 0.10 0.00 0.00 34.13 29.93 1x2g s GLU 218 CO 0.30 -1.12 0.57 0.42 0.02 0.00 0.00 175.26 175.45 1x2g s ILE 219 N 3.59 5.07 0.05 -1.63 -1.09 -1.26 -1.37 121.20 124.56 1x2g s ILE 219 Ca 0.36 1.06 0.05 0.00 -2.23 0.00 0.00 60.65 59.89 1x2g s ILE 219 Cb -0.11 -3.89 -0.02 0.00 -1.58 0.00 0.00 42.46 36.86 1x2g s ILE 219 CO 0.23 0.16 -0.15 0.27 -1.23 0.00 0.00 174.94 174.22 1x2g s ILE 220 N 1.68 1.23 0.22 2.92 -4.36 -0.33 -4.95 121.20 117.61 1x2g s ILE 220 Ca 0.26 -1.10 -0.20 0.00 -0.26 0.00 0.00 60.65 59.36 1x2g s ILE 220 Cb -0.16 -1.11 0.03 0.00 1.25 0.00 0.00 42.46 42.47 1x2g s ILE 220 CO 0.10 0.00 0.60 -0.94 0.24 0.00 0.00 174.94 174.95 1x2g s SER 221 N -1.26 -0.32 0.53 4.36 1.04 -1.26 -0.60 113.70 116.19 1x2g s SER 221 Ca 0.02 -0.45 0.18 0.00 0.48 0.00 0.00 55.95 56.19 1x2g s SER 221 Cb -0.08 0.63 1.35 0.00 0.10 0.00 0.00 66.02 68.02 1x2g s SER 221 CO 0.02 -1.14 2.16 -0.65 0.98 0.00 0.00 173.24 174.61 1x2g h PRO 222 N 2.09 0.00 0.00 4.02 0.11 -1.98 -3.17 132.00 133.07 1x2g h PRO 222 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1x2g h PRO 222 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1x2g h PRO 222 CO 0.32 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.38 1x2g n ASN 223 N -4.44 0.43 -3.84 -2.05 6.94 -1.26 -4.65 115.26 106.38 1x2g n ASN 223 Ca -0.03 0.69 -0.10 0.00 -0.02 0.00 0.00 54.58 55.12 1x2g n ASN 223 Cb 0.10 -0.75 -0.08 0.00 -2.36 0.00 0.00 39.78 36.69 1x2g n ASN 223 CO 0.00 0.00 0.00 -1.59 -1.03 0.00 0.00 177.26 174.64 1x2g s LYS 224 N -3.38 0.72 0.02 -3.83 0.00 -1.20 -5.14 119.74 106.93 1x2g s LYS 224 Ca -0.01 -0.66 -0.30 0.00 0.00 0.00 0.00 55.97 55.00 1x2g s LYS 224 Cb 0.05 0.30 -0.08 0.00 0.00 0.00 0.00 37.83 38.11 1x2g s LYS 224 CO 0.17 -0.21 1.75 0.99 0.00 0.00 0.00 175.35 178.04 1x2g s THR 225 N -2.72 3.20 0.92 3.79 2.01 -1.26 -4.59 115.64 116.98 1x2g s THR 225 Ca -0.04 0.42 -0.11 0.00 0.31 0.00 0.00 61.69 62.27 1x2g s THR 225 Cb -0.00 -3.27 0.15 0.00 0.01 0.00 0.00 72.50 69.38 1x2g s THR 225 CO -0.05 -0.02 1.11 -2.84 -0.69 0.00 0.00 174.62 172.13 1x2g s PRO 226 N 3.61 1.02 -1.29 4.92 0.02 -1.26 -4.90 135.00 137.11 1x2g s PRO 226 Ca 0.78 1.27 -0.16 0.00 0.02 0.00 0.00 61.00 62.91 1x2g s PRO 226 Cb -0.39 -1.75 0.10 0.00 0.02 0.00 0.00 34.50 32.49 1x2g s PRO 226 CO 0.34 -2.54 1.72 -3.47 -0.33 0.00 0.00 177.00 172.72 1x2g n ASP 227 N -4.14 4.91 -3.74 2.53 2.03 -1.26 -4.83 116.55 112.05 1x2g n ASP 227 Ca 0.09 -2.94 -0.13 0.00 0.52 0.00 0.00 54.79 52.34 1x2g n ASP 227 Cb 0.53 -1.67 -0.13 0.00 -0.72 0.00 0.00 41.12 39.13 1x2g n ASP 227 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1x2g s LEU 228 N 2.96 0.57 0.39 -2.67 1.43 -1.26 -5.14 118.68 114.96 1x2g s LEU 228 Ca 0.49 0.47 -0.26 0.00 -1.03 0.00 0.00 54.13 53.81 1x2g s LEU 228 Cb 0.04 0.67 -0.09 0.00 0.03 0.00 0.00 46.19 46.84 1x2g s LEU 228 CO 0.03 -0.15 1.20 -2.16 0.23 0.00 0.00 176.35 175.51 1x2g s PRO 229 N 1.09 4.07 -1.66 1.29 0.05 -1.26 -3.10 135.00 135.48 1x2g s PRO 229 Ca -0.08 1.92 0.00 0.00 0.05 0.00 0.00 61.00 62.89 1x2g s PRO 229 Cb -0.09 -2.73 0.00 0.00 0.05 0.00 0.00 34.50 31.72 1x2g s PRO 229 CO -0.07 -0.33 0.00 0.09 0.05 0.00 0.00 177.00 176.74 1x2g n ASN 230 N 0.17 -5.04 0.06 6.66 5.03 -1.26 -4.89 115.26 116.00 1x2g n ASN 230 Ca 0.04 0.39 -0.12 0.00 0.87 0.00 0.00 54.58 55.76 1x2g n ASN 230 Cb 0.46 -3.91 -0.06 0.00 -1.02 0.00 0.00 39.78 35.24 1x2g n ASN 230 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.26 175.58 1x2g h PHE 231 N 0.00 -0.20 -0.50 3.10 3.57 -1.90 -2.48 116.94 118.53 1x2g h PHE 231 Ca -0.32 0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.28 1x2g h PHE 231 Cb 1.07 0.09 -0.10 0.00 2.79 0.00 0.00 35.95 39.80 1x2g h PHE 231 CO 0.47 -0.12 -0.19 0.00 -2.23 0.00 0.00 178.31 176.23 1x2g h ALA 232 N 0.80 0.20 -0.46 2.41 0.00 -1.90 0.34 119.26 120.65 1x2g h ALA 232 Ca 0.02 0.18 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 1x2g h ALA 232 Cb 0.18 0.50 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1x2g h ALA 232 CO -0.06 -0.52 0.08 1.49 0.00 0.00 0.00 179.25 180.23 1x2g h GLU 233 N -0.08 0.77 -0.44 0.00 4.57 -1.97 -0.77 114.58 116.66 1x2g h GLU 233 Ca 0.24 -0.21 -0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1x2g h GLU 233 Cb 0.45 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.92 1x2g h GLU 233 CO -0.55 0.78 0.27 1.15 -1.18 0.00 0.00 179.01 179.48 1x2g h THR 234 N 0.63 1.14 -0.73 0.32 2.02 -0.93 -1.15 112.91 114.21 1x2g h THR 234 Ca 0.14 -0.31 -0.06 0.00 0.77 0.00 0.00 66.41 66.95 1x2g h THR 234 Cb 0.39 0.54 -0.03 0.00 -1.74 0.00 0.00 68.15 67.31 1x2g h THR 234 CO 0.01 0.14 0.21 0.15 0.37 0.00 0.00 175.52 176.40 1x2g h PHE 235 N 0.59 1.19 -0.13 3.16 3.57 -0.92 -0.13 116.94 124.27 1x2g h PHE 235 Ca 0.16 -0.13 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 1x2g h PHE 235 Cb -0.01 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.38 1x2g h PHE 235 CO -0.03 0.94 0.06 0.00 -2.23 0.00 0.00 178.31 177.05 1x2g h ALA 236 N 1.13 0.17 -0.04 2.41 0.00 -0.91 -2.41 119.26 119.61 1x2g h ALA 236 Ca 0.23 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1x2g h ALA 236 Cb 0.33 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1x2g h ALA 236 CO -0.00 -0.28 0.02 0.00 0.00 0.00 0.00 179.25 178.99 1x2g h ARG 237 N 0.09 0.05 -0.81 0.00 3.08 -1.11 -3.01 114.38 112.67 1x2g h ARG 237 Ca 0.04 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1x2g h ARG 237 Cb 0.11 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.11 1x2g h ARG 237 CO -0.01 0.15 0.51 0.37 -1.07 0.00 0.00 179.97 179.92 1x2g h GLN 238 N -0.06 1.08 -0.34 0.04 5.75 -1.02 -1.98 115.11 118.58 1x2g h GLN 238 Ca 0.01 -0.08 0.00 0.00 -0.15 0.00 0.00 58.65 58.43 1x2g h GLN 238 Cb 0.11 -0.24 0.00 0.00 1.07 0.00 0.00 27.48 28.43 1x2g h GLN 238 CO -0.00 0.74 0.00 -1.13 -2.65 0.00 0.00 178.83 175.78 1x2g n SER 239 N -4.39 1.89 -4.76 -0.69 3.41 -0.91 -4.68 113.62 103.49 1x2g n SER 239 Ca 0.09 -1.96 -0.40 0.00 -0.26 0.00 0.00 58.87 56.34 1x2g n SER 239 Cb 0.05 -0.22 -0.05 0.00 -0.26 0.00 0.00 64.21 63.72 1x2g n SER 239 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1x2g s SER 240 N -1.07 7.28 0.28 4.04 1.04 -0.75 -4.94 113.70 119.59 1x2g s SER 240 Ca 0.25 1.52 0.02 0.00 0.48 0.00 0.00 55.95 58.23 1x2g s SER 240 Cb 0.13 -2.48 0.68 0.00 0.10 0.00 0.00 66.02 64.45 1x2g s SER 240 CO 0.18 0.08 1.69 -0.25 0.98 0.00 0.00 173.24 175.92 1x2g h TRP 241 N 5.22 0.56 -0.01 5.02 7.01 -1.92 -0.50 115.95 131.34 1x2g h TRP 241 Ca -0.45 0.04 0.00 0.00 2.11 0.00 0.00 58.89 60.60 1x2g h TRP 241 Cb 1.21 -0.11 -0.00 0.00 -2.10 0.00 0.00 29.16 28.15 1x2g h TRP 241 CO 0.65 -0.06 0.01 0.93 -2.79 0.00 0.00 178.44 177.18 1x2g h GLU 242 N 0.37 0.00 0.08 2.65 4.39 -1.94 0.13 114.58 120.26 1x2g h GLU 242 Ca 0.53 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.95 1x2g h GLU 242 Cb 1.00 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.63 1x2g h GLU 242 CO -0.53 0.00 -1.49 2.35 -1.16 0.00 0.00 179.01 178.18 1x2g h TRP 243 N 0.00 0.29 -0.11 4.33 2.91 -1.42 -3.21 115.95 118.74 1x2g h TRP 243 Ca 0.01 -0.21 -0.06 0.00 1.13 0.00 0.00 58.89 59.75 1x2g h TRP 243 Cb 0.03 -0.01 -0.00 0.00 -0.51 0.00 0.00 29.16 28.67 1x2g h TRP 243 CO 0.00 1.59 -0.18 -0.91 -1.03 0.00 0.00 178.44 177.91 1x2g h ASN 244 N -0.46 0.35 0.00 2.65 2.35 -1.05 -3.42 115.58 116.01 1x2g h ASN 244 Ca -0.35 -0.54 0.00 0.00 -0.55 0.00 0.00 56.30 54.87 1x2g h ASN 244 Cb 1.66 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 39.93 1x2g h ASN 244 CO -0.03 0.82 0.00 0.49 -1.65 0.00 0.00 177.43 177.06 1x2g n PHE 245 N -4.54 0.00 0.00 1.19 3.72 0.42 -4.50 117.46 113.74 1x2g n PHE 245 Ca -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.33 1x2g n PHE 245 Cb 0.39 -0.04 0.00 0.00 -0.94 0.00 0.00 39.48 38.89 1x2g n PHE 245 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1x2g n GLY 246 N 1.92 -1.84 3.81 1.37 0.00 -0.94 -4.80 105.19 104.71 1x2g n GLY 246 Ca 0.00 -1.52 -0.35 0.00 0.00 0.00 0.00 46.02 44.16 1x2g n GLY 246 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1x2g s GLN 247 N -2.09 4.30 0.49 1.61 -0.21 -1.26 -5.01 119.66 117.48 1x2g s GLN 247 Ca 0.00 1.06 -0.24 0.00 0.02 0.00 0.00 55.36 56.20 1x2g s GLN 247 Cb 0.00 -2.53 -0.07 0.00 1.00 0.00 0.00 33.01 31.41 1x2g s GLN 247 CO 0.00 0.17 1.33 0.00 -2.12 0.00 0.00 175.29 174.67 1x2g n ALA 248 N -0.00 1.56 -1.81 6.09 0.00 -1.26 -4.95 120.51 120.14 1x2g n ALA 248 Ca 0.03 0.19 -0.42 0.00 0.00 0.00 0.00 53.44 53.25 1x2g n ALA 248 Cb 0.52 -2.33 -0.02 0.00 0.00 0.00 0.00 19.45 17.62 1x2g n ALA 248 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1x2g s PRO 249 N -2.56 4.17 -0.47 0.00 0.04 -1.26 -4.99 135.00 129.93 1x2g s PRO 249 Ca 0.66 2.49 0.03 0.00 0.04 0.00 0.00 61.00 64.21 1x2g s PRO 249 Cb -0.45 -3.07 0.14 0.00 0.04 0.00 0.00 34.50 31.16 1x2g s PRO 249 CO 0.54 -0.60 0.26 0.00 0.04 0.00 0.00 177.00 177.24 1x2g s ALA 250 N 0.33 2.47 0.21 8.56 0.00 -1.26 -5.09 121.76 126.99 1x2g s ALA 250 Ca 0.65 -2.80 0.05 0.00 0.00 0.00 0.00 51.96 49.86 1x2g s ALA 250 Cb -0.46 -1.95 -0.05 0.00 0.00 0.00 0.00 23.12 20.65 1x2g s ALA 250 CO 0.42 -2.05 -0.07 -0.06 0.00 0.00 0.00 175.76 174.00 1x2g s PHE 251 N 0.11 1.58 -0.16 0.00 0.40 -1.26 -5.05 117.98 113.60 1x2g s PHE 251 Ca 0.18 -0.76 0.21 0.00 -0.60 0.00 0.00 56.93 55.96 1x2g s PHE 251 Cb -0.23 -0.84 -0.13 0.00 0.51 0.00 0.00 43.02 42.33 1x2g s PHE 251 CO -0.01 0.14 0.80 -1.13 0.70 0.00 0.00 175.22 175.72 1x2g n SER 252 N -0.38 0.59 -4.47 1.36 3.41 -1.22 -4.92 113.62 107.99 1x2g n SER 252 Ca -0.07 0.24 -0.26 0.00 -0.26 0.00 0.00 58.87 58.52 1x2g n SER 252 Cb 0.62 0.81 -0.11 0.00 -0.26 0.00 0.00 64.21 65.28 1x2g n SER 252 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1x2g s HIS 253 N -3.27 2.37 -0.17 7.33 3.76 -0.62 -5.02 115.29 119.67 1x2g s HIS 253 Ca -0.03 -0.32 -0.07 0.00 -0.15 0.00 0.00 55.06 54.48 1x2g s HIS 253 Cb 0.10 -1.13 0.07 0.00 1.11 0.00 0.00 32.58 32.73 1x2g s HIS 253 CO 0.83 0.56 0.38 -1.17 -0.85 0.00 0.00 174.74 174.48 1x2g s LEU 254 N -2.93 -0.33 -0.05 0.89 2.96 -1.26 -2.41 118.68 115.56 1x2g s LEU 254 Ca 0.24 0.87 0.06 0.00 -0.22 0.00 0.00 54.13 55.07 1x2g s LEU 254 Cb -0.07 1.21 -0.01 0.00 0.50 0.00 0.00 46.19 47.82 1x2g s LEU 254 CO 0.12 -0.22 -0.23 -0.76 -1.32 0.00 0.00 176.35 173.94 1x2g s LEU 255 N 2.06 2.04 0.04 -0.68 1.43 0.73 -4.98 118.68 119.32 1x2g s LEU 255 Ca -0.05 -0.47 -0.10 0.00 -1.03 0.00 0.00 54.13 52.48 1x2g s LEU 255 Cb -0.11 -1.28 0.01 0.00 0.03 0.00 0.00 46.19 44.83 1x2g s LEU 255 CO -0.12 0.23 0.20 1.51 0.23 0.00 0.00 176.35 178.41 1x2g s ASP 256 N -0.17 0.02 -0.01 2.29 -4.77 -1.26 -0.04 116.67 112.73 1x2g s ASP 256 Ca -0.02 -0.34 -0.29 0.00 -3.30 0.00 0.00 52.55 48.60 1x2g s ASP 256 Cb -0.13 0.29 0.08 0.00 -1.09 0.00 0.00 42.92 42.08 1x2g s ASP 256 CO 0.03 -0.56 0.73 -0.70 0.70 0.00 0.00 175.17 175.38 1x2g s GLU 257 N -2.53 1.01 -0.26 2.11 2.56 -0.73 -5.02 118.70 115.85 1x2g s GLU 257 Ca -0.05 0.01 -0.01 0.00 0.00 0.00 0.00 54.97 54.92 1x2g s GLU 257 Cb -0.01 0.47 0.04 0.00 2.00 0.00 0.00 34.13 36.63 1x2g s GLU 257 CO -0.04 -0.36 -0.06 0.50 -0.56 0.00 0.00 175.26 174.74 1x2g s ARG 258 N -1.98 2.67 0.51 4.30 6.06 -1.26 -1.14 118.95 128.10 1x2g s ARG 258 Ca -0.05 -1.09 0.06 0.00 -2.50 0.00 0.00 55.73 52.15 1x2g s ARG 258 Cb -0.00 -2.99 0.04 0.00 0.06 0.00 0.00 34.95 32.06 1x2g s ARG 258 CO 0.01 -0.46 0.70 -0.06 -2.50 0.00 0.00 175.30 172.99 1x2g s PHE 259 N 1.27 2.46 0.54 5.12 0.40 0.02 -4.93 117.98 122.86 1x2g s PHE 259 Ca -0.02 -0.35 0.20 0.00 -0.60 0.00 0.00 56.93 56.16 1x2g s PHE 259 Cb -0.18 -2.49 1.41 0.00 0.51 0.00 0.00 43.02 42.27 1x2g s PHE 259 CO -0.04 -0.78 2.16 1.79 0.70 0.00 0.00 175.22 179.05 1x2g h THR 260 N 0.31 0.86 -0.37 0.64 1.35 -2.03 -2.64 112.91 111.04 1x2g h THR 260 Ca -0.38 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 1x2g h THR 260 Cb 1.28 0.98 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 1x2g h THR 260 CO 0.46 0.00 0.00 -2.67 -0.25 0.00 0.00 175.52 173.06 1x2g n TRP 261 N -4.36 0.47 0.00 4.73 4.27 -1.26 -5.02 117.44 116.27 1x2g n TRP 261 Ca -0.02 -0.23 0.00 0.00 -3.89 0.00 0.00 57.50 53.35 1x2g n TRP 261 Cb 0.13 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 30.08 1x2g n TRP 261 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1x2g n GLY 262 N 1.50 4.11 3.86 -1.67 0.00 -0.99 -4.27 105.19 107.73 1x2g n GLY 262 Ca 0.19 -1.31 -0.32 0.00 0.00 0.00 0.00 46.02 44.58 1x2g n GLY 262 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1x2g s GLY 263 N 0.00 2.21 -0.05 -0.02 0.00 -1.26 -0.80 107.32 107.41 1x2g s GLY 263 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 44.72 44.67 1x2g s GLY 263 CO 0.00 0.14 -0.02 0.14 0.00 0.00 0.00 173.10 173.36 1x2g s VAL 264 N -2.08 0.41 -0.13 1.40 1.01 -0.29 -2.87 120.40 117.84 1x2g s VAL 264 Ca 0.53 -0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.51 1x2g s VAL 264 Cb -0.10 -0.48 -0.01 0.00 0.00 0.00 0.00 36.38 35.79 1x2g s VAL 264 CO 0.22 0.21 -0.17 -1.61 0.00 0.00 0.00 175.10 173.75 1x2g s GLU 265 N 1.18 3.24 -0.25 2.72 2.02 -0.29 -1.78 118.70 125.54 1x2g s GLU 265 Ca -0.07 -0.76 0.03 0.00 0.02 0.00 0.00 54.97 54.19 1x2g s GLU 265 Cb -0.14 -2.55 0.06 0.00 0.10 0.00 0.00 34.13 31.60 1x2g s GLU 265 CO -0.02 0.13 -0.12 -1.17 0.02 0.00 0.00 175.26 174.11 1x2g s LEU 266 N 0.52 3.26 -0.13 1.80 2.96 0.95 -0.51 118.68 127.53 1x2g s LEU 266 Ca -0.11 -1.31 -0.05 0.00 -0.22 0.00 0.00 54.13 52.44 1x2g s LEU 266 Cb -0.16 -1.52 -0.04 0.00 0.50 0.00 0.00 46.19 44.97 1x2g s LEU 266 CO 0.04 -0.17 0.07 -1.00 -1.32 0.00 0.00 176.35 173.97 1x2g s HIS 267 N 1.14 3.34 0.19 5.38 3.76 0.23 -0.19 115.29 129.14 1x2g s HIS 267 Ca -0.07 0.27 -0.23 0.00 -0.15 0.00 0.00 55.06 54.88 1x2g s HIS 267 Cb -0.19 -1.93 0.05 0.00 1.11 0.00 0.00 32.58 31.62 1x2g s HIS 267 CO -0.06 0.47 0.76 -0.59 -0.85 0.00 0.00 174.74 174.46 1x2g s PHE 268 N -0.55 -0.29 0.07 1.40 -0.71 -1.01 -0.29 117.98 116.60 1x2g s PHE 268 Ca 0.11 -0.03 0.08 0.00 -1.04 0.00 0.00 56.93 56.04 1x2g s PHE 268 Cb -0.12 0.63 -0.04 0.00 -1.21 0.00 0.00 43.02 42.29 1x2g s PHE 268 CO 0.02 -0.97 -0.18 -0.51 -1.34 0.00 0.00 175.22 172.25 1x2g s ASP 269 N -2.83 3.86 -0.10 1.98 1.01 -0.41 -1.58 116.67 118.59 1x2g s ASP 269 Ca 0.08 -0.47 0.02 0.00 0.71 0.00 0.00 52.55 52.89 1x2g s ASP 269 Cb -0.03 -0.60 0.01 0.00 1.01 0.00 0.00 42.92 43.31 1x2g s ASP 269 CO -0.01 0.23 -0.16 -0.69 0.21 0.00 0.00 175.17 174.74 1x2g s VAL 270 N -1.01 1.57 -0.03 -1.27 1.01 -1.26 -1.61 120.40 117.79 1x2g s VAL 270 Ca 0.16 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.42 1x2g s VAL 270 Cb -0.11 -1.41 0.01 0.00 0.00 0.00 0.00 36.38 34.88 1x2g s VAL 270 CO 0.07 0.45 0.07 -1.61 0.00 0.00 0.00 175.10 174.09 1x2g s GLU 271 N 0.85 0.07 -1.42 2.72 2.02 -0.22 -4.86 118.70 117.85 1x2g s GLU 271 Ca -0.09 0.15 -0.00 0.00 0.02 0.00 0.00 54.97 55.04 1x2g s GLU 271 Cb -0.15 -0.03 0.00 0.00 0.10 0.00 0.00 34.13 34.05 1x2g s GLU 271 CO 0.00 -0.05 0.37 1.63 0.02 0.00 0.00 175.26 177.23 1x2g n LYS 272 N 3.36 -3.02 -0.75 1.61 5.02 -1.26 -2.11 118.16 121.01 1x2g n LYS 272 Ca -0.16 0.37 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 1x2g n LYS 272 Cb 0.57 -4.42 0.00 0.00 -0.02 0.00 0.00 35.03 31.16 1x2g n LYS 272 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1x2g n GLY 273 N -2.05 0.36 3.36 0.72 0.00 -1.26 -4.97 105.19 101.35 1x2g n GLY 273 Ca -0.32 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.47 1x2g n GLY 273 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1x2g s HIS 274 N -2.04 2.00 -0.08 1.61 3.76 -0.90 -0.95 115.29 118.69 1x2g s HIS 274 Ca 0.00 -0.42 -0.30 0.00 -0.15 0.00 0.00 55.06 54.19 1x2g s HIS 274 Cb 0.00 -1.00 -0.03 0.00 1.11 0.00 0.00 32.58 32.66 1x2g s HIS 274 CO 0.00 0.39 1.27 0.42 -0.85 0.00 0.00 174.74 175.97 1x2g s ILE 275 N -1.84 4.16 -0.63 0.60 1.01 0.76 -1.05 121.20 124.20 1x2g s ILE 275 Ca 0.17 1.46 0.23 0.00 0.00 0.00 0.00 60.65 62.51 1x2g s ILE 275 Cb -0.07 -3.94 -0.15 0.00 0.01 0.00 0.00 42.46 38.31 1x2g s ILE 275 CO 0.08 -0.05 0.96 0.35 0.00 0.00 0.00 174.94 176.28 1x2g n THR 276 N 4.91 0.12 -3.62 2.92 -2.24 -0.63 0.35 114.28 116.08 1x2g n THR 276 Ca 0.12 -0.22 -0.06 0.00 -2.27 0.00 0.00 64.05 61.63 1x2g n THR 276 Cb 0.45 0.32 -0.05 0.00 -2.10 0.00 0.00 70.33 68.96 1x2g n THR 276 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1x2g s ARG 277 N -3.19 0.29 -0.10 -0.78 1.70 -1.26 -4.77 118.95 110.84 1x2g s ARG 277 Ca 0.03 0.08 -0.30 0.00 -0.47 0.00 0.00 55.73 55.08 1x2g s ARG 277 Cb 0.15 0.14 0.07 0.00 -0.57 0.00 0.00 34.95 34.74 1x2g s ARG 277 CO 0.82 -0.09 0.70 0.00 -1.08 0.00 0.00 175.30 175.65 1x2g s ALA 278 N -1.01 -1.78 -0.11 7.88 0.00 -1.26 -1.29 121.76 124.20 1x2g s ALA 278 Ca 0.04 1.48 -0.07 0.00 0.00 0.00 0.00 51.96 53.41 1x2g s ALA 278 Cb -0.01 -0.27 0.04 0.00 0.00 0.00 0.00 23.12 22.88 1x2g s ALA 278 CO -0.04 -0.36 0.26 -1.14 0.00 0.00 0.00 175.76 174.48 1x2g s GLN 279 N -0.85 0.25 -0.10 0.00 0.74 0.61 -4.95 119.66 115.36 1x2g s GLN 279 Ca -0.08 0.48 -0.01 0.00 0.05 0.00 0.00 55.36 55.80 1x2g s GLN 279 Cb -0.01 -0.01 -0.03 0.00 1.10 0.00 0.00 33.01 34.06 1x2g s GLN 279 CO 0.08 -0.11 -0.05 0.08 -0.55 0.00 0.00 175.29 174.73 1x2g s VAL 280 N 0.84 3.81 0.14 1.34 1.01 -1.26 -0.60 120.40 125.68 1x2g s VAL 280 Ca -0.06 -0.42 0.11 0.00 0.00 0.00 0.00 61.98 61.61 1x2g s VAL 280 Cb -0.07 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 1x2g s VAL 280 CO -0.05 0.56 -0.27 -0.36 0.00 0.00 0.00 175.10 174.98 1x2g s PHE 281 N -0.42 2.31 0.04 5.22 0.08 0.33 -4.95 117.98 120.59 1x2g s PHE 281 Ca 0.06 -0.38 -0.27 0.00 0.12 0.00 0.00 56.93 56.47 1x2g s PHE 281 Cb -0.12 -1.24 0.08 0.00 -0.57 0.00 0.00 43.02 41.17 1x2g s PHE 281 CO 0.02 0.35 0.73 -0.08 -0.10 0.00 0.00 175.22 176.14 1x2g s THR 282 N -1.11 0.00 -0.76 0.64 -1.32 0.40 -1.13 115.64 112.36 1x2g s THR 282 Ca 0.15 0.00 0.14 0.00 -1.21 0.00 0.00 61.69 60.76 1x2g s THR 282 Cb -0.10 -1.00 0.44 0.00 -1.51 0.00 0.00 72.50 70.33 1x2g s THR 282 CO 0.06 0.00 1.36 -0.90 -2.21 0.00 0.00 174.62 172.94 1x2g n ASP 283 N 0.11 3.48 -4.70 8.08 5.75 -1.14 -3.41 116.55 124.72 1x2g n ASP 283 Ca -0.15 -2.36 -0.40 0.00 -0.01 0.00 0.00 54.79 51.87 1x2g n ASP 283 Cb 0.61 -0.38 0.03 0.00 -1.03 0.00 0.00 41.12 40.36 1x2g n ASP 283 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1x2g n SER 284 N 0.32 2.26 -0.02 -1.12 2.88 -1.26 -3.36 113.62 113.32 1x2g n SER 284 Ca 0.17 1.01 -0.07 0.00 -1.33 0.00 0.00 58.87 58.65 1x2g n SER 284 Cb 0.63 -1.50 0.12 0.00 -0.75 0.00 0.00 64.21 62.71 1x2g n SER 284 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1x2g h LEU 285 N 1.58 0.61 -7.61 2.46 3.38 -1.90 0.18 115.31 114.00 1x2g h LEU 285 Ca -0.49 -0.25 -0.68 0.00 0.09 0.00 0.00 57.88 56.55 1x2g h LEU 285 Cb 1.31 -0.17 -0.36 0.00 0.09 0.00 0.00 40.66 41.53 1x2g h LEU 285 CO 0.57 0.90 -0.49 0.21 0.09 0.00 0.00 178.44 179.73 1x2g s ASN 286 N -6.83 5.04 0.09 -0.43 2.47 -1.26 -3.76 114.94 110.26 1x2g s ASN 286 Ca -0.08 -2.62 0.20 0.00 0.42 0.00 0.00 52.86 50.79 1x2g s ASN 286 Cb 0.13 -1.79 0.83 0.00 -1.45 0.00 0.00 41.25 38.96 1x2g s ASN 286 CO 0.82 -0.39 1.63 -2.65 -3.72 0.00 0.00 177.10 172.78 1x2g n PRO 287 N 3.76 0.07 -0.10 0.43 -0.02 -1.25 -4.30 135.00 133.60 1x2g n PRO 287 Ca 0.04 0.26 -0.07 0.00 -2.02 0.00 0.00 63.50 61.71 1x2g n PRO 287 Cb 0.38 -1.62 -0.01 0.00 -0.02 0.00 0.00 33.50 32.22 1x2g n PRO 287 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1x2g h ALA 288 N 2.51 -0.13 -0.06 3.55 0.00 -1.95 -0.68 119.26 122.51 1x2g h ALA 288 Ca 0.00 0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.03 1x2g h ALA 288 Cb 0.36 0.62 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1x2g h ALA 288 CO 0.00 -0.69 0.04 -1.00 0.00 0.00 0.00 179.25 177.60 1x2g h PRO 289 N -0.24 0.00 -0.14 0.00 0.13 -1.99 -0.17 132.00 129.59 1x2g h PRO 289 Ca 0.17 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.12 1x2g h PRO 289 Cb 0.51 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.64 1x2g h PRO 289 CO -0.49 0.00 -0.65 -0.07 -0.23 0.00 0.00 178.00 176.56 1x2g h LEU 290 N 0.00 0.61 -0.46 1.56 4.07 -1.47 -1.34 115.31 118.29 1x2g h LEU 290 Ca 0.03 -0.37 -0.15 0.00 0.08 0.00 0.00 57.88 57.47 1x2g h LEU 290 Cb 0.11 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 41.67 1x2g h LEU 290 CO -0.00 1.11 -0.36 -0.33 -1.08 0.00 0.00 178.44 177.77 1x2g h GLU 291 N 0.39 0.89 -0.02 1.13 5.08 -0.59 -1.30 114.58 120.15 1x2g h GLU 291 Ca -0.02 -0.45 -0.14 0.00 -1.00 0.00 0.00 59.36 57.75 1x2g h GLU 291 Cb 1.22 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.46 1x2g h GLU 291 CO 0.12 1.10 -0.65 0.00 -1.00 0.00 0.00 179.01 178.58 1x2g h ALA 292 N 0.85 0.88 0.33 3.43 0.00 -1.07 -1.75 119.26 121.92 1x2g h ALA 292 Ca 0.07 -0.58 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 1x2g h ALA 292 Cb 0.94 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1x2g h ALA 292 CO 0.09 0.79 -0.16 1.25 0.00 0.00 0.00 179.25 181.22 1x2g h LEU 293 N 0.06 -0.38 -0.89 0.00 5.85 -1.03 -1.30 115.31 117.62 1x2g h LEU 293 Ca -0.01 -0.01 0.24 0.00 0.84 0.00 0.00 57.88 58.94 1x2g h LEU 293 Cb 1.16 0.10 -0.14 0.00 0.37 0.00 0.00 40.66 42.14 1x2g h LEU 293 CO 0.09 -0.24 0.25 0.00 -0.34 0.00 0.00 178.44 178.20 1x2g h ALA 294 N 0.19 1.32 -0.51 1.25 0.00 -1.16 -0.29 119.26 120.06 1x2g h ALA 294 Ca -0.05 0.23 0.02 0.00 0.00 0.00 0.00 54.91 55.11 1x2g h ALA 294 Cb 0.36 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1x2g h ALA 294 CO 0.07 -0.48 0.31 0.78 0.00 0.00 0.00 179.25 179.94 1x2g h GLY 295 N 0.21 0.72 1.94 0.00 0.00 -0.79 -2.79 103.07 102.36 1x2g h GLY 295 Ca 0.57 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.66 1x2g h GLY 295 CO -0.66 0.21 -0.04 0.54 0.00 0.00 0.00 176.54 176.59 1x2g n ARG 296 N -4.78 0.16 0.19 4.80 1.74 -0.54 -3.80 116.66 114.43 1x2g n ARG 296 Ca 0.03 0.13 0.13 0.00 -0.77 0.00 0.00 57.85 57.37 1x2g n ARG 296 Cb 0.06 -1.68 0.29 0.00 -1.02 0.00 0.00 32.46 30.11 1x2g n ARG 296 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1x2g h LEU 297 N 0.00 0.00 -9.56 0.55 3.38 -0.80 -3.43 115.31 105.45 1x2g h LEU 297 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 1x2g h LEU 297 Cb 0.65 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.44 1x2g h LEU 297 CO 0.00 0.00 1.02 -1.10 0.09 0.00 0.00 178.44 178.45 1x2g s GLN 298 N -3.23 4.16 0.00 1.13 -1.52 -1.24 -1.74 119.66 117.21 1x2g s GLN 298 Ca 0.07 2.51 0.00 0.00 -1.95 0.00 0.00 55.36 55.99 1x2g s GLN 298 Cb 0.07 -3.36 0.00 0.00 -0.22 0.00 0.00 33.01 29.50 1x2g s GLN 298 CO 0.63 -0.75 0.00 0.41 -0.25 0.00 0.00 175.29 175.33 1x2g n GLY 299 N 4.03 1.62 3.77 3.09 0.00 0.15 -4.99 105.19 112.86 1x2g n GLY 299 Ca 0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 1x2g n GLY 299 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x2g n LEU 301 N 0.28 3.72 -4.57 0.00 7.94 -1.26 -0.17 117.00 122.93 1x2g n LEU 301 Ca 0.03 1.02 -0.41 0.00 -1.11 0.00 0.00 56.01 55.54 1x2g n LEU 301 Cb 0.43 -1.50 -0.02 0.00 0.53 0.00 0.00 43.42 42.87 1x2g n LEU 301 CO 0.56 0.03 1.74 -0.47 -1.11 0.00 0.00 177.39 178.14 1x2g s TYR 302 N 2.23 2.62 -0.28 1.96 5.04 -0.13 -4.25 117.35 124.54 1x2g s TYR 302 Ca 0.82 -1.16 -0.23 0.00 -2.44 0.00 0.00 57.07 54.06 1x2g s TYR 302 Cb -0.56 -4.69 0.11 0.00 0.35 0.00 0.00 41.96 37.17 1x2g s TYR 302 CO 0.39 -1.84 0.90 0.50 -1.34 0.00 0.00 175.55 174.16 1x2g s ARG 303 N 4.70 0.60 0.31 4.97 3.52 -1.26 -4.94 118.95 126.84 1x2g s ARG 303 Ca 0.52 0.79 0.07 0.00 -0.13 0.00 0.00 55.73 56.98 1x2g s ARG 303 Cb 0.02 0.25 0.79 0.00 -1.56 0.00 0.00 34.95 34.45 1x2g s ARG 303 CO 0.01 -0.08 1.75 0.00 -0.81 0.00 0.00 175.30 176.16 1x2g h ALA 304 N 5.02 1.68 0.00 6.12 0.00 -1.89 -1.49 119.26 128.70 1x2g h ALA 304 Ca -0.29 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1x2g h ALA 304 Cb 1.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1x2g h ALA 304 CO 0.11 -0.16 0.00 -0.40 0.00 0.00 0.00 179.25 178.80 1x2g n ASP 305 N -4.84 0.00 0.00 0.00 5.75 -1.26 -1.34 116.55 114.86 1x2g n ASP 305 Ca 0.24 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.02 1x2g n ASP 305 Cb 0.64 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.73 1x2g n ASP 305 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1x2g n LEU 307 N -0.25 0.00 0.01 -2.12 4.77 -0.56 -1.16 117.00 117.69 1x2g n LEU 307 Ca 0.00 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.81 1x2g n LEU 307 Cb 0.00 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 1x2g n LEU 307 CO 0.00 0.00 0.22 1.56 -1.33 0.00 0.00 177.39 177.84 1x2g h GLN 308 N 0.00 0.68 -0.66 3.23 4.20 -1.47 -2.63 115.11 118.46 1x2g h GLN 308 Ca 0.00 -0.61 0.06 0.00 0.06 0.00 0.00 58.65 58.15 1x2g h GLN 308 Cb 0.00 0.15 -0.05 0.00 0.30 0.00 0.00 27.48 27.87 1x2g h GLN 308 CO 0.00 1.22 0.37 0.37 -0.67 0.00 0.00 178.83 180.12 1x2g h GLN 309 N 0.44 0.67 -0.35 1.46 5.75 -1.38 0.25 115.11 121.94 1x2g h GLN 309 Ca -0.07 -0.04 -0.15 0.00 -0.15 0.00 0.00 58.65 58.24 1x2g h GLN 309 Cb 1.48 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 29.87 1x2g h GLN 309 CO 0.17 0.44 -0.37 0.93 -2.65 0.00 0.00 178.83 177.35 1x2g h GLU 310 N 0.69 0.83 -0.24 1.69 4.39 -1.83 -1.34 114.58 118.77 1x2g h GLU 310 Ca 0.29 -0.42 -0.10 0.00 0.34 0.00 0.00 59.36 59.47 1x2g h GLU 310 Cb 0.17 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.82 1x2g h GLU 310 CO -0.17 1.06 -0.24 0.00 -1.16 0.00 0.00 179.01 178.50 1x2g h GLU 312 N 0.29 0.00 -0.06 0.00 5.08 -0.81 -3.13 114.58 115.95 1x2g h GLU 312 Ca 0.04 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.42 1x2g h GLU 312 Cb 0.80 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.04 1x2g h GLU 312 CO 0.06 0.00 0.05 0.00 -1.00 0.00 0.00 179.01 178.12 1x2g h ALA 313 N 2.17 1.96 0.00 3.43 0.00 -1.23 -2.71 119.26 122.88 1x2g h ALA 313 Ca 0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1x2g h ALA 313 Cb 0.82 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1x2g h ALA 313 CO 0.00 -0.08 -0.21 -0.07 0.00 0.00 0.00 179.25 178.89 1x2g h LEU 314 N 0.00 0.00 -0.89 0.00 3.38 -1.66 -3.37 115.31 112.77 1x2g h LEU 314 Ca 0.03 0.00 0.21 0.00 0.09 0.00 0.00 57.88 58.21 1x2g h LEU 314 Cb 0.13 0.00 -0.16 0.00 0.09 0.00 0.00 40.66 40.71 1x2g h LEU 314 CO -0.00 0.21 -0.08 -0.07 0.09 0.00 0.00 178.44 178.59 1x2g h LEU 315 N 0.00 -0.60 -1.58 1.67 3.38 -1.66 -1.34 115.31 115.18 1x2g h LEU 315 Ca -0.00 0.25 0.16 0.00 0.09 0.00 0.00 57.88 58.38 1x2g h LEU 315 Cb 0.57 0.48 -0.05 0.00 0.09 0.00 0.00 40.66 41.75 1x2g h LEU 315 CO 0.03 -0.28 0.51 1.62 0.09 0.00 0.00 178.44 180.41 1x2g h VAL 316 N 0.03 0.78 -0.01 1.22 3.04 -1.83 -1.16 116.25 118.33 1x2g h VAL 316 Ca 0.48 -0.14 0.00 0.00 -1.01 0.00 0.00 66.70 66.03 1x2g h VAL 316 Cb 0.85 0.34 0.00 0.00 -2.01 0.00 0.00 31.29 30.47 1x2g h VAL 316 CO -0.86 0.07 -0.52 0.47 -1.01 0.00 0.00 177.57 175.73 1x2g n ASP 317 N -4.48 1.06 -3.03 3.17 8.00 -0.53 -4.45 116.55 116.30 1x2g n ASP 317 Ca 0.15 -0.85 -0.24 0.00 0.71 0.00 0.00 54.79 54.56 1x2g n ASP 317 Cb 0.55 0.41 -0.04 0.00 -0.02 0.00 0.00 41.12 42.03 1x2g n ASP 317 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1x2g n PHE 318 N -0.95 2.94 -0.31 1.24 3.72 -0.44 -4.95 117.46 118.70 1x2g n PHE 318 Ca 0.08 -3.95 0.03 0.00 -0.05 0.00 0.00 57.45 53.56 1x2g n PHE 318 Cb 0.36 -0.47 0.22 0.00 -0.94 0.00 0.00 39.48 38.65 1x2g n PHE 318 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1x2g h PRO 319 N 3.03 1.04 0.00 -1.08 0.11 -1.78 0.33 132.00 133.66 1x2g h PRO 319 Ca 0.12 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 66.17 1x2g h PRO 319 Cb 0.64 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 31.51 1x2g h PRO 319 CO 0.73 0.69 0.00 0.39 -0.21 0.00 0.00 178.00 179.60 1x2g n GLU 320 N -4.48 0.06 -0.90 1.05 -0.58 -1.26 -2.65 120.64 111.88 1x2g n GLU 320 Ca 0.14 0.20 -0.04 0.00 -0.42 0.00 0.00 57.16 57.04 1x2g n GLU 320 Cb 0.18 -1.60 0.18 0.00 -0.57 0.00 0.00 31.44 29.62 1x2g n GLU 320 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1x2g n GLN 321 N -1.71 1.99 -0.00 3.49 3.00 0.10 -4.80 117.38 119.44 1x2g n GLN 321 Ca 0.05 -3.38 -0.06 0.00 -0.01 0.00 0.00 57.00 53.60 1x2g n GLN 321 Cb 0.26 -1.81 0.14 0.00 0.00 0.00 0.00 30.24 28.83 1x2g n GLN 321 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.06 178.11 1x2g h GLU 322 N 1.18 0.54 0.08 -1.09 4.11 -1.43 -2.26 114.58 115.73 1x2g h GLU 322 Ca 0.16 -0.24 -0.00 0.00 0.07 0.00 0.00 59.36 59.35 1x2g h GLU 322 Cb 1.35 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.59 1x2g h GLU 322 CO 0.31 0.80 -0.04 -0.22 0.07 0.00 0.00 179.01 179.94 1x2g h LYS 323 N 0.46 -0.11 -0.55 1.06 3.64 -1.87 -0.84 116.57 118.37 1x2g h LYS 323 Ca 0.05 0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.54 1x2g h LYS 323 Cb 0.80 0.02 -0.11 0.00 -0.41 0.00 0.00 32.23 32.54 1x2g h LYS 323 CO 0.07 0.10 -0.31 0.93 -2.27 0.00 0.00 179.45 177.96 1x2g h GLU 324 N -0.30 -0.16 -0.47 1.90 3.07 -1.87 -1.53 114.58 115.20 1x2g h GLU 324 Ca -0.01 0.01 -0.08 0.00 -0.50 0.00 0.00 59.36 58.78 1x2g h GLU 324 Cb 0.26 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.18 1x2g h GLU 324 CO 0.02 -0.11 -0.03 -0.07 -1.40 0.00 0.00 179.01 177.42 1x2g h LEU 325 N -0.16 0.78 -0.47 1.33 3.38 -1.26 -1.45 115.31 117.46 1x2g h LEU 325 Ca 0.23 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1x2g h LEU 325 Cb 0.54 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1x2g h LEU 325 CO -0.64 0.87 0.19 0.03 0.09 0.00 0.00 178.44 178.98 1x2g h ARG 326 N 0.75 0.71 -0.12 1.13 -0.00 -0.87 -1.22 114.38 114.76 1x2g h ARG 326 Ca 0.14 -0.13 -0.01 0.00 -0.50 0.00 0.00 59.98 59.48 1x2g h ARG 326 Cb 0.50 -0.11 -0.00 0.00 0.00 0.00 0.00 29.97 30.35 1x2g h ARG 326 CO 0.03 0.64 0.03 0.93 0.00 0.00 0.00 179.97 181.60 1x2g h GLU 327 N 0.62 0.18 -0.41 0.04 5.08 -1.17 -0.79 114.58 118.14 1x2g h GLU 327 Ca 0.16 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.52 1x2g h GLU 327 Cb 0.20 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.38 1x2g h GLU 327 CO -0.01 0.33 0.18 -0.07 -1.00 0.00 0.00 179.01 178.44 1x2g h LEU 328 N -0.00 0.24 -0.08 1.33 3.38 -1.19 0.09 115.31 119.07 1x2g h LEU 328 Ca 0.04 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.05 1x2g h LEU 328 Cb 0.22 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1x2g h LEU 328 CO -0.00 0.17 0.01 -1.28 0.09 0.00 0.00 178.44 177.43 1x2g h SER 329 N 0.37 -0.02 -0.59 -0.43 0.87 -1.16 -2.75 113.55 109.84 1x2g h SER 329 Ca 0.18 0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.77 1x2g h SER 329 Cb 0.13 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.08 1x2g h SER 329 CO -0.16 0.01 0.38 0.00 -0.53 0.00 0.00 176.83 176.53 1x2g h ALA 330 N 1.06 0.76 0.00 6.23 0.00 -0.94 -2.12 119.26 124.24 1x2g h ALA 330 Ca 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1x2g h ALA 330 Cb 0.04 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1x2g h ALA 330 CO -0.06 0.15 0.00 1.87 0.00 0.00 0.00 179.25 181.21 1x2g n TRP 331 N -4.70 0.00 0.00 0.00 -0.00 0.00 -1.99 117.44 110.75 1x2g n TRP 331 Ca 0.05 -0.05 0.00 0.00 -0.00 0.00 0.00 57.50 57.49 1x2g n TRP 331 Cb 0.05 -0.09 0.00 0.00 -0.00 0.00 0.00 31.31 31.27 1x2g n TRP 331 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1x2g n ALA 333 N 0.72 0.00 -0.12 5.87 0.00 -0.80 -0.37 120.51 125.81 1x2g n ALA 333 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1x2g n ALA 333 Cb 0.07 0.00 0.15 0.00 0.00 0.00 0.00 19.45 19.67 1x2g n ALA 333 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1x2g h GLY 334 N 0.00 0.89 2.00 0.00 0.00 -1.68 -3.27 103.07 101.01 1x2g h GLY 334 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 47.33 46.75 1x2g h GLY 334 CO 0.00 0.54 0.00 0.00 0.00 0.00 0.00 176.54 177.08 1x2g h ALA 335 N 1.25 1.00 0.00 3.60 0.00 -0.97 -3.38 119.26 120.76 1x2g h ALA 335 Ca 0.15 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1x2g h ALA 335 Cb 0.43 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1x2g h ALA 335 CO 0.02 0.00 -0.40 0.28 0.00 0.00 0.00 179.25 179.14 1x2g h VAL 336 N 0.00 0.42 0.00 0.00 2.07 -1.81 -3.52 116.25 113.41 1x2g h VAL 336 Ca 0.00 -1.40 0.00 0.00 0.82 0.00 0.00 66.70 66.12 1x2g h VAL 336 Cb 0.88 0.89 0.00 0.00 -1.52 0.00 0.00 31.29 31.54 1x2g h VAL 336 CO 0.00 0.14 0.00 0.54 0.02 0.00 0.00 177.57 178.27