#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ly1 h GLU 42 N 0.00 0.19 -6.52 1.61 5.08 -2.05 -3.46 114.58 109.43 3ly1 h GLU 42 Ca 0.00 -0.15 -0.53 0.00 -1.00 0.00 0.00 59.36 57.68 3ly1 h GLU 42 Cb 0.00 0.03 0.03 0.00 0.50 0.00 0.00 28.75 29.31 3ly1 h GLU 42 CO 0.00 0.79 0.88 0.99 -1.00 0.00 0.00 179.01 180.67 3ly1 s THR 43 N -3.61 3.00 0.24 1.13 2.01 -1.26 -4.98 115.64 112.17 3ly1 s THR 43 Ca -0.03 0.63 -0.30 0.00 0.31 0.00 0.00 61.69 62.29 3ly1 s THR 43 Cb 0.12 -3.40 -0.09 0.00 0.01 0.00 0.00 72.50 69.13 3ly1 s THR 43 CO 0.80 0.03 0.95 -1.10 -0.69 0.00 0.00 174.62 174.61 3ly1 s GLN 44 N 1.70 4.84 0.60 4.92 -1.52 -1.26 -5.05 119.66 123.90 3ly1 s GLN 44 Ca 0.69 1.51 -0.17 0.00 -1.95 0.00 0.00 55.36 55.44 3ly1 s GLN 44 Cb -0.40 -3.27 -0.03 0.00 -0.22 0.00 0.00 33.01 29.09 3ly1 s GLN 44 CO 0.31 0.50 1.11 -1.25 -0.25 0.00 0.00 175.29 175.70 3ly1 s PRO 45 N -1.20 3.11 0.48 2.91 0.04 -1.26 -5.01 135.00 134.07 3ly1 s PRO 45 Ca 0.41 1.44 -0.23 0.00 0.04 0.00 0.00 61.00 62.66 3ly1 s PRO 45 Cb -0.26 -1.99 -0.07 0.00 0.04 0.00 0.00 34.50 32.22 3ly1 s PRO 45 CO 0.32 -1.01 1.22 -1.21 0.04 0.00 0.00 177.00 176.36 3ly1 s GLU 46 N -3.78 3.61 0.45 4.56 2.02 -1.26 -5.02 118.70 119.29 3ly1 s GLU 46 Ca 0.68 1.91 -0.21 0.00 0.02 0.00 0.00 54.97 57.37 3ly1 s GLU 46 Cb -0.21 -2.38 -0.10 0.00 0.10 0.00 0.00 34.13 31.54 3ly1 s GLU 46 CO 0.35 -0.71 1.00 -1.54 0.02 0.00 0.00 175.26 174.38 3ly1 s SER 47 N -1.23 6.64 0.40 -0.19 1.04 -1.26 -5.01 113.70 114.09 3ly1 s SER 47 Ca 0.65 1.84 -0.27 0.00 0.48 0.00 0.00 55.95 58.65 3ly1 s SER 47 Cb -0.32 -2.55 -0.10 0.00 0.10 0.00 0.00 66.02 63.15 3ly1 s SER 47 CO 0.39 -0.57 1.41 0.00 0.98 0.00 0.00 173.24 175.44 3ly1 s ALA 48 N -2.03 3.40 0.31 5.32 0.00 -1.26 -4.93 121.76 122.57 3ly1 s ALA 48 Ca 0.64 1.43 -0.29 0.00 0.00 0.00 0.00 51.96 53.74 3ly1 s ALA 48 Cb -0.14 -3.56 -0.12 0.00 0.00 0.00 0.00 23.12 19.30 3ly1 s ALA 48 CO 0.18 -0.99 1.39 0.00 0.00 0.00 0.00 175.76 176.34 3ly1 n ALA 49 N 0.25 1.59 -2.82 0.00 0.00 -1.26 -4.99 120.51 113.28 3ly1 n ALA 49 Ca 0.03 0.37 -0.33 0.00 0.00 0.00 0.00 53.44 53.51 3ly1 n ALA 49 Cb 0.41 -2.31 -0.13 0.00 0.00 0.00 0.00 19.45 17.42 3ly1 n ALA 49 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3ly1 s PHE 50 N -0.66 2.84 0.07 0.00 5.36 -1.26 -5.12 117.98 119.21 3ly1 s PHE 50 Ca 0.60 -0.35 0.06 0.00 -0.96 0.00 0.00 56.93 56.27 3ly1 s PHE 50 Cb -0.57 -1.78 -0.03 0.00 -0.34 0.00 0.00 43.02 40.30 3ly1 s PHE 50 CO 0.57 0.01 -0.16 0.95 -1.46 0.00 0.00 175.22 175.13 3ly1 s THR 51 N -0.12 1.25 0.32 0.12 -4.23 -1.26 -5.13 115.64 106.60 3ly1 s THR 51 Ca -0.00 -1.32 -0.28 0.00 -1.18 0.00 0.00 61.69 58.91 3ly1 s THR 51 Cb -0.13 -1.18 -0.13 0.00 1.34 0.00 0.00 72.50 72.40 3ly1 s THR 51 CO 0.03 -0.15 1.25 0.00 -0.54 0.00 0.00 174.62 175.22 3ly1 n ALA 52 N 1.32 1.03 -1.44 3.99 0.00 -1.26 -4.97 120.51 119.19 3ly1 n ALA 52 Ca -0.20 0.37 -0.29 0.00 0.00 0.00 0.00 53.44 53.32 3ly1 n ALA 52 Cb 0.54 -2.22 0.18 0.00 0.00 0.00 0.00 19.45 17.95 3ly1 n ALA 52 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3ly1 s PRO 53 N -1.69 0.34 0.27 0.00 0.04 -1.26 -5.08 135.00 127.61 3ly1 s PRO 53 Ca 0.57 0.11 -0.01 0.00 0.04 0.00 0.00 61.00 61.71 3ly1 s PRO 53 Cb -0.60 -1.76 -0.03 0.00 0.04 0.00 0.00 34.50 32.15 3ly1 s PRO 53 CO 0.61 -2.70 0.28 -1.54 0.04 0.00 0.00 177.00 173.68 3ly1 s SER 54 N -4.06 0.67 0.33 6.66 1.04 -0.80 -4.85 113.70 112.68 3ly1 s SER 54 Ca 0.68 -1.44 0.10 0.00 0.48 0.00 0.00 55.95 55.76 3ly1 s SER 54 Cb -0.12 0.51 0.56 0.00 0.10 0.00 0.00 66.02 67.06 3ly1 s SER 54 CO 0.54 -1.02 1.74 0.71 0.98 0.00 0.00 173.24 176.19 3ly1 h THR 55 N 2.35 1.32 -0.40 2.02 1.35 -1.85 -2.64 112.91 115.06 3ly1 h THR 55 Ca -0.30 -1.54 -0.08 0.00 -0.55 0.00 0.00 66.41 63.94 3ly1 h THR 55 Cb 1.24 1.79 -0.01 0.00 -1.73 0.00 0.00 68.15 69.44 3ly1 h THR 55 CO 0.44 0.45 -0.08 0.44 -0.25 0.00 0.00 175.52 176.51 3ly1 h ASP 56 N 0.06 0.75 -2.92 5.36 3.32 -1.96 -3.39 116.42 117.65 3ly1 h ASP 56 Ca 0.00 -0.35 -0.61 0.00 0.02 0.00 0.00 57.03 56.08 3ly1 h ASP 56 Cb 0.80 -0.21 -0.41 0.00 0.22 0.00 0.00 39.33 39.73 3ly1 h ASP 56 CO 0.06 0.93 -0.63 -3.20 -1.72 0.00 0.00 179.24 174.68 3ly1 n ASN 57 N -4.36 2.62 -4.91 6.45 2.85 -1.04 -5.11 115.26 111.76 3ly1 n ASN 57 Ca -0.01 -3.12 -0.27 0.00 -0.11 0.00 0.00 54.58 51.07 3ly1 n ASN 57 Cb 0.35 -0.73 0.01 0.00 1.24 0.00 0.00 39.78 40.65 3ly1 n ASN 57 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 3ly1 s PRO 58 N -1.36 3.23 -0.02 1.20 0.04 -1.02 -1.90 135.00 135.17 3ly1 s PRO 58 Ca 0.27 0.06 -0.30 0.00 0.04 0.00 0.00 61.00 61.07 3ly1 s PRO 58 Cb -0.02 -2.34 -0.04 0.00 0.04 0.00 0.00 34.50 32.15 3ly1 s PRO 58 CO -0.16 -0.44 1.18 0.42 0.04 0.00 0.00 177.00 178.04 3ly1 s ILE 59 N -2.85 4.25 -0.53 0.56 1.01 0.50 -4.94 121.20 119.20 3ly1 s ILE 59 Ca 0.50 1.59 -0.10 0.00 0.00 0.00 0.00 60.65 62.64 3ly1 s ILE 59 Cb -0.10 -4.02 0.14 0.00 0.01 0.00 0.00 42.46 38.48 3ly1 s ILE 59 CO 0.45 0.04 0.42 -0.13 0.00 0.00 0.00 174.94 175.72 3ly1 s ARG 60 N 1.79 2.68 -0.37 2.79 0.52 -1.26 -0.78 118.95 124.31 3ly1 s ARG 60 Ca 0.56 -1.90 0.12 0.00 -0.52 0.00 0.00 55.73 53.99 3ly1 s ARG 60 Cb -0.26 -4.02 0.44 0.00 0.52 0.00 0.00 34.95 31.64 3ly1 s ARG 60 CO 0.24 -1.22 1.03 0.44 0.02 0.00 0.00 175.30 175.81 3ly1 n ILE 61 N 4.73 1.63 -0.02 1.52 -5.35 -0.22 -4.81 119.36 116.83 3ly1 n ILE 61 Ca -0.05 -3.92 -0.01 0.00 -0.27 0.00 0.00 62.75 58.50 3ly1 n ILE 61 Cb 0.41 -0.23 -0.05 0.00 -1.74 0.00 0.00 39.64 38.04 3ly1 n ILE 61 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 3ly1 n ASN 62 N -0.26 3.54 -0.51 7.28 6.94 -1.07 -2.03 115.26 129.15 3ly1 n ASN 62 Ca 0.23 0.00 0.06 0.00 -0.02 0.00 0.00 54.58 54.84 3ly1 n ASN 62 Cb 0.75 0.83 0.10 0.00 -2.36 0.00 0.00 39.78 39.10 3ly1 n ASN 62 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 3ly1 n PHE 63 N -2.07 0.00 -3.12 -2.53 3.72 -1.26 -4.35 117.46 107.84 3ly1 n PHE 63 Ca -0.07 -0.75 -0.20 0.00 -0.05 0.00 0.00 57.45 56.38 3ly1 n PHE 63 Cb 0.54 -0.14 -0.00 0.00 -0.94 0.00 0.00 39.48 38.93 3ly1 n PHE 63 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3ly1 n ASN 64 N -0.69 -3.72 -4.81 4.37 3.02 -1.26 -4.96 115.26 107.21 3ly1 n ASN 64 Ca 0.11 -0.23 -0.33 0.00 -0.03 0.00 0.00 54.58 54.10 3ly1 n ASN 64 Cb 0.74 -3.10 -0.00 0.00 -0.61 0.00 0.00 39.78 36.80 3ly1 n ASN 64 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3ly1 s GLU 65 N -5.75 3.49 -0.14 3.52 2.02 -1.26 -4.88 118.70 115.70 3ly1 s GLU 65 Ca 0.30 1.21 -0.28 0.00 0.02 0.00 0.00 54.97 56.22 3ly1 s GLU 65 Cb -0.16 -2.06 -0.01 0.00 0.10 0.00 0.00 34.13 32.01 3ly1 s GLU 65 CO 0.36 -0.67 0.95 1.21 0.02 0.00 0.00 175.26 177.14 3ly1 s ASN 66 N -2.64 7.14 0.00 -0.19 3.84 -1.26 -4.86 114.94 116.97 3ly1 s ASN 66 Ca 0.64 1.41 0.30 0.00 0.21 0.00 0.00 52.86 55.42 3ly1 s ASN 66 Cb -0.15 -2.52 1.48 0.00 -0.55 0.00 0.00 41.25 39.51 3ly1 s ASN 66 CO 0.32 -0.45 2.03 -0.81 -2.79 0.00 0.00 177.10 175.40 3ly1 n PRO 67 N 5.18 0.50 -2.79 0.43 -0.04 -1.26 -4.65 135.00 132.37 3ly1 n PRO 67 Ca 0.08 -0.04 -0.39 0.00 -0.04 0.00 0.00 63.50 63.11 3ly1 n PRO 67 Cb 0.48 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.38 3ly1 n PRO 67 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3ly1 s LEU 68 N -2.53 4.51 0.00 1.53 1.43 -1.26 -4.82 118.68 117.54 3ly1 s LEU 68 Ca 0.29 1.87 0.00 0.00 -1.03 0.00 0.00 54.13 55.26 3ly1 s LEU 68 Cb 0.20 -3.76 0.00 0.00 0.03 0.00 0.00 46.19 42.66 3ly1 s LEU 68 CO 0.46 0.06 0.00 0.61 0.23 0.00 0.00 176.35 177.72 3ly1 n GLY 69 N 1.09 -2.96 3.73 -3.19 0.00 -1.26 -4.89 105.19 97.71 3ly1 n GLY 69 Ca -0.01 -0.45 -0.41 0.00 0.00 0.00 0.00 46.02 45.15 3ly1 n GLY 69 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3ly1 s SER 71 N -2.06 7.32 0.31 1.61 0.15 -1.26 -4.95 113.70 114.82 3ly1 s SER 71 Ca 0.00 1.99 0.07 0.00 0.70 0.00 0.00 55.95 58.71 3ly1 s SER 71 Cb 0.00 -2.60 0.79 0.00 -1.71 0.00 0.00 66.02 62.50 3ly1 s SER 71 CO 0.00 -0.19 1.76 -0.65 1.20 0.00 0.00 173.24 175.36 3ly1 h PRO 72 N 5.41 0.68 -0.30 5.44 0.11 -2.02 0.20 132.00 141.53 3ly1 h PRO 72 Ca -0.44 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 65.50 3ly1 h PRO 72 Cb 1.21 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 3ly1 h PRO 72 CO 0.73 0.45 -0.37 0.87 -0.21 0.00 0.00 178.00 179.47 3ly1 h LYS 73 N 0.70 0.68 -0.47 1.05 1.57 -1.99 -1.87 116.57 116.24 3ly1 h LYS 73 Ca 0.60 -0.33 -0.06 0.00 -1.87 0.00 0.00 60.65 58.99 3ly1 h LYS 73 Cb 1.01 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.30 3ly1 h LYS 73 CO -0.42 0.94 0.06 0.00 -0.57 0.00 0.00 179.45 179.47 3ly1 h ALA 74 N 1.03 0.63 -0.70 3.86 0.00 -1.36 -2.12 119.26 120.59 3ly1 h ALA 74 Ca 0.05 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 3ly1 h ALA 74 Cb 0.89 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 3ly1 h ALA 74 CO 0.08 0.37 0.42 1.96 0.00 0.00 0.00 179.25 182.08 3ly1 h GLN 75 N 0.66 0.94 -0.24 0.00 4.20 -0.53 -0.37 115.11 119.77 3ly1 h GLN 75 Ca 0.14 -0.08 -0.08 0.00 0.06 0.00 0.00 58.65 58.70 3ly1 h GLN 75 Cb 0.41 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 3ly1 h GLN 75 CO 0.01 0.66 -0.15 0.00 -0.67 0.00 0.00 178.83 178.68 3ly1 h ALA 76 N 1.51 0.34 -0.38 3.87 0.00 -1.11 -0.41 119.26 123.08 3ly1 h ALA 76 Ca 0.25 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.85 3ly1 h ALA 76 Cb -0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3ly1 h ALA 76 CO -0.05 0.23 0.24 0.00 0.00 0.00 0.00 179.25 179.67 3ly1 h ALA 77 N 0.70 0.48 -0.12 0.00 0.00 -0.96 -0.31 119.26 119.05 3ly1 h ALA 77 Ca 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3ly1 h ALA 77 Cb 0.67 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3ly1 h ALA 77 CO 0.04 -0.09 0.08 0.00 0.00 0.00 0.00 179.25 179.28 3ly1 h ALA 78 N 1.15 0.16 -0.20 0.00 0.00 -0.88 -0.92 119.26 118.57 3ly1 h ALA 78 Ca 0.14 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 3ly1 h ALA 78 Cb -0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3ly1 h ALA 78 CO -0.05 -0.36 0.12 0.00 0.00 0.00 0.00 179.25 178.97 3ly1 h ARG 79 N 0.16 0.27 0.00 0.00 3.08 -0.99 -2.97 114.38 113.94 3ly1 h ARG 79 Ca 0.05 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 3ly1 h ARG 79 Cb -0.02 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 3ly1 h ARG 79 CO -0.01 0.21 -0.05 -0.44 -1.07 0.00 0.00 179.97 178.61 3ly1 h ASP 80 N 0.25 0.00 1.26 7.04 3.32 -0.82 -2.57 116.42 124.91 3ly1 h ASP 80 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3ly1 h ASP 80 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3ly1 h ASP 80 CO -0.01 0.05 0.00 0.00 -1.72 0.00 0.00 179.24 177.55 3ly1 h ALA 81 N 1.95 1.00 -0.66 3.45 0.00 -1.00 -3.34 119.26 120.67 3ly1 h ALA 81 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3ly1 h ALA 81 Cb 0.21 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3ly1 h ALA 81 CO 0.01 0.00 0.36 0.28 0.00 0.00 0.00 179.25 179.89 3ly1 h VAL 82 N 0.00 1.21 0.00 0.00 2.07 -1.51 -1.37 116.25 116.65 3ly1 h VAL 82 Ca 0.00 -0.54 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 3ly1 h VAL 82 Cb 0.63 0.36 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 3ly1 h VAL 82 CO 0.00 0.23 -0.09 1.62 0.02 0.00 0.00 177.57 179.36 3ly1 h VAL 83 N 0.91 0.68 0.00 2.57 3.04 -1.78 -1.60 116.25 120.07 3ly1 h VAL 83 Ca 0.23 -0.35 0.00 0.00 -1.01 0.00 0.00 66.70 65.57 3ly1 h VAL 83 Cb 0.05 1.21 0.00 0.00 -2.01 0.00 0.00 31.29 30.54 3ly1 h VAL 83 CO -0.04 0.08 -0.41 0.29 -1.01 0.00 0.00 177.57 176.49 3ly1 n LYS 84 N -3.88 0.00 -0.02 4.17 5.02 -0.58 -4.44 118.16 118.44 3ly1 n LYS 84 Ca -0.02 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.36 3ly1 n LYS 84 Cb 0.18 -1.50 0.50 0.00 -0.02 0.00 0.00 35.03 34.19 3ly1 n LYS 84 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ly1 n ALA 85 N -1.50 2.59 0.31 7.82 0.00 -0.60 -1.98 120.51 127.14 3ly1 n ALA 85 Ca 0.06 -0.21 0.20 0.00 0.00 0.00 0.00 53.44 53.49 3ly1 n ALA 85 Cb 0.34 -1.24 0.93 0.00 0.00 0.00 0.00 19.45 19.47 3ly1 n ALA 85 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 3ly1 h ASN 86 N 0.51 0.00 -2.73 0.00 -1.07 -1.77 -3.44 115.58 107.07 3ly1 h ASN 86 Ca 0.00 0.00 -0.59 0.00 0.07 0.00 0.00 56.30 55.78 3ly1 h ASN 86 Cb 0.11 0.00 -0.09 0.00 -2.07 0.00 0.00 38.32 36.27 3ly1 h ASN 86 CO 0.00 0.00 -0.62 -0.13 0.07 0.00 0.00 177.43 176.75 3ly1 s ARG 87 N -3.88 2.57 0.35 4.14 0.52 -0.84 -5.10 118.95 116.71 3ly1 s ARG 87 Ca -0.02 -1.06 -0.27 0.00 -0.52 0.00 0.00 55.73 53.86 3ly1 s ARG 87 Cb 0.11 -2.44 -0.09 0.00 0.52 0.00 0.00 34.95 33.05 3ly1 s ARG 87 CO 0.47 0.45 1.21 0.71 0.02 0.00 0.00 175.30 178.17 3ly1 s TYR 88 N -1.81 3.14 -0.26 -0.53 2.02 -1.26 -4.93 117.35 113.72 3ly1 s TYR 88 Ca 0.29 1.52 -0.04 0.00 -0.37 0.00 0.00 57.07 58.47 3ly1 s TYR 88 Cb -0.09 -3.49 -0.04 0.00 -0.40 0.00 0.00 41.96 37.94 3ly1 s TYR 88 CO 0.20 -1.41 2.96 0.00 -1.57 0.00 0.00 175.55 175.73 3ly1 n ALA 89 N 0.53 6.17 0.09 3.71 0.00 -1.26 -4.76 120.51 125.00 3ly1 n ALA 89 Ca 0.02 -2.33 -0.13 0.00 0.00 0.00 0.00 53.44 51.00 3ly1 n ALA 89 Cb 0.44 -2.07 -0.08 0.00 0.00 0.00 0.00 19.45 17.74 3ly1 n ALA 89 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3ly1 h LYS 90 N 2.74 -0.17 -0.18 0.00 1.57 -1.95 -1.42 116.57 117.17 3ly1 h LYS 90 Ca 0.29 0.01 -0.14 0.00 -1.87 0.00 0.00 60.65 58.94 3ly1 h LYS 90 Cb 1.03 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.37 3ly1 h LYS 90 CO 0.59 -0.02 -0.48 -0.97 -0.57 0.00 0.00 179.45 178.00 3ly1 h ASN 91 N -0.28 0.50 -0.50 0.86 -1.24 -2.01 -2.79 115.58 110.13 3ly1 h ASN 91 Ca -0.02 -0.25 -0.03 0.00 0.71 0.00 0.00 56.30 56.71 3ly1 h ASN 91 Cb 0.23 -0.14 -0.03 0.00 0.73 0.00 0.00 38.32 39.11 3ly1 h ASN 91 CO 0.03 0.91 0.20 -0.33 -1.29 0.00 0.00 177.43 176.95 3ly1 h GLU 92 N 0.37 0.79 -0.59 6.67 3.07 -1.90 -2.51 114.58 120.49 3ly1 h GLU 92 Ca 0.02 -0.13 -0.07 0.00 -0.50 0.00 0.00 59.36 58.69 3ly1 h GLU 92 Cb 0.99 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 28.73 3ly1 h GLU 92 CO 0.09 0.66 0.11 0.82 -1.40 0.00 0.00 179.01 179.29 3ly1 h ILE 93 N 0.78 1.26 0.00 3.13 2.04 -1.15 -0.75 117.51 122.82 3ly1 h ILE 93 Ca 0.18 -0.96 0.00 0.00 1.00 0.00 0.00 64.86 65.08 3ly1 h ILE 93 Cb 0.18 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 3ly1 h ILE 93 CO -0.01 0.35 0.00 0.18 0.00 0.00 0.00 178.15 178.67 3ly1 n LEU 94 N -4.33 0.00 0.00 1.44 4.77 -0.95 -1.67 117.00 116.27 3ly1 n LEU 94 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 3ly1 n LEU 94 Cb 0.26 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 3ly1 n LEU 94 CO 0.42 0.00 0.00 -0.11 -1.33 0.00 0.00 177.39 176.37 3ly1 n LEU 96 N 0.84 0.00 -0.17 2.23 7.94 -0.29 -1.67 117.00 125.88 3ly1 n LEU 96 Ca 0.00 0.00 -0.08 0.00 -1.11 0.00 0.00 56.01 54.82 3ly1 n LEU 96 Cb 0.00 0.00 0.01 0.00 0.53 0.00 0.00 43.42 43.96 3ly1 n LEU 96 CO 0.00 0.00 0.96 1.23 -1.11 0.00 0.00 177.39 178.47 3ly1 h GLY 97 N 0.00 0.79 0.98 -3.96 0.00 -1.59 -0.97 103.07 98.32 3ly1 h GLY 97 Ca 0.00 -0.43 0.01 0.00 0.00 0.00 0.00 47.33 46.91 3ly1 h GLY 97 CO 0.00 0.40 0.46 3.43 0.00 0.00 0.00 176.54 180.83 3ly1 h ASN 98 N 0.66 0.79 -0.25 0.19 2.35 -1.58 -0.47 115.58 117.28 3ly1 h ASN 98 Ca 0.17 -0.02 -0.09 0.00 -0.55 0.00 0.00 56.30 55.81 3ly1 h ASN 98 Cb 0.19 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 3ly1 h ASN 98 CO -0.01 0.57 -0.13 0.50 -1.65 0.00 0.00 177.43 176.70 3ly1 h LYS 99 N 0.93 0.66 -0.08 0.81 3.64 -1.70 -2.07 116.57 118.77 3ly1 h LYS 99 Ca 0.26 -0.21 -0.20 0.00 -1.27 0.00 0.00 60.65 59.23 3ly1 h LYS 99 Cb -0.08 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.68 3ly1 h LYS 99 CO -0.07 0.77 -0.80 -0.07 -2.27 0.00 0.00 179.45 177.01 3ly1 h LEU 100 N 0.60 0.61 0.00 5.20 3.38 -0.93 -2.35 115.31 121.84 3ly1 h LEU 100 Ca 0.10 -0.42 -0.00 0.00 0.09 0.00 0.00 57.88 57.65 3ly1 h LEU 100 Cb 0.57 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3ly1 h LEU 100 CO 0.04 1.19 -0.00 0.00 0.09 0.00 0.00 178.44 179.76 3ly1 h ALA 101 N 0.79 -0.00 -0.75 1.53 0.00 -0.91 -1.48 119.26 118.44 3ly1 h ALA 101 Ca -0.05 -0.00 0.12 0.00 0.00 0.00 0.00 54.91 54.97 3ly1 h ALA 101 Cb 1.40 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 19.11 3ly1 h ALA 101 CO 0.14 -0.50 0.35 0.00 0.00 0.00 0.00 179.25 179.24 3ly1 h ALA 102 N 0.99 1.05 -0.64 0.00 0.00 -1.35 0.21 119.26 119.51 3ly1 h ALA 102 Ca -0.00 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 3ly1 h ALA 102 Cb 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3ly1 h ALA 102 CO 0.00 -0.11 0.08 1.25 0.00 0.00 0.00 179.25 180.47 3ly1 h HIS 103 N 0.55 1.14 -0.16 0.00 6.17 -1.10 -2.47 115.15 119.28 3ly1 h HIS 103 Ca 0.39 -0.16 0.00 0.00 0.71 0.00 0.00 60.37 61.31 3ly1 h HIS 103 Cb 0.50 -0.31 0.00 0.00 2.52 0.00 0.00 27.41 30.12 3ly1 h HIS 103 CO -0.13 0.96 0.00 0.72 0.71 0.00 0.00 177.93 180.20 3ly1 n HIS 104 N -4.21 0.20 -3.74 5.26 8.25 -0.59 -4.95 115.22 115.46 3ly1 n HIS 104 Ca 0.04 -0.10 -0.23 0.00 -0.26 0.00 0.00 57.72 57.17 3ly1 n HIS 104 Cb 0.30 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.44 3ly1 n HIS 104 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 3ly1 n GLN 105 N 0.36 -4.93 -4.35 -0.41 6.02 -0.03 -4.67 117.38 109.37 3ly1 n GLN 105 Ca 0.16 0.61 -0.19 0.00 -0.01 0.00 0.00 57.00 57.58 3ly1 n GLN 105 Cb 0.34 -5.19 -0.09 0.00 1.02 0.00 0.00 30.24 26.32 3ly1 n GLN 105 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3ly1 s VAL 106 N -3.64 0.44 0.55 5.09 -7.23 -0.66 -4.68 120.40 110.27 3ly1 s VAL 106 Ca 0.08 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.20 3ly1 s VAL 106 Cb -0.04 -2.55 -0.01 0.00 0.56 0.00 0.00 36.38 34.35 3ly1 s VAL 106 CO 0.82 0.00 0.85 -1.61 -0.31 0.00 0.00 175.10 174.85 3ly1 s GLU 107 N -3.87 3.12 0.37 4.82 0.41 -1.26 -4.10 118.70 118.19 3ly1 s GLU 107 Ca 0.35 0.03 0.10 0.00 -0.41 0.00 0.00 54.97 55.05 3ly1 s GLU 107 Cb 0.06 -2.32 0.87 0.00 -1.78 0.00 0.00 34.13 30.96 3ly1 s GLU 107 CO 0.16 -0.52 1.87 0.00 -0.49 0.00 0.00 175.26 176.28 3ly1 h ALA 108 N -0.02 1.90 0.00 5.21 0.00 -1.93 -0.87 119.26 123.55 3ly1 h ALA 108 Ca -0.46 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3ly1 h ALA 108 Cb 1.24 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3ly1 h ALA 108 CO 0.61 -0.14 0.00 -2.30 0.00 0.00 0.00 179.25 177.42 3ly1 n PRO 109 N -4.55 0.04 -0.13 0.00 -0.02 -1.26 -2.04 135.00 127.04 3ly1 n PRO 109 Ca 0.17 0.32 0.11 0.00 -2.02 0.00 0.00 63.50 62.08 3ly1 n PRO 109 Cb 0.50 -1.50 0.30 0.00 -0.02 0.00 0.00 33.50 32.77 3ly1 n PRO 109 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3ly1 n SER 110 N -1.39 2.44 -4.31 2.55 7.64 -0.33 -4.26 113.62 115.97 3ly1 n SER 110 Ca 0.02 -1.84 -0.32 0.00 1.01 0.00 0.00 58.87 57.73 3ly1 n SER 110 Cb 0.05 -0.17 -0.16 0.00 -1.01 0.00 0.00 64.21 62.93 3ly1 n SER 110 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3ly1 s ILE 111 N -1.67 2.47 -0.21 0.44 -1.09 -0.87 -1.53 121.20 118.74 3ly1 s ILE 111 Ca 0.35 -0.89 0.02 0.00 -2.23 0.00 0.00 60.65 57.89 3ly1 s ILE 111 Cb 0.20 -1.96 0.04 0.00 -1.58 0.00 0.00 42.46 39.15 3ly1 s ILE 111 CO 0.28 0.56 -0.15 -0.22 -1.23 0.00 0.00 174.94 174.17 3ly1 s LEU 112 N 0.07 2.57 0.27 2.97 2.96 -0.68 -4.98 118.68 121.87 3ly1 s LEU 112 Ca -0.09 -0.93 -0.28 0.00 -0.22 0.00 0.00 54.13 52.62 3ly1 s LEU 112 Cb -0.15 -1.46 -0.09 0.00 0.50 0.00 0.00 46.19 44.98 3ly1 s LEU 112 CO 0.05 -0.08 0.94 -0.76 -1.32 0.00 0.00 176.35 175.18 3ly1 s LEU 113 N 1.25 4.52 0.05 -0.68 1.43 -1.26 -0.78 118.68 123.21 3ly1 s LEU 113 Ca -0.01 1.90 -0.04 0.00 -1.03 0.00 0.00 54.13 54.96 3ly1 s LEU 113 Cb -0.16 -3.78 -0.02 0.00 0.03 0.00 0.00 46.19 42.26 3ly1 s LEU 113 CO -0.10 0.07 0.04 0.42 0.23 0.00 0.00 176.35 177.01 3ly1 s THR 114 N -1.36 0.17 -1.20 5.49 -4.23 0.10 -4.70 115.64 109.91 3ly1 s THR 114 Ca 0.45 -1.40 -0.20 0.00 -1.18 0.00 0.00 61.69 59.36 3ly1 s THR 114 Cb -0.23 -1.18 0.05 0.00 1.34 0.00 0.00 72.50 72.48 3ly1 s THR 114 CO 0.28 -0.77 1.68 0.00 -0.54 0.00 0.00 174.62 175.27 3ly1 s ALA 115 N -3.27 2.97 0.04 3.99 0.00 -1.26 -0.98 121.76 123.25 3ly1 s ALA 115 Ca 0.01 -2.63 0.00 0.00 0.00 0.00 0.00 51.96 49.34 3ly1 s ALA 115 Cb 0.03 -4.62 0.00 0.00 0.00 0.00 0.00 23.12 18.53 3ly1 s ALA 115 CO -0.08 -3.60 0.00 0.41 0.00 0.00 0.00 175.76 172.50 3ly1 n GLY 116 N 5.90 -2.24 0.07 0.00 0.00 -1.19 -4.06 105.19 103.66 3ly1 n GLY 116 Ca 0.44 -1.45 0.13 0.00 0.00 0.00 0.00 46.02 45.14 3ly1 n GLY 116 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3ly1 n SER 117 N -2.47 0.48 -0.35 1.61 3.41 -1.26 -3.13 113.62 111.91 3ly1 n SER 117 Ca -0.00 0.56 0.09 0.00 -0.26 0.00 0.00 58.87 59.25 3ly1 n SER 117 Cb 0.05 -0.68 0.27 0.00 -0.26 0.00 0.00 64.21 63.59 3ly1 n SER 117 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3ly1 h SER 118 N 0.00 0.87 0.79 4.04 0.02 -1.95 -1.16 113.55 116.15 3ly1 h SER 118 Ca 0.00 0.05 -0.17 0.00 -0.84 0.00 0.00 61.79 60.83 3ly1 h SER 118 Cb 0.58 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.98 3ly1 h SER 118 CO 0.00 0.44 -0.82 -0.33 -1.14 0.00 0.00 176.83 174.99 3ly1 h GLU 119 N 0.92 0.02 -0.86 3.45 4.39 -1.69 -2.65 114.58 118.17 3ly1 h GLU 119 Ca 0.50 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 60.16 3ly1 h GLU 119 Cb 0.57 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.19 3ly1 h GLU 119 CO -0.27 0.82 0.48 0.78 -1.16 0.00 0.00 179.01 179.66 3ly1 h GLY 120 N 2.37 1.28 0.92 -3.84 0.00 -1.39 -0.40 103.07 102.01 3ly1 h GLY 120 Ca -0.01 -0.58 -0.00 0.00 0.00 0.00 0.00 47.33 46.74 3ly1 h GLY 120 CO 0.11 0.55 0.07 -2.22 0.00 0.00 0.00 176.54 175.05 3ly1 h ILE 121 N 1.20 1.11 -0.20 2.60 2.04 -1.09 0.49 117.51 123.66 3ly1 h ILE 121 Ca 0.30 -0.31 0.02 0.00 1.00 0.00 0.00 64.86 65.87 3ly1 h ILE 121 Cb 0.02 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 3ly1 h ILE 121 CO -0.05 0.10 0.06 -0.09 0.00 0.00 0.00 178.15 178.17 3ly1 h ARG 122 N 0.10 0.14 -0.48 2.37 2.43 -1.38 -1.34 114.38 116.22 3ly1 h ARG 122 Ca 0.05 -0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.09 3ly1 h ARG 122 Cb 0.10 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.60 3ly1 h ARG 122 CO -0.01 0.10 -0.15 0.00 -1.51 0.00 0.00 179.97 178.40 3ly1 h ALA 123 N 1.13 0.82 -0.35 2.80 0.00 -0.89 -0.45 119.26 122.32 3ly1 h ALA 123 Ca 0.09 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 54.65 3ly1 h ALA 123 Cb 0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 3ly1 h ALA 123 CO -0.10 0.65 0.21 0.00 0.00 0.00 0.00 179.25 180.02 3ly1 h ALA 124 N 1.00 0.44 -0.00 0.00 0.00 -0.63 0.74 119.26 120.81 3ly1 h ALA 124 Ca 0.12 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3ly1 h ALA 124 Cb 0.69 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 3ly1 h ALA 124 CO 0.05 -0.13 0.00 0.82 0.00 0.00 0.00 179.25 179.99 3ly1 h ILE 125 N 0.43 1.13 -0.84 0.00 1.08 -0.98 -2.50 117.51 115.83 3ly1 h ILE 125 Ca 0.14 -0.40 0.05 0.00 -0.39 0.00 0.00 64.86 64.26 3ly1 h ILE 125 Cb -0.01 1.40 -0.06 0.00 -3.07 0.00 0.00 36.82 35.09 3ly1 h ILE 125 CO -0.06 0.10 0.53 -0.33 -0.69 0.00 0.00 178.15 177.71 3ly1 h GLU 126 N -0.17 0.97 -0.32 2.37 5.08 -0.93 0.76 114.58 122.35 3ly1 h GLU 126 Ca 0.00 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 3ly1 h GLU 126 Cb 0.17 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 3ly1 h GLU 126 CO -0.00 0.64 0.07 0.00 -1.00 0.00 0.00 179.01 178.72 3ly1 h ALA 127 N 1.37 1.53 -0.20 3.43 0.00 -0.70 -3.21 119.26 121.48 3ly1 h ALA 127 Ca 0.35 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3ly1 h ALA 127 Cb 0.08 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3ly1 h ALA 127 CO -0.14 0.35 0.00 0.66 0.00 0.00 0.00 179.25 180.12 3ly1 n TYR 128 N -4.35 0.26 -2.53 0.00 4.01 -0.81 -5.00 117.16 108.74 3ly1 n TYR 128 Ca 0.01 -0.29 -0.40 0.00 -0.16 0.00 0.00 57.90 57.06 3ly1 n TYR 128 Cb 0.18 -0.02 -0.05 0.00 -0.31 0.00 0.00 39.34 39.15 3ly1 n TYR 128 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3ly1 s ALA 129 N -0.95 3.39 0.27 -0.72 0.00 0.20 -4.94 121.76 119.01 3ly1 s ALA 129 Ca 0.18 0.84 -0.05 0.00 0.00 0.00 0.00 51.96 52.93 3ly1 s ALA 129 Cb 0.10 -3.31 -0.01 0.00 0.00 0.00 0.00 23.12 19.91 3ly1 s ALA 129 CO 0.14 -0.09 0.39 -1.54 0.00 0.00 0.00 175.76 174.66 3ly1 s SER 130 N -0.89 0.41 0.46 0.00 1.04 -1.26 -5.00 113.70 108.45 3ly1 s SER 130 Ca 0.44 -1.27 0.29 0.00 0.48 0.00 0.00 55.95 55.89 3ly1 s SER 130 Cb -0.31 0.57 1.03 0.00 0.10 0.00 0.00 66.02 67.41 3ly1 s SER 130 CO 0.39 -1.13 1.84 -0.07 0.98 0.00 0.00 173.24 175.25 3ly1 h LEU 131 N 2.28 0.00 -1.68 2.42 3.38 -1.91 -2.61 115.31 117.19 3ly1 h LEU 131 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 3ly1 h LEU 131 Cb 1.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.00 3ly1 h LEU 131 CO 0.41 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 178.32 3ly1 n GLU 132 N -2.90 2.14 -2.62 1.13 -0.58 -1.26 -4.81 120.64 111.73 3ly1 n GLU 132 Ca 0.02 -1.68 -0.35 0.00 -0.42 0.00 0.00 57.16 54.73 3ly1 n GLU 132 Cb 0.36 -1.47 -0.05 0.00 -0.57 0.00 0.00 31.44 29.71 3ly1 n GLU 132 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3ly1 s ALA 133 N -1.85 3.05 0.12 0.62 0.00 -0.98 -4.26 121.76 118.45 3ly1 s ALA 133 Ca 0.33 0.61 0.10 0.00 0.00 0.00 0.00 51.96 53.00 3ly1 s ALA 133 Cb 0.21 -3.24 -0.04 0.00 0.00 0.00 0.00 23.12 20.05 3ly1 s ALA 133 CO 0.31 -0.13 -0.21 1.14 0.00 0.00 0.00 175.76 176.86 3ly1 s GLN 134 N -2.72 1.64 -0.21 0.00 -2.07 -0.33 -2.80 119.66 113.17 3ly1 s GLN 134 Ca 0.60 -1.24 -0.11 0.00 -1.82 0.00 0.00 55.36 52.78 3ly1 s GLN 134 Cb -0.18 -2.03 -0.05 0.00 -1.09 0.00 0.00 33.01 29.66 3ly1 s GLN 134 CO 0.23 0.47 0.19 -1.17 -1.32 0.00 0.00 175.29 173.69 3ly1 s LEU 135 N -2.12 4.17 -0.27 2.60 2.96 0.15 -0.70 118.68 125.47 3ly1 s LEU 135 Ca 0.16 0.24 -0.06 0.00 -0.22 0.00 0.00 54.13 54.26 3ly1 s LEU 135 Cb -0.10 -2.17 0.00 0.00 0.50 0.00 0.00 46.19 44.42 3ly1 s LEU 135 CO 0.09 0.09 0.05 -0.69 -1.32 0.00 0.00 176.35 174.56 3ly1 s VAL 136 N 0.78 3.81 0.11 1.68 1.01 0.94 -0.07 120.40 128.66 3ly1 s VAL 136 Ca 0.10 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.48 3ly1 s VAL 136 Cb -0.13 -2.91 -0.04 0.00 0.00 0.00 0.00 36.38 33.31 3ly1 s VAL 136 CO 0.03 0.18 -0.08 0.27 0.00 0.00 0.00 175.10 175.49 3ly1 s ILE 137 N 1.49 0.90 0.64 2.22 -4.36 -0.61 -2.80 121.20 118.69 3ly1 s ILE 137 Ca 0.03 -1.90 -0.18 0.00 -0.26 0.00 0.00 60.65 58.35 3ly1 s ILE 137 Cb -0.16 -1.65 -0.01 0.00 1.25 0.00 0.00 42.46 41.89 3ly1 s ILE 137 CO 0.01 -0.76 1.24 -2.84 0.24 0.00 0.00 174.94 172.84 3ly1 s PRO 138 N -3.54 2.64 0.40 0.37 0.02 -1.26 -0.59 135.00 133.03 3ly1 s PRO 138 Ca 0.12 1.91 0.14 0.00 0.02 0.00 0.00 61.00 63.19 3ly1 s PRO 138 Cb 0.02 -1.88 0.83 0.00 0.02 0.00 0.00 34.50 33.50 3ly1 s PRO 138 CO -0.02 -1.49 1.87 1.49 -0.33 0.00 0.00 177.00 178.52 3ly1 h GLU 139 N 0.51 0.00 -3.61 5.54 4.81 -1.37 -3.37 114.58 117.09 3ly1 h GLU 139 Ca -0.50 0.00 -0.64 0.00 -0.13 0.00 0.00 59.36 58.09 3ly1 h GLU 139 Cb 1.31 0.00 -0.41 0.00 0.63 0.00 0.00 28.75 30.29 3ly1 h GLU 139 CO 0.53 0.32 -0.65 -1.17 -0.73 0.00 0.00 179.01 177.31 3ly1 s LEU 140 N -8.14 4.33 0.00 1.64 2.96 -1.26 -4.77 118.68 113.44 3ly1 s LEU 140 Ca -0.03 -2.84 -0.03 0.00 -0.22 0.00 0.00 54.13 51.01 3ly1 s LEU 140 Cb 0.14 -1.61 0.01 0.00 0.50 0.00 0.00 46.19 45.23 3ly1 s LEU 140 CO 0.71 -0.26 0.34 1.07 -1.32 0.00 0.00 176.35 176.89 3ly1 n THR 141 N 3.34 0.00 -1.87 3.68 5.66 -1.26 -4.64 114.28 119.19 3ly1 n THR 141 Ca 0.05 -0.99 -0.42 0.00 -3.05 0.00 0.00 64.05 59.64 3ly1 n THR 141 Cb 0.34 0.66 -0.03 0.00 -1.55 0.00 0.00 70.33 69.75 3ly1 n THR 141 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 3ly1 s TYR 142 N -3.98 2.66 -0.65 1.09 5.04 -0.68 -4.69 117.35 116.14 3ly1 s TYR 142 Ca 0.16 0.37 0.24 0.00 -2.44 0.00 0.00 57.07 55.41 3ly1 s TYR 142 Cb -0.01 -4.01 0.91 0.00 0.35 0.00 0.00 41.96 39.20 3ly1 s TYR 142 CO 0.12 -3.93 1.73 0.41 -1.34 0.00 0.00 175.55 172.54 3ly1 n GLY 143 N 3.95 -1.44 0.23 8.97 0.00 -1.26 -3.88 105.19 111.75 3ly1 n GLY 143 Ca 0.15 0.02 0.03 0.00 0.00 0.00 0.00 46.02 46.23 3ly1 n GLY 143 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3ly1 h ASP 144 N 0.00 0.13 0.58 1.61 5.19 -1.99 -1.36 116.42 120.59 3ly1 h ASP 144 Ca 0.00 -0.03 -0.03 0.00 -0.62 0.00 0.00 57.03 56.35 3ly1 h ASP 144 Cb 0.51 -0.04 0.01 0.00 0.18 0.00 0.00 39.33 39.99 3ly1 h ASP 144 CO 0.00 0.32 -0.28 1.23 -3.12 0.00 0.00 179.24 177.39 3ly1 h GLY 145 N 0.72 -0.82 0.55 2.75 0.00 -1.95 -1.92 103.07 102.40 3ly1 h GLY 145 Ca 0.03 0.30 0.08 0.00 0.00 0.00 0.00 47.33 47.74 3ly1 h GLY 145 CO 0.03 -0.30 0.39 -2.09 0.00 0.00 0.00 176.54 174.57 3ly1 h GLU 146 N -0.84 0.65 -0.26 4.80 4.81 -1.78 -0.27 114.58 121.70 3ly1 h GLU 146 Ca -0.08 -0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.17 3ly1 h GLU 146 Cb 0.62 -0.15 -0.07 0.00 0.63 0.00 0.00 28.75 29.79 3ly1 h GLU 146 CO 0.13 0.43 -0.18 1.25 -0.73 0.00 0.00 179.01 179.91 3ly1 h HIS 147 N 0.67 -0.46 0.00 0.92 2.76 -1.06 -0.56 115.15 117.42 3ly1 h HIS 147 Ca 0.35 0.03 -0.17 0.00 -2.20 0.00 0.00 60.37 58.39 3ly1 h HIS 147 Cb 0.31 0.25 -0.02 0.00 1.55 0.00 0.00 27.41 29.49 3ly1 h HIS 147 CO -0.09 -0.26 -0.79 0.74 -1.30 0.00 0.00 177.93 176.24 3ly1 h PHE 148 N -0.17 0.00 -0.73 5.26 0.04 -0.95 -2.75 116.94 117.65 3ly1 h PHE 148 Ca 0.14 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.86 3ly1 h PHE 148 Cb 0.38 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.50 3ly1 h PHE 148 CO -0.36 0.79 0.26 0.00 -0.60 0.00 0.00 178.31 178.40 3ly1 h ALA 149 N 1.21 0.95 -0.41 2.45 0.00 -0.77 -0.84 119.26 121.86 3ly1 h ALA 149 Ca -0.01 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 3ly1 h ALA 149 Cb 1.58 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 3ly1 h ALA 149 CO 0.10 0.60 0.01 0.87 0.00 0.00 0.00 179.25 180.83 3ly1 h LYS 150 N 1.06 0.72 -0.90 0.00 1.57 -0.99 -2.34 116.57 115.67 3ly1 h LYS 150 Ca 0.24 -0.22 0.06 0.00 -1.87 0.00 0.00 60.65 58.86 3ly1 h LYS 150 Cb 0.25 -0.07 -0.06 0.00 0.08 0.00 0.00 32.23 32.44 3ly1 h LYS 150 CO -0.01 0.79 0.59 0.82 -0.57 0.00 0.00 179.45 181.07 3ly1 h ILE 151 N 0.55 1.08 0.00 1.86 2.04 -1.28 0.68 117.51 122.45 3ly1 h ILE 151 Ca 0.12 -0.36 0.00 0.00 1.00 0.00 0.00 64.86 65.62 3ly1 h ILE 151 Cb 0.46 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.48 3ly1 h ILE 151 CO 0.02 0.19 0.00 0.00 0.00 0.00 0.00 178.15 178.36 3ly1 n ALA 152 N -2.40 2.23 -1.97 1.87 0.00 -0.34 -5.12 120.51 114.79 3ly1 n ALA 152 Ca 0.13 -0.12 -0.01 0.00 0.00 0.00 0.00 53.44 53.44 3ly1 n ALA 152 Cb 0.18 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.27 3ly1 n ALA 152 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ly1 n GLY 153 N 0.52 -2.41 3.77 0.00 0.00 0.23 -4.78 105.19 102.51 3ly1 n GLY 153 Ca 0.13 0.17 -0.36 0.00 0.00 0.00 0.00 46.02 45.96 3ly1 n GLY 153 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ly1 s LYS 155 N -1.00 4.01 -0.24 1.61 2.20 -1.12 -4.93 119.74 120.27 3ly1 s LYS 155 Ca 0.04 -0.13 -0.05 0.00 -0.36 0.00 0.00 55.97 55.46 3ly1 s LYS 155 Cb -0.01 -3.36 -0.01 0.00 -1.51 0.00 0.00 37.83 32.94 3ly1 s LYS 155 CO 0.29 0.42 0.01 0.08 -0.36 0.00 0.00 175.35 175.79 3ly1 s VAL 156 N -0.01 3.72 -0.37 4.02 1.01 -1.26 -0.68 120.40 126.83 3ly1 s VAL 156 Ca 0.11 -0.47 -0.05 0.00 0.00 0.00 0.00 61.98 61.57 3ly1 s VAL 156 Cb -0.12 -2.76 0.07 0.00 0.00 0.00 0.00 36.38 33.57 3ly1 s VAL 156 CO 0.01 0.32 0.15 -0.89 0.00 0.00 0.00 175.10 174.68 3ly1 s THR 157 N 1.51 3.58 -0.18 3.92 2.01 0.89 -4.97 115.64 122.41 3ly1 s THR 157 Ca 0.05 -1.50 -0.14 0.00 0.31 0.00 0.00 61.69 60.40 3ly1 s THR 157 Cb -0.15 -3.19 -0.04 0.00 0.01 0.00 0.00 72.50 69.13 3ly1 s THR 157 CO -0.00 -0.38 0.32 -0.54 -0.69 0.00 0.00 174.62 173.32 3ly1 s LYS 158 N 1.30 4.22 -0.24 4.92 1.02 -1.26 -1.57 119.74 128.14 3ly1 s LYS 158 Ca 0.01 0.11 -0.08 0.00 0.02 0.00 0.00 55.97 56.02 3ly1 s LYS 158 Cb -0.21 -3.47 -0.04 0.00 -0.52 0.00 0.00 37.83 33.59 3ly1 s LYS 158 CO -0.00 0.13 0.11 0.08 -0.92 0.00 0.00 175.35 174.75 3ly1 s VAL 159 N 0.78 4.76 0.00 3.17 1.01 0.24 -4.82 120.40 125.54 3ly1 s VAL 159 Ca 0.17 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.12 3ly1 s VAL 159 Cb -0.14 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 33.03 3ly1 s VAL 159 CO 0.05 0.35 0.00 1.17 0.00 0.00 0.00 175.10 176.67 3ly1 n LYS 160 N 4.57 3.08 -3.62 2.72 4.81 -1.26 -0.97 118.16 127.49 3ly1 n LYS 160 Ca -0.16 0.00 -0.20 0.00 -0.87 0.00 0.00 58.31 57.08 3ly1 n LYS 160 Cb 0.52 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.54 3ly1 n LYS 160 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 3ly1 s LEU 162 N 0.00 3.60 0.63 3.14 1.43 0.47 -4.36 118.68 123.60 3ly1 s LEU 162 Ca 0.00 -0.52 0.42 0.00 -1.03 0.00 0.00 54.13 53.00 3ly1 s LEU 162 Cb 0.00 -2.28 2.23 0.00 0.03 0.00 0.00 46.19 46.16 3ly1 s LEU 162 CO 0.00 -0.48 2.28 -2.24 0.23 0.00 0.00 176.35 176.14 3ly1 h ASP 163 N 1.08 0.00 -0.69 2.29 3.04 -1.99 0.31 116.42 120.46 3ly1 h ASP 163 Ca -0.43 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.36 3ly1 h ASP 163 Cb 1.26 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.55 3ly1 h ASP 163 CO 0.56 0.00 0.00 -0.46 -2.04 0.00 0.00 179.24 177.30 3ly1 n ASN 164 N -3.03 4.39 0.00 4.15 6.94 -1.26 -4.95 115.26 121.50 3ly1 n ASN 164 Ca -0.02 -2.23 0.00 0.00 -0.02 0.00 0.00 54.58 52.30 3ly1 n ASN 164 Cb 0.10 -0.54 0.00 0.00 -2.36 0.00 0.00 39.78 36.98 3ly1 n ASN 164 CO 0.00 0.00 0.00 0.79 -1.03 0.00 0.00 177.26 177.02 3ly1 n TRP 165 N 1.37 0.00 -1.46 -2.53 7.02 0.11 -5.05 117.44 116.90 3ly1 n TRP 165 Ca 0.25 0.00 -0.31 0.00 -1.02 0.00 0.00 57.50 56.42 3ly1 n TRP 165 Cb 0.76 -0.06 0.07 0.00 -2.42 0.00 0.00 31.31 29.66 3ly1 n TRP 165 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3ly1 s ALA 166 N -2.57 2.46 0.35 6.99 0.00 -1.26 -4.73 121.76 123.01 3ly1 s ALA 166 Ca 0.00 0.10 -0.28 0.00 0.00 0.00 0.00 51.96 51.78 3ly1 s ALA 166 Cb 0.00 -3.20 -0.10 0.00 0.00 0.00 0.00 23.12 19.82 3ly1 s ALA 166 CO 0.00 -1.48 1.33 -0.06 0.00 0.00 0.00 175.76 175.55 3ly1 s PHE 167 N -3.01 2.93 -0.96 0.00 0.40 -1.26 -0.39 117.98 115.69 3ly1 s PHE 167 Ca 0.59 1.38 -0.17 0.00 -0.60 0.00 0.00 56.93 58.14 3ly1 s PHE 167 Cb -0.15 -3.73 0.16 0.00 0.51 0.00 0.00 43.02 39.81 3ly1 s PHE 167 CO 0.55 -2.07 1.10 0.34 0.70 0.00 0.00 175.22 175.84 3ly1 s ASP 168 N -0.49 6.76 0.33 1.36 2.15 -1.26 -4.66 116.67 120.85 3ly1 s ASP 168 Ca 0.51 -2.39 0.04 0.00 0.43 0.00 0.00 52.55 51.14 3ly1 s ASP 168 Cb -0.40 -2.35 0.58 0.00 -0.30 0.00 0.00 42.92 40.45 3ly1 s ASP 168 CO 0.53 -0.88 1.85 0.40 -0.17 0.00 0.00 175.17 176.91 3ly1 h ILE 169 N 5.34 1.21 -0.63 4.11 1.08 -1.96 0.15 117.51 126.81 3ly1 h ILE 169 Ca 0.17 -0.86 -0.07 0.00 -0.39 0.00 0.00 64.86 63.72 3ly1 h ILE 169 Cb 1.00 1.02 -0.03 0.00 -3.07 0.00 0.00 36.82 35.74 3ly1 h ILE 169 CO 1.05 0.29 0.13 -0.33 -0.69 0.00 0.00 178.15 178.59 3ly1 h GLU 170 N 0.48 1.01 -0.14 2.37 4.39 -1.98 0.15 114.58 120.85 3ly1 h GLU 170 Ca 0.10 -0.24 -0.16 0.00 0.34 0.00 0.00 59.36 59.40 3ly1 h GLU 170 Cb 0.38 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 3ly1 h GLU 170 CO 0.02 0.91 -0.57 0.78 -1.16 0.00 0.00 179.01 178.99 3ly1 h GLY 171 N 1.04 0.49 0.91 -3.84 0.00 -1.74 -1.16 103.07 98.77 3ly1 h GLY 171 Ca 0.20 -0.58 -0.02 0.00 0.00 0.00 0.00 47.33 46.93 3ly1 h GLY 171 CO 0.01 0.52 0.11 1.41 0.00 0.00 0.00 176.54 178.59 3ly1 h LEU 172 N 0.34 0.40 -0.92 3.11 3.38 -0.54 -2.04 115.31 119.04 3ly1 h LEU 172 Ca 0.00 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 3ly1 h LEU 172 Cb 1.09 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.70 3ly1 h LEU 172 CO 0.10 0.46 0.52 0.11 0.09 0.00 0.00 178.44 179.72 3ly1 h LYS 173 N 0.31 1.27 -0.46 1.13 1.57 -0.55 -2.12 116.57 117.72 3ly1 h LYS 173 Ca 0.09 -0.14 -0.14 0.00 -1.87 0.00 0.00 60.65 58.60 3ly1 h LYS 173 Cb 0.19 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 3ly1 h LYS 173 CO -0.01 0.91 -0.27 0.00 -0.57 0.00 0.00 179.45 179.52 3ly1 h ALA 174 N 1.29 0.65 -0.56 3.86 0.00 -1.11 -1.16 119.26 122.24 3ly1 h ALA 174 Ca 0.33 -0.41 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 3ly1 h ALA 174 Cb -0.01 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 3ly1 h ALA 174 CO -0.06 0.68 0.15 0.00 0.00 0.00 0.00 179.25 180.02 3ly1 h ALA 175 N 0.84 1.22 -0.18 0.00 0.00 -1.06 0.56 119.26 120.63 3ly1 h ALA 175 Ca 0.10 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 3ly1 h ALA 175 Cb 0.85 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 3ly1 h ALA 175 CO 0.08 0.54 -0.01 0.28 0.00 0.00 0.00 179.25 180.14 3ly1 h VAL 176 N 0.82 1.26 0.00 0.00 2.07 -1.24 -3.26 116.25 115.90 3ly1 h VAL 176 Ca 0.18 -0.91 -0.06 0.00 0.82 0.00 0.00 66.70 66.73 3ly1 h VAL 176 Cb 0.27 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 3ly1 h VAL 176 CO -0.00 0.27 -0.31 0.00 0.02 0.00 0.00 177.57 177.55 3ly1 h ALA 177 N 0.76 1.47 0.00 1.67 0.00 -0.79 -2.57 119.26 119.80 3ly1 h ALA 177 Ca 0.05 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3ly1 h ALA 177 Cb 0.42 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3ly1 h ALA 177 CO 0.01 0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.65 3ly1 h ALA 178 N 1.69 1.00 -2.87 0.00 0.00 -0.97 -3.44 119.26 114.67 3ly1 h ALA 178 Ca -0.00 0.00 -0.64 0.00 0.00 0.00 0.00 54.91 54.27 3ly1 h ALA 178 Cb 0.55 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.18 3ly1 h ALA 178 CO 0.04 0.00 -0.48 -0.47 0.00 0.00 0.00 179.25 178.34 3ly1 s TYR 179 N -3.14 3.22 -0.01 0.00 5.04 -0.97 -4.98 117.35 116.50 3ly1 s TYR 179 Ca 0.09 0.15 0.29 0.00 -2.44 0.00 0.00 57.07 55.17 3ly1 s TYR 179 Cb 0.11 -2.41 1.05 0.00 0.35 0.00 0.00 41.96 41.06 3ly1 s TYR 179 CO 0.60 -0.18 1.87 0.66 -1.34 0.00 0.00 175.55 177.16 3ly1 h SER 180 N 8.35 0.00 -2.98 4.32 4.64 -1.86 -3.45 113.55 122.56 3ly1 h SER 180 Ca -0.34 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.81 3ly1 h SER 180 Cb 1.19 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 63.33 3ly1 h SER 180 CO 0.56 0.05 0.13 0.61 -0.87 0.00 0.00 176.83 177.31 3ly1 n GLY 181 N 0.31 -0.84 3.78 -0.77 0.00 -1.26 -5.04 105.19 101.37 3ly1 n GLY 181 Ca 0.01 -1.75 -0.35 0.00 0.00 0.00 0.00 46.02 43.94 3ly1 n GLY 181 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3ly1 s PRO 182 N -3.92 3.51 -0.01 1.61 0.04 -1.26 -4.90 135.00 130.06 3ly1 s PRO 182 Ca 0.27 1.53 0.03 0.00 0.04 0.00 0.00 61.00 62.87 3ly1 s PRO 182 Cb -0.01 -2.04 -0.01 0.00 0.04 0.00 0.00 34.50 32.49 3ly1 s PRO 182 CO 0.19 -0.71 -0.10 -1.12 0.04 0.00 0.00 177.00 175.30 3ly1 s SER 183 N -1.84 1.17 -0.15 6.66 0.01 -0.30 -1.18 113.70 118.08 3ly1 s SER 183 Ca 0.71 -0.18 -0.03 0.00 1.31 0.00 0.00 55.95 57.76 3ly1 s SER 183 Cb -0.21 -0.16 -0.02 0.00 0.21 0.00 0.00 66.02 65.83 3ly1 s SER 183 CO 0.25 0.11 -0.06 -0.63 0.41 0.00 0.00 173.24 173.32 3ly1 s ILE 184 N -0.16 3.68 -0.18 1.44 1.01 0.13 -4.13 121.20 122.98 3ly1 s ILE 184 Ca 0.03 -0.44 -0.02 0.00 0.00 0.00 0.00 60.65 60.22 3ly1 s ILE 184 Cb -0.05 -2.59 -0.01 0.00 0.01 0.00 0.00 42.46 39.82 3ly1 s ILE 184 CO -0.00 0.51 -0.09 -0.69 0.00 0.00 0.00 174.94 174.66 3ly1 s VAL 185 N 0.31 3.12 -0.26 2.92 1.01 -1.26 -0.04 120.40 126.19 3ly1 s VAL 185 Ca -0.05 -0.60 -0.03 0.00 0.00 0.00 0.00 61.98 61.30 3ly1 s VAL 185 Cb -0.14 -2.37 0.02 0.00 0.00 0.00 0.00 36.38 33.89 3ly1 s VAL 185 CO 0.04 0.48 -0.03 -0.47 0.00 0.00 0.00 175.10 175.12 3ly1 s TYR 186 N 1.02 3.09 -0.25 5.22 5.04 -1.12 -0.75 117.35 129.60 3ly1 s TYR 186 Ca -0.01 -1.44 0.01 0.00 -2.44 0.00 0.00 57.07 53.19 3ly1 s TYR 186 Cb -0.15 -2.10 0.07 0.00 0.35 0.00 0.00 41.96 40.13 3ly1 s TYR 186 CO -0.01 -0.70 -0.03 -0.51 -1.34 0.00 0.00 175.55 172.96 3ly1 s LEU 187 N 1.36 2.67 -0.19 6.97 1.43 -0.54 -4.59 118.68 125.79 3ly1 s LEU 187 Ca 0.00 -1.28 -0.14 0.00 -1.03 0.00 0.00 54.13 51.69 3ly1 s LEU 187 Cb -0.17 -1.17 -0.05 0.00 0.03 0.00 0.00 46.19 44.83 3ly1 s LEU 187 CO -0.03 -0.26 0.29 -0.69 0.23 0.00 0.00 176.35 175.89 3ly1 s VAL 188 N 1.39 5.29 -0.28 -1.59 1.01 -1.26 -1.01 120.40 123.94 3ly1 s VAL 188 Ca -0.03 0.51 0.01 0.00 0.00 0.00 0.00 61.98 62.47 3ly1 s VAL 188 Cb -0.19 -3.63 0.16 0.00 0.00 0.00 0.00 36.38 32.73 3ly1 s VAL 188 CO -0.08 0.35 0.45 0.21 0.00 0.00 0.00 175.10 176.03 3ly1 s ASN 189 N 0.72 -0.14 0.45 3.32 2.47 -0.26 -2.98 114.94 118.52 3ly1 s ASN 189 Ca 0.15 -0.03 -0.25 0.00 0.42 0.00 0.00 52.86 53.16 3ly1 s ASN 189 Cb -0.13 1.36 -0.08 0.00 -1.45 0.00 0.00 41.25 40.94 3ly1 s ASN 189 CO 0.05 -0.32 1.37 -2.65 -3.72 0.00 0.00 177.10 171.83 3ly1 n PRO 190 N 5.37 2.10 -2.49 0.43 -0.02 -1.26 -4.27 135.00 134.86 3ly1 n PRO 190 Ca 0.00 0.75 -0.35 0.00 -2.02 0.00 0.00 63.50 61.88 3ly1 n PRO 190 Cb 0.50 -2.55 -0.03 0.00 -0.02 0.00 0.00 33.50 31.41 3ly1 n PRO 190 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3ly1 s ASN 191 N -0.53 6.42 -0.18 2.55 2.47 0.12 -4.75 114.94 121.04 3ly1 s ASN 191 Ca 0.62 2.03 0.01 0.00 0.42 0.00 0.00 52.86 55.95 3ly1 s ASN 191 Cb -0.46 -2.58 0.02 0.00 -1.45 0.00 0.00 41.25 36.78 3ly1 s ASN 191 CO 0.57 -0.73 -0.18 0.21 -3.72 0.00 0.00 177.10 173.25 3ly1 s ASN 192 N -1.74 3.17 0.00 -4.21 2.47 -1.26 -0.74 114.94 112.62 3ly1 s ASN 192 Ca 0.64 -0.69 0.20 0.00 0.42 0.00 0.00 52.86 53.43 3ly1 s ASN 192 Cb -0.20 -1.43 0.00 0.00 -1.45 0.00 0.00 41.25 38.17 3ly1 s ASN 192 CO 0.25 -0.03 0.99 -0.81 -3.72 0.00 0.00 177.10 173.78 3ly1 n PRO 193 N 4.63 1.45 0.16 0.43 -0.04 -1.26 -1.69 135.00 138.68 3ly1 n PRO 193 Ca -0.20 -0.96 0.00 0.00 -0.04 0.00 0.00 63.50 62.31 3ly1 n PRO 193 Cb 0.49 -1.39 0.25 0.00 -0.04 0.00 0.00 33.50 32.82 3ly1 n PRO 193 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 3ly1 h THR 194 N 2.26 1.35 0.00 0.52 1.35 -1.88 -3.39 112.91 113.12 3ly1 h THR 194 Ca 0.00 -1.75 0.00 0.00 -0.55 0.00 0.00 66.41 64.11 3ly1 h THR 194 Cb 0.68 1.95 0.00 0.00 -1.73 0.00 0.00 68.15 69.04 3ly1 h THR 194 CO 0.00 0.50 0.00 0.61 -0.25 0.00 0.00 175.52 176.38 3ly1 n GLY 195 N -0.05 1.01 3.94 5.82 0.00 0.08 -4.21 105.19 111.79 3ly1 n GLY 195 Ca -0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.77 3ly1 n GLY 195 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ly1 s THR 196 N -3.32 3.93 0.18 2.61 -4.23 -1.23 -0.23 115.64 113.35 3ly1 s THR 196 Ca 0.00 -0.37 0.08 0.00 -1.18 0.00 0.00 61.69 60.22 3ly1 s THR 196 Cb 0.00 -3.48 -0.04 0.00 1.34 0.00 0.00 72.50 70.32 3ly1 s THR 196 CO 0.00 -0.37 -0.05 0.27 -0.54 0.00 0.00 174.62 173.93 3ly1 s ILE 197 N -2.66 3.45 -0.17 2.99 -5.25 -1.26 -0.70 121.20 117.61 3ly1 s ILE 197 Ca 0.50 -1.57 -0.08 0.00 -0.99 0.00 0.00 60.65 58.50 3ly1 s ILE 197 Cb -0.10 -2.73 -0.04 0.00 2.95 0.00 0.00 42.46 42.53 3ly1 s ILE 197 CO 0.40 -0.13 0.10 -0.89 -1.79 0.00 0.00 174.94 172.63 3ly1 s THR 198 N -1.77 5.18 0.31 8.37 2.01 -1.26 -5.00 115.64 123.48 3ly1 s THR 198 Ca 0.27 0.10 -0.29 0.00 0.31 0.00 0.00 61.69 62.07 3ly1 s THR 198 Cb -0.09 -3.32 -0.11 0.00 0.01 0.00 0.00 72.50 68.99 3ly1 s THR 198 CO 0.17 0.50 1.50 -2.84 -0.69 0.00 0.00 174.62 173.26 3ly1 s PRO 199 N -0.04 4.17 0.43 4.92 0.02 -1.26 -4.74 135.00 138.49 3ly1 s PRO 199 Ca 0.09 2.48 0.16 0.00 0.02 0.00 0.00 61.00 63.74 3ly1 s PRO 199 Cb -0.12 -3.03 1.06 0.00 0.02 0.00 0.00 34.50 32.43 3ly1 s PRO 199 CO 0.00 -0.51 1.92 0.00 -0.33 0.00 0.00 177.00 178.08 3ly1 h ALA 200 N 4.24 2.13 0.00 -1.55 0.00 -1.27 -0.72 119.26 122.09 3ly1 h ALA 200 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3ly1 h ALA 200 Cb 1.23 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3ly1 h ALA 200 CO 0.73 -0.33 0.00 -0.40 0.00 0.00 0.00 179.25 179.25 3ly1 n ASP 201 N -4.48 0.00 -0.06 0.00 5.68 -1.26 -0.89 116.55 115.54 3ly1 n ASP 201 Ca 0.15 0.20 -0.17 0.00 -0.50 0.00 0.00 54.79 54.46 3ly1 n ASP 201 Cb 0.54 -0.37 -0.13 0.00 -1.14 0.00 0.00 41.12 40.02 3ly1 n ASP 201 CO 0.00 0.00 0.00 0.52 -1.33 0.00 0.00 177.20 176.39 3ly1 n VAL 202 N -1.37 1.61 -0.00 2.12 0.31 -0.29 -4.51 118.33 116.21 3ly1 n VAL 202 Ca 0.07 -0.66 -0.20 0.00 -0.01 0.00 0.00 64.34 63.54 3ly1 n VAL 202 Cb 0.18 -1.40 -0.14 0.00 -0.91 0.00 0.00 33.84 31.57 3ly1 n VAL 202 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 3ly1 h ILE 203 N 0.03 1.30 -0.61 2.52 2.04 -1.36 -3.37 117.51 118.05 3ly1 h ILE 203 Ca -0.48 -2.42 0.05 0.00 1.00 0.00 0.00 64.86 63.01 3ly1 h ILE 203 Cb 2.01 2.94 -0.05 0.00 -0.74 0.00 0.00 36.82 40.97 3ly1 h ILE 203 CO 0.01 0.66 0.34 -0.33 0.00 0.00 0.00 178.15 178.83 3ly1 h GLU 204 N -0.50 0.61 0.00 2.37 5.08 -1.27 -2.29 114.58 118.58 3ly1 h GLU 204 Ca -0.21 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.01 3ly1 h GLU 204 Cb 1.56 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.66 3ly1 h GLU 204 CO 0.06 0.41 -0.48 -1.35 -1.00 0.00 0.00 179.01 176.64 3ly1 h PRO 205 N 0.63 0.00 0.40 2.33 0.11 -1.79 0.44 132.00 134.12 3ly1 h PRO 205 Ca 0.27 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.36 3ly1 h PRO 205 Cb 0.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.27 3ly1 h PRO 205 CO -0.17 0.48 -0.19 2.35 -0.21 0.00 0.00 178.00 180.26 3ly1 h TRP 206 N 0.00 -0.50 -0.43 0.65 7.01 -1.59 -1.12 115.95 119.97 3ly1 h TRP 206 Ca -0.00 -0.01 0.04 0.00 2.11 0.00 0.00 58.89 61.03 3ly1 h TRP 206 Cb 0.94 0.16 -0.04 0.00 -2.10 0.00 0.00 29.16 28.12 3ly1 h TRP 206 CO 0.00 -0.31 0.18 0.82 -2.79 0.00 0.00 178.44 176.34 3ly1 h ILE 207 N -0.54 0.92 0.00 2.65 2.04 -1.33 -2.22 117.51 119.03 3ly1 h ILE 207 Ca -0.05 -0.13 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 3ly1 h ILE 207 Cb 0.41 0.51 -0.00 0.00 -0.74 0.00 0.00 36.82 37.00 3ly1 h ILE 207 CO 0.09 0.07 -0.14 0.00 0.00 0.00 0.00 178.15 178.16 3ly1 h ALA 208 N 1.26 1.29 0.00 1.87 0.00 -0.85 -0.92 119.26 121.91 3ly1 h ALA 208 Ca 0.19 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3ly1 h ALA 208 Cb 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3ly1 h ALA 208 CO -0.17 0.18 0.00 -1.13 0.00 0.00 0.00 179.25 178.13 3ly1 n SER 209 N -3.69 0.01 -3.56 0.00 3.41 -0.43 -4.93 113.62 104.42 3ly1 n SER 209 Ca -0.02 0.50 -0.27 0.00 -0.26 0.00 0.00 58.87 58.83 3ly1 n SER 209 Cb 0.26 -0.50 0.05 0.00 -0.26 0.00 0.00 64.21 63.76 3ly1 n SER 209 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3ly1 n LYS 210 N -1.51 -1.60 -1.63 4.33 5.02 -0.35 -4.91 118.16 117.51 3ly1 n LYS 210 Ca 0.05 0.57 -0.42 0.00 -2.02 0.00 0.00 58.31 56.49 3ly1 n LYS 210 Cb 0.23 -4.62 0.00 0.00 -0.02 0.00 0.00 35.03 30.63 3ly1 n LYS 210 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 3ly1 n PRO 211 N -3.93 1.58 -2.10 1.97 -0.04 -1.26 -4.83 135.00 126.40 3ly1 n PRO 211 Ca -0.09 0.56 -0.40 0.00 -0.04 0.00 0.00 63.50 63.53 3ly1 n PRO 211 Cb 0.60 -2.10 -0.01 0.00 -0.04 0.00 0.00 33.50 31.94 3ly1 n PRO 211 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3ly1 s ALA 212 N -1.19 3.40 -1.43 0.55 0.00 -1.26 -3.20 121.76 118.63 3ly1 s ALA 212 Ca 0.60 1.24 -0.08 0.00 0.00 0.00 0.00 51.96 53.72 3ly1 s ALA 212 Cb -0.58 -3.48 0.05 0.00 0.00 0.00 0.00 23.12 19.11 3ly1 s ALA 212 CO 0.59 -0.71 0.90 -1.71 0.00 0.00 0.00 175.76 174.83 3ly1 n ASN 213 N 0.52 -3.57 -3.06 0.00 2.85 -1.26 -4.82 115.26 105.90 3ly1 n ASN 213 Ca 0.02 -0.77 -0.17 0.00 -0.11 0.00 0.00 54.58 53.54 3ly1 n ASN 213 Cb 0.43 -4.05 -0.05 0.00 1.24 0.00 0.00 39.78 37.35 3ly1 n ASN 213 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56 3ly1 n THR 214 N -4.56 0.00 -3.64 -0.44 -1.04 -1.19 -1.15 114.28 102.26 3ly1 n THR 214 Ca -0.09 -1.60 -0.05 0.00 -2.04 0.00 0.00 64.05 60.27 3ly1 n THR 214 Cb 0.59 0.58 -0.07 0.00 -1.82 0.00 0.00 70.33 69.61 3ly1 n THR 214 CO 0.00 0.00 0.00 -0.36 -0.64 0.00 0.00 175.07 174.07 3ly1 s PHE 216 N -2.58 -0.88 -0.22 -1.42 0.40 -0.53 -4.85 117.98 107.90 3ly1 s PHE 216 Ca 0.14 1.75 -0.05 0.00 -0.60 0.00 0.00 56.93 58.17 3ly1 s PHE 216 Cb 0.01 0.52 -0.02 0.00 0.51 0.00 0.00 43.02 44.04 3ly1 s PHE 216 CO 0.10 -0.43 -0.01 0.42 0.70 0.00 0.00 175.22 176.00 3ly1 s ILE 217 N 1.53 3.77 -0.21 0.64 1.01 0.07 0.01 121.20 128.03 3ly1 s ILE 217 Ca -0.10 -0.36 -0.01 0.00 0.00 0.00 0.00 60.65 60.18 3ly1 s ILE 217 Cb -0.04 -2.72 0.02 0.00 0.01 0.00 0.00 42.46 39.72 3ly1 s ILE 217 CO -0.18 0.41 -0.12 -0.69 0.00 0.00 0.00 174.94 174.36 3ly1 s VAL 218 N 1.30 2.59 -0.41 2.92 1.01 0.13 -1.47 120.40 126.47 3ly1 s VAL 218 Ca 0.04 -0.88 -0.10 0.00 0.00 0.00 0.00 61.98 61.04 3ly1 s VAL 218 Cb -0.15 -2.19 0.06 0.00 0.00 0.00 0.00 36.38 34.11 3ly1 s VAL 218 CO 0.00 0.41 0.26 -0.62 0.00 0.00 0.00 175.10 175.15 3ly1 s ASP 219 N 1.34 5.73 -0.48 3.32 -1.08 -0.18 -0.73 116.67 124.59 3ly1 s ASP 219 Ca 0.03 -1.35 0.03 0.00 -0.52 0.00 0.00 52.55 50.74 3ly1 s ASP 219 Cb -0.14 -2.02 0.47 0.00 -1.46 0.00 0.00 42.92 39.77 3ly1 s ASP 219 CO -0.08 -0.51 1.66 -0.62 0.52 0.00 0.00 175.17 176.14 3ly1 n GLU 220 N 4.98 2.90 -0.29 4.34 1.02 -0.68 -1.11 120.64 131.79 3ly1 n GLU 220 Ca -0.11 -3.58 0.12 0.00 -0.02 0.00 0.00 57.16 53.57 3ly1 n GLU 220 Cb 0.44 -2.23 0.27 0.00 -0.02 0.00 0.00 31.44 29.90 3ly1 n GLU 220 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3ly1 h ALA 221 N 1.89 1.20 -0.68 0.62 0.00 -1.83 -2.15 119.26 118.30 3ly1 h ALA 221 Ca 0.48 0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.62 3ly1 h ALA 221 Cb 1.29 0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.41 3ly1 h ALA 221 CO 1.13 -0.46 0.00 0.66 0.00 0.00 0.00 179.25 180.59 3ly1 n TYR 222 N -5.24 1.28 0.00 0.00 4.01 -1.26 -4.68 117.16 111.27 3ly1 n TYR 222 Ca 0.20 -0.57 0.01 0.00 -0.16 0.00 0.00 57.90 57.38 3ly1 n TYR 222 Cb 0.65 -0.15 0.34 0.00 -0.31 0.00 0.00 39.34 39.86 3ly1 n TYR 222 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3ly1 h ALA 223 N 4.13 1.47 0.00 -0.72 0.00 -1.64 -2.53 119.26 119.97 3ly1 h ALA 223 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3ly1 h ALA 223 Cb 1.27 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3ly1 h ALA 223 CO 0.14 0.39 0.00 0.93 0.00 0.00 0.00 179.25 180.71 3ly1 h GLU 224 N 0.51 0.00 0.00 0.00 3.07 -1.85 -2.42 114.58 113.89 3ly1 h GLU 224 Ca 0.12 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.98 3ly1 h GLU 224 Cb 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.13 3ly1 h GLU 224 CO -0.00 0.00 0.00 1.19 -1.40 0.00 0.00 179.01 178.80 3ly1 n PHE 225 N -2.72 0.23 -2.22 4.33 3.72 -0.95 -4.93 117.46 114.91 3ly1 n PHE 225 Ca 0.01 0.07 -0.42 0.00 -0.05 0.00 0.00 57.45 57.06 3ly1 n PHE 225 Cb 0.25 -0.62 -0.03 0.00 -0.94 0.00 0.00 39.48 38.14 3ly1 n PHE 225 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3ly1 s VAL 226 N -3.04 3.41 -0.05 -4.37 1.01 -0.91 -4.69 120.40 111.75 3ly1 s VAL 226 Ca 0.11 1.04 0.22 0.00 0.00 0.00 0.00 61.98 63.34 3ly1 s VAL 226 Cb 0.15 -3.66 -0.32 0.00 0.00 0.00 0.00 36.38 32.54 3ly1 s VAL 226 CO 0.46 0.09 0.48 0.59 0.00 0.00 0.00 175.10 176.73 3ly1 n ASN 227 N 3.71 0.04 -4.67 3.32 3.02 -1.26 -5.01 115.26 114.41 3ly1 n ASN 227 Ca 0.10 0.02 -0.43 0.00 -0.03 0.00 0.00 54.58 54.24 3ly1 n ASN 227 Cb 0.43 1.86 -0.02 0.00 -0.61 0.00 0.00 39.78 41.44 3ly1 n ASN 227 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3ly1 s ASP 228 N -4.62 6.94 0.07 6.41 -1.08 -1.26 -4.90 116.67 118.23 3ly1 s ASP 228 Ca -0.08 1.80 0.17 0.00 -0.52 0.00 0.00 52.55 53.92 3ly1 s ASP 228 Cb 0.13 -2.54 0.71 0.00 -1.46 0.00 0.00 42.92 39.75 3ly1 s ASP 228 CO 0.90 -0.72 1.52 -0.81 0.52 0.00 0.00 175.17 176.58 3ly1 n PRO 229 N 6.16 0.05 0.12 4.34 -0.04 -1.26 -2.02 135.00 142.35 3ly1 n PRO 229 Ca 0.13 0.30 0.13 0.00 -0.04 0.00 0.00 63.50 64.03 3ly1 n PRO 229 Cb 0.45 -1.60 0.42 0.00 -0.04 0.00 0.00 33.50 32.73 3ly1 n PRO 229 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3ly1 n ARG 230 N -1.70 0.26 -2.93 0.54 1.74 -1.26 -4.78 116.66 108.53 3ly1 n ARG 230 Ca 0.03 0.27 -0.38 0.00 -0.77 0.00 0.00 57.85 57.00 3ly1 n ARG 230 Cb 0.18 -1.84 -0.06 0.00 -1.02 0.00 0.00 32.46 29.72 3ly1 n ARG 230 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 3ly1 s PHE 231 N -3.16 3.83 -0.06 -1.55 5.36 -0.86 -0.76 117.98 120.79 3ly1 s PHE 231 Ca 0.09 1.66 -0.03 0.00 -0.96 0.00 0.00 56.93 57.69 3ly1 s PHE 231 Cb 0.11 -2.80 0.03 0.00 -0.34 0.00 0.00 43.02 40.02 3ly1 s PHE 231 CO 0.55 0.41 0.14 0.50 -1.46 0.00 0.00 175.22 175.36 3ly1 s ARG 232 N -1.50 0.11 0.50 10.12 3.52 -1.26 -4.89 118.95 125.55 3ly1 s ARG 232 Ca 0.41 0.29 -0.23 0.00 -0.13 0.00 0.00 55.73 56.07 3ly1 s ARG 232 Cb -0.21 -0.08 -0.07 0.00 -1.56 0.00 0.00 34.95 33.03 3ly1 s ARG 232 CO 0.26 -0.11 1.32 0.45 -0.81 0.00 0.00 175.30 176.42 3ly1 n SER 233 N 3.73 2.65 0.00 -2.12 2.88 -1.26 -4.83 113.62 114.67 3ly1 n SER 233 Ca -0.21 1.03 0.14 0.00 -1.33 0.00 0.00 58.87 58.50 3ly1 n SER 233 Cb 0.55 -1.55 0.65 0.00 -0.75 0.00 0.00 64.21 63.10 3ly1 n SER 233 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3ly1 n ILE 234 N -0.71 0.10 -0.26 2.46 0.13 -1.26 -4.37 119.36 115.46 3ly1 n ILE 234 Ca 0.09 0.02 0.07 0.00 -1.10 0.00 0.00 62.75 61.83 3ly1 n ILE 234 Cb 0.43 -0.56 0.20 0.00 -0.84 0.00 0.00 39.64 38.87 3ly1 n ILE 234 CO 0.00 0.00 0.00 -1.28 2.80 0.00 0.00 176.55 178.07 3ly1 h SER 235 N 0.00 0.02 0.00 9.51 0.87 -1.98 -3.27 113.55 118.70 3ly1 h SER 235 Ca 0.00 0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 3ly1 h SER 235 Cb 0.37 0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.53 3ly1 h SER 235 CO 0.00 -0.05 0.14 -2.65 -0.53 0.00 0.00 176.83 173.75 3ly1 n PRO 236 N -5.16 0.00 0.00 2.24 -0.02 -1.26 -1.68 135.00 129.12 3ly1 n PRO 236 Ca 0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 3ly1 n PRO 236 Cb 0.49 -1.46 0.00 0.00 -0.02 0.00 0.00 33.50 32.51 3ly1 n PRO 236 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3ly1 n ILE 238 N 2.25 0.00 -0.35 4.25 5.41 -1.24 -1.34 119.36 128.35 3ly1 n ILE 238 Ca 0.00 0.00 0.14 0.00 1.00 0.00 0.00 62.75 63.89 3ly1 n ILE 238 Cb 0.00 0.00 0.35 0.00 -0.71 0.00 0.00 39.64 39.28 3ly1 n ILE 238 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 3ly1 h THR 239 N 0.00 0.67 -0.21 1.39 2.02 -1.59 -1.51 112.91 113.67 3ly1 h THR 239 Ca 0.00 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 66.94 3ly1 h THR 239 Cb 0.00 -0.10 0.00 0.00 -1.74 0.00 0.00 68.15 66.31 3ly1 h THR 239 CO 0.00 0.13 0.00 0.00 0.37 0.00 0.00 175.52 176.02 3ly1 n GLN 240 N -4.77 1.67 0.00 6.66 6.02 -0.45 -4.89 117.38 121.62 3ly1 n GLN 240 Ca 0.24 -1.02 0.00 0.00 -0.01 0.00 0.00 57.00 56.21 3ly1 n GLN 240 Cb 0.62 -1.33 0.00 0.00 1.02 0.00 0.00 30.24 30.55 3ly1 n GLN 240 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ly1 n GLY 241 N 1.05 1.28 3.76 1.08 0.00 -0.57 -5.08 105.19 106.72 3ly1 n GLY 241 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 3ly1 n GLY 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ly1 n ALA 242 N -1.15 2.40 0.21 4.61 0.00 -1.25 -4.91 120.51 120.41 3ly1 n ALA 242 Ca 0.00 0.35 0.03 0.00 0.00 0.00 0.00 53.44 53.83 3ly1 n ALA 242 Cb 0.00 -2.43 0.04 0.00 0.00 0.00 0.00 19.45 17.06 3ly1 n ALA 242 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3ly1 n GLU 243 N 0.95 0.58 -0.41 0.00 1.02 -1.26 -4.14 120.64 117.39 3ly1 n GLU 243 Ca 0.03 -1.11 0.07 0.00 -0.02 0.00 0.00 57.16 56.14 3ly1 n GLU 243 Cb 0.38 -1.14 0.18 0.00 -0.02 0.00 0.00 31.44 30.84 3ly1 n GLU 243 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 3ly1 n ASN 244 N 0.34 2.01 -3.92 1.62 6.94 -1.26 -4.91 115.26 116.07 3ly1 n ASN 244 Ca 0.05 -3.59 -0.20 0.00 -0.02 0.00 0.00 54.58 50.82 3ly1 n ASN 244 Cb 0.21 -0.50 -0.16 0.00 -2.36 0.00 0.00 39.78 36.97 3ly1 n ASN 244 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3ly1 s ILE 245 N -3.10 0.62 -0.20 1.53 1.01 -1.26 -1.45 121.20 118.35 3ly1 s ILE 245 Ca 0.36 -0.19 -0.01 0.00 0.00 0.00 0.00 60.65 60.81 3ly1 s ILE 245 Cb 0.34 -0.62 0.01 0.00 0.01 0.00 0.00 42.46 42.20 3ly1 s ILE 245 CO -0.03 0.24 -0.14 -0.63 0.00 0.00 0.00 174.94 174.38 3ly1 s ILE 246 N 0.76 2.54 -0.26 2.92 1.01 0.10 -4.43 121.20 123.83 3ly1 s ILE 246 Ca -0.11 -0.78 -0.10 0.00 0.00 0.00 0.00 60.65 59.65 3ly1 s ILE 246 Cb -0.14 -2.11 -0.05 0.00 0.01 0.00 0.00 42.46 40.18 3ly1 s ILE 246 CO 0.01 0.49 0.17 -0.22 0.00 0.00 0.00 174.94 175.39 3ly1 s LEU 247 N 1.36 3.98 -0.13 2.97 2.96 -0.49 0.20 118.68 129.53 3ly1 s LEU 247 Ca 0.05 0.01 -0.05 0.00 -0.22 0.00 0.00 54.13 53.92 3ly1 s LEU 247 Cb -0.13 -2.09 -0.04 0.00 0.50 0.00 0.00 46.19 44.43 3ly1 s LEU 247 CO -0.09 -0.01 0.03 -0.76 -1.32 0.00 0.00 176.35 174.20 3ly1 s LEU 248 N 1.51 3.71 0.08 -0.68 1.43 0.10 -0.78 118.68 124.05 3ly1 s LEU 248 Ca 0.07 0.12 -0.01 0.00 -1.03 0.00 0.00 54.13 53.27 3ly1 s LEU 248 Cb -0.15 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 3ly1 s LEU 248 CO 0.08 0.28 0.02 -0.54 0.23 0.00 0.00 176.35 176.42 3ly1 s LYS 249 N -0.29 0.74 0.07 1.70 1.02 -0.61 -1.69 119.74 120.69 3ly1 s LYS 249 Ca 0.07 -1.29 -0.11 0.00 0.02 0.00 0.00 55.97 54.66 3ly1 s LYS 249 Cb -0.12 0.23 0.01 0.00 -0.52 0.00 0.00 37.83 37.43 3ly1 s LYS 249 CO 0.02 -0.18 0.25 -0.08 -0.92 0.00 0.00 175.35 174.45 3ly1 s THR 250 N -3.96 0.11 -2.49 2.17 -1.32 -1.26 -1.57 115.64 107.31 3ly1 s THR 250 Ca 0.13 -0.88 0.23 0.00 -1.21 0.00 0.00 61.69 59.96 3ly1 s THR 250 Cb 0.08 -1.09 0.42 0.00 -1.51 0.00 0.00 72.50 70.39 3ly1 s THR 250 CO -0.06 -0.49 1.50 0.49 -2.21 0.00 0.00 174.62 173.86 3ly1 n PHE 251 N 0.29 0.22 0.43 9.09 3.01 -0.16 -4.53 117.46 125.81 3ly1 n PHE 251 Ca -0.17 -0.11 0.13 0.00 1.01 0.00 0.00 57.45 58.31 3ly1 n PHE 251 Cb 0.61 0.00 0.39 0.00 -0.01 0.00 0.00 39.48 40.47 3ly1 n PHE 251 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 3ly1 h SER 252 N 3.25 0.00 0.00 4.37 0.02 -1.92 -3.18 113.55 116.08 3ly1 h SER 252 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3ly1 h SER 252 Cb 0.70 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.24 3ly1 h SER 252 CO 0.00 0.00 0.00 0.29 -1.14 0.00 0.00 176.83 175.98 3ly1 n LYS 253 N -2.59 0.00 0.01 3.45 4.76 -1.26 -3.25 118.16 119.27 3ly1 n LYS 253 Ca 0.04 0.00 0.03 0.00 -2.87 0.00 0.00 58.31 55.50 3ly1 n LYS 253 Cb 0.41 0.00 0.38 0.00 -1.84 0.00 0.00 35.03 33.98 3ly1 n LYS 253 CO 0.00 0.00 0.00 0.97 -1.37 0.00 0.00 177.40 177.00 3ly1 h ILE 254 N 0.00 1.14 0.00 -0.18 2.10 -1.83 -0.15 117.51 118.59 3ly1 h ILE 254 Ca 0.00 -0.42 0.00 0.00 1.08 0.00 0.00 64.86 65.52 3ly1 h ILE 254 Cb 0.00 0.70 0.00 0.00 -1.09 0.00 0.00 36.82 36.43 3ly1 h ILE 254 CO 0.00 0.17 0.00 1.41 -1.08 0.00 0.00 178.15 178.65 3ly1 n HIS 255 N -4.40 0.00 -2.71 2.19 8.25 -1.25 -4.88 115.22 112.42 3ly1 n HIS 255 Ca 0.02 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.43 3ly1 n HIS 255 Cb 0.13 -0.18 0.01 0.00 1.12 0.00 0.00 29.99 31.07 3ly1 n HIS 255 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3ly1 n ALA 256 N -1.18 -3.12 0.00 -1.41 0.00 -0.07 -4.55 120.51 110.18 3ly1 n ALA 256 Ca 0.17 0.95 0.00 0.00 0.00 0.00 0.00 53.44 54.57 3ly1 n ALA 256 Cb 0.19 -2.93 0.00 0.00 0.00 0.00 0.00 19.45 16.71 3ly1 n ALA 256 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3ly1 n ALA 258 N -0.10 0.00 -0.89 0.00 0.00 -1.20 -4.86 120.51 113.46 3ly1 n ALA 258 Ca 0.09 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.38 3ly1 n ALA 258 Cb 0.33 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.66 3ly1 n ALA 258 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ly1 n GLY 259 N 0.00 2.91 0.00 0.00 0.00 -1.26 -4.81 105.19 102.02 3ly1 n GLY 259 Ca 0.00 -1.06 0.00 0.00 0.00 0.00 0.00 46.02 44.96 3ly1 n GLY 259 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ly1 n ARG 261 N 2.84 0.00 -4.13 1.61 5.12 -1.26 -5.09 116.66 115.76 3ly1 n ARG 261 Ca 0.42 0.00 -0.31 0.00 -1.93 0.00 0.00 57.85 56.03 3ly1 n ARG 261 Cb 0.65 0.00 -0.16 0.00 -1.16 0.00 0.00 32.46 31.78 3ly1 n ARG 261 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 3ly1 s VAL 262 N 0.00 1.73 0.24 1.55 1.01 -1.26 -3.18 120.40 120.49 3ly1 s VAL 262 Ca 0.00 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.24 3ly1 s VAL 262 Cb 0.00 -1.60 -0.00 0.00 0.00 0.00 0.00 36.38 34.78 3ly1 s VAL 262 CO 0.00 0.49 0.29 0.61 0.00 0.00 0.00 175.10 176.49 3ly1 n GLY 263 N 4.64 2.67 3.55 4.51 0.00 -0.15 -0.99 105.19 119.42 3ly1 n GLY 263 Ca -0.18 -1.62 -0.09 0.00 0.00 0.00 0.00 46.02 44.12 3ly1 n GLY 263 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3ly1 s TYR 264 N -3.39 -0.39 0.09 1.61 1.13 -0.61 -0.72 117.35 115.06 3ly1 s TYR 264 Ca 0.22 0.15 0.07 0.00 -1.41 0.00 0.00 57.07 56.10 3ly1 s TYR 264 Cb -0.00 0.59 -0.04 0.00 -1.10 0.00 0.00 41.96 41.41 3ly1 s TYR 264 CO 0.16 -0.84 -0.12 0.00 -2.51 0.00 0.00 175.55 172.23 3ly1 s ALA 265 N -3.59 2.87 -0.09 9.51 0.00 0.04 -1.57 121.76 128.93 3ly1 s ALA 265 Ca 0.05 -1.24 0.03 0.00 0.00 0.00 0.00 51.96 50.80 3ly1 s ALA 265 Cb -0.02 -0.85 0.01 0.00 0.00 0.00 0.00 23.12 22.26 3ly1 s ALA 265 CO -0.07 0.62 -0.19 0.08 0.00 0.00 0.00 175.76 176.20 3ly1 s VAL 266 N -1.15 1.68 0.29 0.00 1.01 0.04 -1.68 120.40 120.60 3ly1 s VAL 266 Ca 0.20 -0.79 -0.19 0.00 0.00 0.00 0.00 61.98 61.19 3ly1 s VAL 266 Cb -0.11 -1.49 0.07 0.00 0.00 0.00 0.00 36.38 34.85 3ly1 s VAL 266 CO 0.11 0.48 0.91 0.00 0.00 0.00 0.00 175.10 176.60 3ly1 s ALA 267 N 0.57 -1.17 0.53 5.51 0.00 -0.58 -1.39 121.76 125.23 3ly1 s ALA 267 Ca -0.15 -0.54 -0.22 0.00 0.00 0.00 0.00 51.96 51.05 3ly1 s ALA 267 Cb -0.17 0.72 -0.06 0.00 0.00 0.00 0.00 23.12 23.61 3ly1 s ALA 267 CO 0.05 -1.03 1.30 1.58 0.00 0.00 0.00 175.76 177.66 3ly1 n HIS 268 N -0.61 2.11 -0.21 0.00 -0.00 -1.26 -4.38 115.22 110.87 3ly1 n HIS 268 Ca -0.06 0.44 0.18 0.00 0.46 0.00 0.00 57.72 58.74 3ly1 n HIS 268 Cb 0.60 -2.34 0.51 0.00 -0.12 0.00 0.00 29.99 28.63 3ly1 n HIS 268 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 3ly1 h PRO 269 N 1.46 0.41 -0.37 1.57 0.11 -1.92 -0.47 132.00 132.79 3ly1 h PRO 269 Ca -0.50 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.54 3ly1 h PRO 269 Cb 1.31 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 3ly1 h PRO 269 CO 0.57 0.27 0.03 1.79 -0.21 0.00 0.00 178.00 180.45 3ly1 h THR 270 N 0.42 1.19 -0.00 -1.15 1.35 -1.90 -1.36 112.91 111.46 3ly1 h THR 270 Ca 0.43 -0.75 -0.17 0.00 -0.55 0.00 0.00 66.41 65.37 3ly1 h THR 270 Cb 1.04 0.88 0.01 0.00 -1.73 0.00 0.00 68.15 68.35 3ly1 h THR 270 CO -0.15 0.26 -0.66 0.58 -0.25 0.00 0.00 175.52 175.30 3ly1 h VAL 271 N 0.54 1.40 -0.93 6.82 2.07 -1.48 -2.91 116.25 121.78 3ly1 h VAL 271 Ca 0.12 -2.10 0.02 0.00 0.82 0.00 0.00 66.70 65.56 3ly1 h VAL 271 Cb 0.30 2.56 -0.05 0.00 -1.52 0.00 0.00 31.29 32.58 3ly1 h VAL 271 CO 0.01 0.62 0.61 0.40 0.02 0.00 0.00 177.57 179.22 3ly1 h ILE 272 N -0.03 1.22 -0.66 4.57 1.08 -1.11 -2.53 117.51 120.05 3ly1 h ILE 272 Ca -0.08 -0.42 0.00 0.00 -0.39 0.00 0.00 64.86 63.97 3ly1 h ILE 272 Cb 1.36 -0.12 -0.03 0.00 -3.07 0.00 0.00 36.82 34.96 3ly1 h ILE 272 CO 0.13 0.22 0.42 0.00 -0.69 0.00 0.00 178.15 178.23 3ly1 h ALA 273 N 1.35 1.50 0.00 1.87 0.00 -1.23 -0.47 119.26 122.28 3ly1 h ALA 273 Ca 0.35 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.20 3ly1 h ALA 273 Cb -0.10 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.42 3ly1 h ALA 273 CO -0.09 0.45 0.00 1.28 0.00 0.00 0.00 179.25 180.89 3ly1 n LEU 274 N -4.42 1.28 0.00 0.00 4.77 -0.95 -3.49 117.00 114.19 3ly1 n LEU 274 Ca 0.07 -0.64 0.00 0.00 -0.03 0.00 0.00 56.01 55.41 3ly1 n LEU 274 Cb 0.05 -0.27 0.00 0.00 -2.33 0.00 0.00 43.42 40.87 3ly1 n LEU 274 CO 0.36 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 3ly1 n GLY 276 N 0.56 0.00 0.02 -0.72 0.00 -0.19 -4.21 105.19 100.65 3ly1 n GLY 276 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 3ly1 n GLY 276 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ly1 n ARG 277 N 0.00 0.04 -0.23 1.61 1.74 -1.23 -3.18 116.66 115.41 3ly1 n ARG 277 Ca 0.00 0.22 0.07 0.00 -0.77 0.00 0.00 57.85 57.37 3ly1 n ARG 277 Cb 0.00 -1.57 0.17 0.00 -1.02 0.00 0.00 32.46 30.04 3ly1 n ARG 277 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3ly1 n TYR 278 N -1.65 0.49 -4.32 -1.55 4.01 -1.26 -4.94 117.16 107.95 3ly1 n TYR 278 Ca 0.04 -0.74 -0.18 0.00 -0.16 0.00 0.00 57.90 56.86 3ly1 n TYR 278 Cb 0.23 -0.17 -0.10 0.00 -0.31 0.00 0.00 39.34 38.99 3ly1 n TYR 278 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 3ly1 s VAL 279 N -2.07 1.59 -1.22 -0.72 -7.23 -1.19 -4.76 120.40 104.80 3ly1 s VAL 279 Ca 0.29 -2.13 -0.10 0.00 -1.81 0.00 0.00 61.98 58.22 3ly1 s VAL 279 Cb 0.22 -1.96 0.20 0.00 0.56 0.00 0.00 36.38 35.40 3ly1 s VAL 279 CO 0.08 -0.61 1.60 0.00 -0.31 0.00 0.00 175.10 175.87 3ly1 n ALA 280 N -0.25 4.71 -0.83 1.32 0.00 -1.26 -4.94 120.51 119.26 3ly1 n ALA 280 Ca -0.09 -4.39 0.00 0.00 0.00 0.00 0.00 53.44 48.96 3ly1 n ALA 280 Cb 0.60 -2.88 0.00 0.00 0.00 0.00 0.00 19.45 17.18 3ly1 n ALA 280 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ly1 n GLY 281 N 3.05 -0.73 3.11 0.00 0.00 -1.26 -4.49 105.19 104.87 3ly1 n GLY 281 Ca 0.35 -1.03 -0.36 0.00 0.00 0.00 0.00 46.02 44.99 3ly1 n GLY 281 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ly1 s GLU 282 N 0.00 2.04 -0.42 1.61 2.02 -1.26 -4.95 118.70 117.73 3ly1 s GLU 282 Ca 0.00 -1.92 0.10 0.00 0.02 0.00 0.00 54.97 53.17 3ly1 s GLU 282 Cb 0.00 -3.58 0.37 0.00 0.10 0.00 0.00 34.13 31.02 3ly1 s GLU 282 CO 0.00 -1.08 0.84 1.63 0.02 0.00 0.00 175.26 176.67 3ly1 n LYS 283 N 4.42 1.75 -2.41 1.61 5.02 -1.26 -5.02 118.16 122.26 3ly1 n LYS 283 Ca -0.01 -3.83 -0.34 0.00 -2.02 0.00 0.00 58.31 52.12 3ly1 n LYS 283 Cb 0.41 -1.83 -0.02 0.00 -0.02 0.00 0.00 35.03 33.57 3ly1 n LYS 283 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3ly1 s ILE 284 N -3.26 3.75 0.49 -0.18 -1.09 -1.26 -4.99 121.20 114.66 3ly1 s ILE 284 Ca 0.41 1.03 -0.21 0.00 -2.23 0.00 0.00 60.65 59.65 3ly1 s ILE 284 Cb 0.35 -3.42 -0.07 0.00 -1.58 0.00 0.00 42.46 37.73 3ly1 s ILE 284 CO -0.09 -0.29 1.12 0.54 -1.23 0.00 0.00 174.94 174.99 3ly1 s ASN 285 N -2.14 6.08 0.25 3.58 2.20 -1.26 -4.71 114.94 118.94 3ly1 s ASN 285 Ca 0.67 2.17 -0.06 0.00 -0.94 0.00 0.00 52.86 54.70 3ly1 s ASN 285 Cb -0.17 -2.59 0.26 0.00 -2.00 0.00 0.00 41.25 36.76 3ly1 s ASN 285 CO 0.24 -0.97 1.90 0.15 -2.94 0.00 0.00 177.10 175.48 3ly1 h PHE 286 N 1.69 1.23 -0.49 1.54 3.04 -1.93 -0.98 116.94 121.04 3ly1 h PHE 286 Ca -0.50 -0.00 -0.03 0.00 3.98 0.00 0.00 57.97 61.42 3ly1 h PHE 286 Cb 1.25 -0.40 -0.02 0.00 2.56 0.00 0.00 35.95 39.33 3ly1 h PHE 286 CO 0.53 0.81 0.18 0.77 -2.02 0.00 0.00 178.31 178.59 3ly1 h SER 287 N 1.29 0.68 -0.57 0.41 0.02 -1.85 -2.17 113.55 111.36 3ly1 h SER 287 Ca 0.34 -0.18 -0.10 0.00 -0.84 0.00 0.00 61.79 61.01 3ly1 h SER 287 Cb -0.06 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.28 3ly1 h SER 287 CO -0.06 0.68 -0.03 1.23 -1.14 0.00 0.00 176.83 177.50 3ly1 h GLY 288 N 0.65 1.12 0.73 -3.77 0.00 -1.82 -0.31 103.07 99.66 3ly1 h GLY 288 Ca 0.16 -0.83 -0.00 0.00 0.00 0.00 0.00 47.33 46.66 3ly1 h GLY 288 CO -0.01 0.77 -0.01 -2.08 0.00 0.00 0.00 176.54 175.20 3ly1 h VAL 289 N 0.94 1.17 -0.47 4.60 2.07 -1.08 0.89 116.25 124.37 3ly1 h VAL 289 Ca 0.16 -0.63 -0.01 0.00 0.82 0.00 0.00 66.70 67.04 3ly1 h VAL 289 Cb 0.58 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 3ly1 h VAL 289 CO 0.03 0.16 0.24 0.44 0.02 0.00 0.00 177.57 178.47 3ly1 h ASP 290 N -0.31 0.60 -0.45 0.57 5.19 -1.36 -1.00 116.42 119.66 3ly1 h ASP 290 Ca -0.00 -0.11 0.04 0.00 -0.62 0.00 0.00 57.03 56.33 3ly1 h ASP 290 Cb 0.29 -0.15 -0.04 0.00 0.18 0.00 0.00 39.33 39.61 3ly1 h ASP 290 CO 0.01 0.54 0.22 0.00 -3.12 0.00 0.00 179.24 176.89 3ly1 h ALA 291 N 1.09 0.56 -0.12 3.45 0.00 -1.00 -1.97 119.26 121.27 3ly1 h ALA 291 Ca 0.16 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.10 3ly1 h ALA 291 Cb 0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3ly1 h ALA 291 CO -0.02 -0.13 0.06 0.00 0.00 0.00 0.00 179.25 179.15 3ly1 h ALA 292 N 1.24 0.15 -0.78 0.00 0.00 -0.47 0.40 119.26 119.80 3ly1 h ALA 292 Ca 0.19 0.00 0.08 0.00 0.00 0.00 0.00 54.91 55.19 3ly1 h ALA 292 Cb 0.10 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.80 3ly1 h ALA 292 CO -0.14 -0.38 0.44 -0.07 0.00 0.00 0.00 179.25 179.10 3ly1 h LEU 293 N 0.13 0.63 -0.49 0.00 3.38 -1.13 -2.82 115.31 115.01 3ly1 h LEU 293 Ca 0.05 0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.92 3ly1 h LEU 293 Cb 0.01 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3ly1 h LEU 293 CO -0.03 0.37 -0.35 0.00 0.09 0.00 0.00 178.44 178.52 3ly1 h ALA 294 N 1.43 0.67 0.00 1.53 0.00 -0.86 -3.20 119.26 118.82 3ly1 h ALA 294 Ca 0.37 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 3ly1 h ALA 294 Cb 0.31 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3ly1 h ALA 294 CO -0.23 0.67 0.00 0.45 0.00 0.00 0.00 179.25 180.14 3ly1 n SER 295 N -4.06 2.93 0.00 0.00 2.88 0.09 -2.44 113.62 113.01 3ly1 n SER 295 Ca -0.01 -1.86 0.00 0.00 -1.33 0.00 0.00 58.87 55.67 3ly1 n SER 295 Cb 0.52 -0.67 0.00 0.00 -0.75 0.00 0.00 64.21 63.31 3ly1 n SER 295 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 3ly1 n ASN 297 N 2.04 0.00 -3.98 -3.46 3.02 -1.21 -4.57 115.26 107.09 3ly1 n ASN 297 Ca 0.07 0.00 -0.43 0.00 -0.03 0.00 0.00 54.58 54.19 3ly1 n ASN 297 Cb 0.35 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.53 3ly1 n ASN 297 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3ly1 n ASP 298 N 0.00 6.04 0.16 6.41 -0.08 -1.02 -4.82 116.55 123.24 3ly1 n ASP 298 Ca 0.00 -3.32 0.04 0.00 -1.51 0.00 0.00 54.79 50.00 3ly1 n ASP 298 Cb 0.00 -1.33 0.45 0.00 2.34 0.00 0.00 41.12 42.58 3ly1 n ASP 298 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 3ly1 h SER 299 N 5.57 0.14 -0.85 1.67 4.64 -1.92 -2.58 113.55 120.22 3ly1 h SER 299 Ca 0.25 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.53 3ly1 h SER 299 Cb 0.63 -0.04 -0.04 0.00 -0.31 0.00 0.00 62.40 62.64 3ly1 h SER 299 CO 1.40 0.28 0.45 0.00 -0.87 0.00 0.00 176.83 178.09 3ly1 h ALA 300 N 1.74 1.09 -0.56 5.18 0.00 -1.90 -1.84 119.26 122.98 3ly1 h ALA 300 Ca 0.03 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 3ly1 h ALA 300 Cb 0.30 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3ly1 h ALA 300 CO 0.02 0.62 0.23 0.35 0.00 0.00 0.00 179.25 180.46 3ly1 h PHE 301 N 1.19 0.84 -0.45 0.00 3.57 -1.85 -1.95 116.94 118.28 3ly1 h PHE 301 Ca 0.30 -0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.71 3ly1 h PHE 301 Cb 0.06 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.52 3ly1 h PHE 301 CO 0.01 0.68 0.17 0.82 -2.23 0.00 0.00 178.31 177.76 3ly1 h ILE 302 N 0.76 1.21 -0.37 1.41 1.08 -1.37 0.20 117.51 120.43 3ly1 h ILE 302 Ca 0.19 -0.66 0.07 0.00 -0.39 0.00 0.00 64.86 64.07 3ly1 h ILE 302 Cb 0.19 0.79 -0.06 0.00 -3.07 0.00 0.00 36.82 34.67 3ly1 h ILE 302 CO -0.02 0.24 -0.03 0.74 -0.69 0.00 0.00 178.15 178.40 3ly1 h THR 303 N 0.59 0.69 -0.68 -0.27 2.02 -1.32 -1.94 112.91 112.01 3ly1 h THR 303 Ca 0.15 -0.02 0.01 0.00 0.77 0.00 0.00 66.41 67.31 3ly1 h THR 303 Cb 0.21 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 67.21 3ly1 h THR 303 CO -0.01 0.01 0.45 0.22 0.37 0.00 0.00 175.52 176.56 3ly1 h TYR 304 N 0.07 0.85 -0.70 3.16 3.20 -0.69 -1.33 116.97 121.53 3ly1 h TYR 304 Ca 0.18 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.07 3ly1 h TYR 304 Cb 0.26 -0.29 -0.03 0.00 1.54 0.00 0.00 36.73 38.21 3ly1 h TYR 304 CO -0.28 0.54 0.45 1.03 -1.64 0.00 0.00 178.16 178.25 3ly1 h SER 305 N 0.92 0.82 -0.11 -2.11 0.87 -0.20 0.52 113.55 114.26 3ly1 h SER 305 Ca 0.25 -0.04 -0.04 0.00 -1.23 0.00 0.00 61.79 60.74 3ly1 h SER 305 Cb -0.11 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 61.65 3ly1 h SER 305 CO -0.05 0.61 -0.07 0.50 -0.53 0.00 0.00 176.83 177.28 3ly1 h LYS 306 N 0.95 0.24 -0.21 2.24 3.64 -1.19 -2.83 116.57 119.42 3ly1 h LYS 306 Ca 0.25 -0.11 0.05 0.00 -1.27 0.00 0.00 60.65 59.57 3ly1 h LYS 306 Cb -0.08 -0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 31.69 3ly1 h LYS 306 CO -0.05 0.62 -0.09 -0.22 -2.27 0.00 0.00 179.45 177.43 3ly1 h LYS 307 N -0.14 -0.06 -0.64 1.90 3.64 -0.85 0.45 116.57 120.87 3ly1 h LYS 307 Ca 0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 3ly1 h LYS 307 Cb 0.56 0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.36 3ly1 h LYS 307 CO 0.02 -0.04 0.41 1.03 -2.27 0.00 0.00 179.45 178.60 3ly1 h SER 308 N -0.06 0.75 -0.86 4.20 0.87 -1.00 -0.93 113.55 116.53 3ly1 h SER 308 Ca 0.11 -0.03 0.05 0.00 -1.23 0.00 0.00 61.79 60.69 3ly1 h SER 308 Cb 0.23 -0.19 -0.06 0.00 -0.44 0.00 0.00 62.40 61.94 3ly1 h SER 308 CO -0.25 0.56 0.54 -1.13 -0.53 0.00 0.00 176.83 176.01 3ly1 h ASN 309 N 0.87 0.86 -0.62 6.23 -1.24 -1.15 -1.74 115.58 118.79 3ly1 h ASN 309 Ca 0.23 0.01 -0.01 0.00 0.71 0.00 0.00 56.30 57.24 3ly1 h ASN 309 Cb -0.08 -0.17 -0.03 0.00 0.73 0.00 0.00 38.32 38.77 3ly1 h ASN 309 CO -0.05 0.57 0.35 0.44 -1.29 0.00 0.00 177.43 177.45 3ly1 h ASP 310 N 1.00 0.76 -0.32 1.15 3.32 0.16 -0.58 116.42 121.91 3ly1 h ASP 310 Ca 0.36 -0.08 0.01 0.00 0.02 0.00 0.00 57.03 57.33 3ly1 h ASP 310 Cb 0.11 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 3ly1 h ASP 310 CO -0.15 0.63 0.21 0.58 -1.72 0.00 0.00 179.24 178.78 3ly1 h VAL 311 N 0.84 1.07 -0.76 -1.35 2.07 -0.79 -2.74 116.25 114.58 3ly1 h VAL 311 Ca 0.22 -0.15 -0.05 0.00 0.82 0.00 0.00 66.70 67.54 3ly1 h VAL 311 Cb 0.02 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.37 3ly1 h VAL 311 CO -0.04 0.08 0.27 0.28 0.02 0.00 0.00 177.57 178.18 3ly1 h SER 312 N 0.42 1.08 -0.69 0.57 0.02 -0.92 -2.44 113.55 111.60 3ly1 h SER 312 Ca 0.12 -0.19 0.07 0.00 -0.84 0.00 0.00 61.79 60.95 3ly1 h SER 312 Cb -0.04 -0.28 -0.06 0.00 0.14 0.00 0.00 62.40 62.16 3ly1 h SER 312 CO -0.03 0.98 0.38 -0.09 -1.14 0.00 0.00 176.83 176.92 3ly1 h ARG 313 N 1.12 0.66 -0.17 3.45 2.43 -0.98 -2.66 114.38 118.23 3ly1 h ARG 313 Ca 0.25 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.27 3ly1 h ARG 313 Cb 0.27 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 3ly1 h ARG 313 CO -0.01 0.44 -0.38 1.96 -1.51 0.00 0.00 179.97 180.46 3ly1 h GLN 314 N 0.68 0.37 -0.80 0.20 1.08 -1.14 -1.35 115.11 114.16 3ly1 h GLN 314 Ca 0.31 -0.18 -0.04 0.00 -1.45 0.00 0.00 58.65 57.29 3ly1 h GLN 314 Cb 0.22 -0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.61 3ly1 h GLN 314 CO -0.20 0.71 0.33 0.82 -0.95 0.00 0.00 178.83 179.54 3ly1 h ILE 315 N 0.32 1.26 -0.14 2.54 2.04 -1.28 -1.30 117.51 120.94 3ly1 h ILE 315 Ca 0.03 -0.80 -0.15 0.00 1.00 0.00 0.00 64.86 64.94 3ly1 h ILE 315 Cb 0.82 0.30 0.01 0.00 -0.74 0.00 0.00 36.82 37.20 3ly1 h ILE 315 CO 0.07 0.33 -0.49 0.25 0.00 0.00 0.00 178.15 178.30 3ly1 h LEU 316 N 1.15 0.67 -1.02 1.44 5.85 -1.21 -3.06 115.31 119.12 3ly1 h LEU 316 Ca 0.27 -0.61 -0.05 0.00 0.84 0.00 0.00 57.88 58.33 3ly1 h LEU 316 Cb 0.19 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 3ly1 h LEU 316 CO -0.02 1.17 0.14 -0.07 -0.34 0.00 0.00 178.44 179.31 3ly1 h LEU 317 N 0.22 0.78 -0.22 2.25 3.38 -1.15 -1.62 115.31 118.94 3ly1 h LEU 317 Ca -0.02 -0.14 0.05 0.00 0.09 0.00 0.00 57.88 57.86 3ly1 h LEU 317 Cb 1.12 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.61 3ly1 h LEU 317 CO 0.10 0.76 -0.14 0.50 0.09 0.00 0.00 178.44 179.76 3ly1 h LYS 318 N 0.81 -0.12 -0.49 1.13 3.64 -1.25 0.61 116.57 120.89 3ly1 h LYS 318 Ca 0.18 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.56 3ly1 h LYS 318 Cb 0.29 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 3ly1 h LYS 318 CO -0.00 -0.08 0.28 0.00 -2.27 0.00 0.00 179.45 177.37 3ly1 h ALA 319 N 1.04 0.63 -0.81 5.00 0.00 -1.32 -0.40 119.26 123.40 3ly1 h ALA 319 Ca 0.13 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3ly1 h ALA 319 Cb 0.31 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 3ly1 h ALA 319 CO -0.30 0.15 0.44 -0.07 0.00 0.00 0.00 179.25 179.47 3ly1 h LEU 320 N 0.66 1.01 -0.40 0.00 3.38 -0.92 -0.80 115.31 118.23 3ly1 h LEU 320 Ca 0.17 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 3ly1 h LEU 320 Cb 0.04 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 3ly1 h LEU 320 CO -0.03 0.82 0.13 -0.33 0.09 0.00 0.00 178.44 179.11 3ly1 h GLU 321 N 1.12 0.62 -0.93 1.13 5.08 -0.56 0.43 114.58 121.48 3ly1 h GLU 321 Ca 0.28 -0.13 0.11 0.00 -1.00 0.00 0.00 59.36 58.62 3ly1 h GLU 321 Cb 0.03 -0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.11 3ly1 h GLU 321 CO -0.05 0.62 0.56 -0.44 -1.00 0.00 0.00 179.01 178.70 3ly1 h ASP 322 N 0.50 0.81 0.44 1.42 3.32 -0.67 -1.85 116.42 120.38 3ly1 h ASP 322 Ca 0.13 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.23 3ly1 h ASP 322 Cb 0.26 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.70 3ly1 h ASP 322 CO -0.00 0.44 -0.40 0.18 -1.72 0.00 0.00 179.24 177.73 3ly1 n LEU 323 N -4.68 0.62 -3.55 1.55 4.77 -0.34 -4.94 117.00 110.43 3ly1 n LEU 323 Ca 0.17 -0.05 -0.21 0.00 -0.03 0.00 0.00 56.01 55.89 3ly1 n LEU 323 Cb 0.33 -0.22 0.08 0.00 -2.33 0.00 0.00 43.42 41.27 3ly1 n LEU 323 CO 0.27 0.14 0.14 0.29 -1.33 0.00 0.00 177.39 176.90 3ly1 n LYS 324 N -1.25 -6.89 -3.68 3.23 5.02 0.03 -5.01 118.16 109.62 3ly1 n LYS 324 Ca 0.08 0.80 -0.37 0.00 -2.02 0.00 0.00 58.31 56.80 3ly1 n LYS 324 Cb 0.34 -5.78 -0.12 0.00 -0.02 0.00 0.00 35.03 29.44 3ly1 n LYS 324 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3ly1 s LEU 325 N -6.80 3.73 0.56 -0.35 1.43 -0.55 -5.04 118.68 111.65 3ly1 s LEU 325 Ca 0.26 -0.14 -0.20 0.00 -1.03 0.00 0.00 54.13 53.01 3ly1 s LEU 325 Cb -0.12 -2.01 -0.04 0.00 0.03 0.00 0.00 46.19 44.05 3ly1 s LEU 325 CO 0.74 -0.05 1.24 -2.84 0.23 0.00 0.00 176.35 175.67 3ly1 s PRO 326 N 1.68 3.14 0.08 1.29 0.02 -1.26 -4.61 135.00 135.33 3ly1 s PRO 326 Ca 0.07 1.93 -0.02 0.00 0.02 0.00 0.00 61.00 63.00 3ly1 s PRO 326 Cb -0.16 -2.10 -0.04 0.00 0.02 0.00 0.00 34.50 32.23 3ly1 s PRO 326 CO 0.07 -1.10 0.01 1.52 -0.33 0.00 0.00 177.00 177.18 3ly1 s TYR 327 N -1.50 0.61 0.17 6.54 1.13 -1.26 -0.52 117.35 122.52 3ly1 s TYR 327 Ca 0.74 -1.09 -0.01 0.00 -1.41 0.00 0.00 57.07 55.29 3ly1 s TYR 327 Cb -0.33 -0.40 -0.04 0.00 -1.10 0.00 0.00 41.96 40.09 3ly1 s TYR 327 CO 0.37 -0.44 0.36 -0.51 -2.51 0.00 0.00 175.55 172.82 3ly1 s LEU 328 N -2.96 4.26 0.26 -3.49 1.43 -0.70 -5.01 118.68 112.47 3ly1 s LEU 328 Ca 0.13 0.40 -0.30 0.00 -1.03 0.00 0.00 54.13 53.32 3ly1 s LEU 328 Cb 0.08 -3.15 -0.11 0.00 0.03 0.00 0.00 46.19 43.04 3ly1 s LEU 328 CO -0.06 0.00 1.58 -2.84 0.23 0.00 0.00 176.35 175.26 3ly1 s PRO 329 N -3.12 4.16 -0.29 1.29 0.02 -1.26 -4.60 135.00 131.21 3ly1 s PRO 329 Ca 0.38 2.51 -0.07 0.00 0.02 0.00 0.00 61.00 63.84 3ly1 s PRO 329 Cb -0.11 -3.06 0.00 0.00 0.02 0.00 0.00 34.50 31.35 3ly1 s PRO 329 CO 0.28 -0.60 0.07 0.45 -0.33 0.00 0.00 177.00 176.87 3ly1 s SER 330 N 0.63 5.09 0.00 2.53 0.15 -1.26 -3.56 113.70 117.28 3ly1 s SER 330 Ca 0.65 -0.62 0.06 0.00 0.70 0.00 0.00 55.95 56.74 3ly1 s SER 330 Cb -0.46 -1.88 0.07 0.00 -1.71 0.00 0.00 66.02 62.03 3ly1 s SER 330 CO 0.43 -0.16 0.78 -0.62 1.20 0.00 0.00 173.24 174.87 3ly1 n GLU 331 N 4.87 0.49 0.00 5.44 -0.58 0.68 -4.92 120.64 126.63 3ly1 n GLU 331 Ca -0.15 -1.05 0.00 0.00 -0.42 0.00 0.00 57.16 55.54 3ly1 n GLU 331 Cb 0.49 -1.12 0.00 0.00 -0.57 0.00 0.00 31.44 30.24 3ly1 n GLU 331 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ly1 n GLY 332 N 0.25 4.39 2.17 0.62 0.00 -1.25 -2.74 105.19 108.64 3ly1 n GLY 332 Ca 0.04 -1.90 -0.29 0.00 0.00 0.00 0.00 46.02 43.87 3ly1 n GLY 332 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3ly1 n ASN 333 N 0.00 6.09 -3.63 1.61 6.94 -1.26 -4.95 115.26 120.07 3ly1 n ASN 333 Ca 0.00 -3.75 -0.10 0.00 -0.02 0.00 0.00 54.58 50.71 3ly1 n ASN 333 Cb 0.00 -0.84 -0.03 0.00 -2.36 0.00 0.00 39.78 36.56 3ly1 n ASN 333 CO 0.00 0.00 0.00 0.72 -1.03 0.00 0.00 177.26 176.95 3ly1 s PHE 334 N -3.64 -0.30 -0.04 -2.53 -0.71 -1.26 -0.80 117.98 108.69 3ly1 s PHE 334 Ca 0.60 -0.01 0.03 0.00 -1.04 0.00 0.00 56.93 56.51 3ly1 s PHE 334 Cb 0.48 0.50 0.00 0.00 -1.21 0.00 0.00 43.02 42.80 3ly1 s PHE 334 CO 0.02 -0.93 -0.13 0.08 -1.34 0.00 0.00 175.22 172.92 3ly1 s VAL 335 N -3.83 1.13 -0.26 -2.49 1.01 -0.15 -4.66 120.40 111.16 3ly1 s VAL 335 Ca 0.06 -0.53 -0.09 0.00 0.00 0.00 0.00 61.98 61.42 3ly1 s VAL 335 Cb -0.02 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 3ly1 s VAL 335 CO -0.06 0.34 0.11 0.12 0.00 0.00 0.00 175.10 175.61 3ly1 s PHE 336 N 0.25 3.14 0.10 5.22 5.36 -1.26 -0.84 117.98 129.95 3ly1 s PHE 336 Ca -0.06 -0.22 0.01 0.00 -0.96 0.00 0.00 56.93 55.70 3ly1 s PHE 336 Cb -0.12 -2.28 -0.04 0.00 -0.34 0.00 0.00 43.02 40.24 3ly1 s PHE 336 CO 0.02 -0.27 -0.05 -3.38 -1.46 0.00 0.00 175.22 170.08 3ly1 s HIS 337 N 1.62 0.87 0.36 10.12 -3.43 -0.52 -1.72 115.29 122.59 3ly1 s HIS 337 Ca 0.06 -0.96 -0.14 0.00 -0.80 0.00 0.00 55.06 53.23 3ly1 s HIS 337 Cb -0.15 -0.51 -0.08 0.00 -1.43 0.00 0.00 32.58 30.40 3ly1 s HIS 337 CO 0.06 -0.20 0.77 -1.14 -2.00 0.00 0.00 174.74 172.23 3ly1 s GLN 338 N -3.86 3.93 0.13 -0.38 0.74 0.32 -1.02 119.66 119.51 3ly1 s GLN 338 Ca 0.13 0.62 0.09 0.00 0.05 0.00 0.00 55.36 56.25 3ly1 s GLN 338 Cb 0.06 -2.39 -0.04 0.00 1.10 0.00 0.00 33.01 31.74 3ly1 s GLN 338 CO -0.05 0.06 -0.22 -0.51 -0.55 0.00 0.00 175.29 174.03 3ly1 s LEU 339 N -3.35 2.34 0.00 3.68 1.43 0.54 -4.69 118.68 118.63 3ly1 s LEU 339 Ca 0.54 -0.74 0.12 0.00 -1.03 0.00 0.00 54.13 53.01 3ly1 s LEU 339 Cb -0.10 -0.96 0.05 0.00 0.03 0.00 0.00 46.19 45.21 3ly1 s LEU 339 CO 0.23 0.07 0.80 1.33 0.23 0.00 0.00 176.35 179.01 3ly1 n VAL 340 N 0.85 0.00 -4.05 -1.59 0.24 -1.26 -4.84 118.33 107.68 3ly1 n VAL 340 Ca -0.18 -0.45 -0.23 0.00 -2.04 0.00 0.00 64.34 61.45 3ly1 n VAL 340 Cb 0.54 1.20 -0.06 0.00 -1.47 0.00 0.00 33.84 34.06 3ly1 n VAL 340 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 3ly1 s VAL 341 N -1.23 3.09 0.25 3.34 -7.23 -1.26 -5.09 120.40 112.27 3ly1 s VAL 341 Ca 0.12 -1.64 -0.30 0.00 -1.81 0.00 0.00 61.98 58.35 3ly1 s VAL 341 Cb 0.10 -3.01 -0.10 0.00 0.56 0.00 0.00 36.38 33.93 3ly1 s VAL 341 CO 0.21 -0.18 1.47 -2.84 -0.31 0.00 0.00 175.10 173.46 3ly1 s PRO 342 N -3.87 4.24 0.21 4.82 0.02 -1.26 -4.88 135.00 134.28 3ly1 s PRO 342 Ca 0.38 2.35 -0.10 0.00 0.02 0.00 0.00 61.00 63.65 3ly1 s PRO 342 Cb -0.03 -3.10 0.29 0.00 0.02 0.00 0.00 34.50 31.68 3ly1 s PRO 342 CO 0.23 -0.46 1.71 1.25 -0.33 0.00 0.00 177.00 179.40 3ly1 h LEU 343 N 5.10 0.06 -1.19 -5.54 5.85 -1.94 -1.24 115.31 116.40 3ly1 h LEU 343 Ca -0.46 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.36 3ly1 h LEU 343 Cb 1.22 0.13 -0.04 0.00 0.37 0.00 0.00 40.66 42.34 3ly1 h LEU 343 CO 0.79 0.04 0.46 0.50 -0.34 0.00 0.00 178.44 179.88 3ly1 h LYS 344 N 0.29 1.01 -0.46 1.25 1.63 -1.93 0.19 116.57 118.56 3ly1 h LYS 344 Ca 0.31 -0.08 -0.08 0.00 -0.85 0.00 0.00 60.65 59.95 3ly1 h LYS 344 Cb 0.45 -0.22 -0.02 0.00 -0.60 0.00 0.00 32.23 31.85 3ly1 h LYS 344 CO -0.38 0.70 -0.03 -0.44 -3.45 0.00 0.00 179.45 175.85 3ly1 h ASP 345 N 1.03 0.81 -0.37 4.20 3.32 -1.71 -2.55 116.42 121.15 3ly1 h ASP 345 Ca 0.27 -0.32 -0.08 0.00 0.02 0.00 0.00 57.03 56.92 3ly1 h ASP 345 Cb -0.06 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.26 3ly1 h ASP 345 CO -0.05 0.94 -0.06 0.22 -1.72 0.00 0.00 179.24 178.56 3ly1 h TYR 346 N 0.67 0.79 -0.70 4.55 3.20 -0.24 -0.32 116.97 124.91 3ly1 h TYR 346 Ca 0.13 -0.16 0.09 0.00 3.14 0.00 0.00 58.73 61.92 3ly1 h TYR 346 Cb 0.54 -0.20 -0.07 0.00 1.54 0.00 0.00 36.73 38.55 3ly1 h TYR 346 CO 0.04 0.84 0.36 1.96 -1.64 0.00 0.00 178.16 179.71 3ly1 h GLN 347 N 0.51 0.60 -0.08 1.82 4.20 -0.67 -3.07 115.11 118.42 3ly1 h GLN 347 Ca 0.10 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.74 3ly1 h GLN 347 Cb 0.57 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.21 3ly1 h GLN 347 CO 0.03 0.40 -0.06 1.15 -0.67 0.00 0.00 178.83 179.68 3ly1 h THR 348 N 0.62 1.34 0.00 -0.54 2.02 -1.19 -0.14 112.91 115.01 3ly1 h THR 348 Ca 0.34 -1.13 0.00 0.00 0.77 0.00 0.00 66.41 66.39 3ly1 h THR 348 Cb 0.33 1.92 0.00 0.00 -1.74 0.00 0.00 68.15 68.66 3ly1 h THR 348 CO -0.25 0.32 0.00 1.41 0.37 0.00 0.00 175.52 177.37 3ly1 n HIS 349 N -4.73 0.00 0.00 3.16 8.25 -0.15 -1.04 115.22 120.71 3ly1 n HIS 349 Ca -0.07 -0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.36 3ly1 n HIS 349 Cb 0.28 -0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.32 3ly1 n HIS 349 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3ly1 n ALA 351 N 0.69 0.00 0.21 -1.41 0.00 -0.07 -1.84 120.51 118.09 3ly1 n ALA 351 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.49 3ly1 n ALA 351 Cb 0.05 0.00 0.46 0.00 0.00 0.00 0.00 19.45 19.97 3ly1 n ALA 351 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3ly1 h ASP 352 N 0.00 0.00 -0.01 0.00 3.32 -1.35 -1.08 116.42 117.30 3ly1 h ASP 352 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3ly1 h ASP 352 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3ly1 h ASP 352 CO 0.00 0.28 0.00 0.00 -1.72 0.00 0.00 179.24 177.80 3ly1 n ALA 353 N -2.42 2.66 -1.37 3.45 0.00 -0.77 -4.74 120.51 117.32 3ly1 n ALA 353 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.19 3ly1 n ALA 353 Cb 0.34 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.35 3ly1 n ALA 353 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3ly1 n GLY 354 N 1.01 0.95 2.71 0.00 0.00 -0.41 -4.72 105.19 104.72 3ly1 n GLY 354 Ca 0.22 -0.55 -0.24 0.00 0.00 0.00 0.00 46.02 45.45 3ly1 n GLY 354 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ly1 s VAL 355 N -2.14 0.23 -0.38 1.61 1.01 -1.25 -0.37 120.40 119.11 3ly1 s VAL 355 Ca 0.00 -0.06 -0.14 0.00 0.00 0.00 0.00 61.98 61.78 3ly1 s VAL 355 Cb 0.00 -0.60 0.01 0.00 0.00 0.00 0.00 36.38 35.79 3ly1 s VAL 355 CO 0.00 0.01 0.27 -0.76 0.00 0.00 0.00 175.10 174.63 3ly1 s LEU 356 N 2.01 4.87 0.00 3.92 1.43 0.04 -2.32 118.68 128.63 3ly1 s LEU 356 Ca 0.03 -0.72 0.08 0.00 -1.03 0.00 0.00 54.13 52.49 3ly1 s LEU 356 Cb -0.14 -2.15 0.08 0.00 0.03 0.00 0.00 46.19 44.01 3ly1 s LEU 356 CO -0.06 -0.36 0.63 2.30 0.23 0.00 0.00 176.35 179.09 3ly1 n ILE 357 N 5.13 0.00 -1.93 -0.59 -5.35 -1.26 -1.06 119.36 114.31 3ly1 n ILE 357 Ca -0.12 -1.83 -0.33 0.00 -0.27 0.00 0.00 62.75 60.21 3ly1 n ILE 357 Cb 0.48 -0.42 0.02 0.00 -1.74 0.00 0.00 39.64 37.98 3ly1 n ILE 357 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3ly1 s GLY 358 N -4.29 2.09 1.23 3.28 0.00 -0.85 -4.54 107.32 104.24 3ly1 s GLY 358 Ca 0.48 0.40 -0.19 0.00 0.00 0.00 0.00 44.72 45.41 3ly1 s GLY 358 CO 0.31 0.73 1.06 1.09 0.00 0.00 0.00 173.10 176.29 3ly1 s ARG 359 N -4.17 -1.45 0.43 2.90 1.70 -1.26 -4.72 118.95 112.37 3ly1 s ARG 359 Ca 0.64 0.07 -0.23 0.00 -0.47 0.00 0.00 55.73 55.74 3ly1 s ARG 359 Cb -0.17 -1.56 -0.08 0.00 -0.57 0.00 0.00 34.95 32.57 3ly1 s ARG 359 CO 0.40 -3.89 1.07 0.00 -1.08 0.00 0.00 175.30 171.80 3ly1 s ALA 360 N -2.82 3.01 -0.56 7.88 0.00 -1.26 -4.66 121.76 123.35 3ly1 s ALA 360 Ca 0.70 0.73 0.07 0.00 0.00 0.00 0.00 51.96 53.46 3ly1 s ALA 360 Cb -0.12 -3.29 0.25 0.00 0.00 0.00 0.00 23.12 19.96 3ly1 s ALA 360 CO 0.57 -0.34 0.68 1.19 0.00 0.00 0.00 175.76 177.86 3ly1 n PHE 361 N -0.37 2.45 -1.71 0.00 3.72 -1.26 -5.10 117.46 115.20 3ly1 n PHE 361 Ca 0.06 -3.98 -0.39 0.00 -0.05 0.00 0.00 57.45 53.09 3ly1 n PHE 361 Cb 0.50 -0.50 0.04 0.00 -0.94 0.00 0.00 39.48 38.58 3ly1 n PHE 361 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 3ly1 n PRO 362 N 1.02 1.60 -0.16 -1.08 -0.04 -1.26 -1.02 135.00 134.05 3ly1 n PRO 362 Ca 0.27 0.58 0.06 0.00 -0.04 0.00 0.00 63.50 64.38 3ly1 n PRO 362 Cb 0.45 -2.44 0.17 0.00 -0.04 0.00 0.00 33.50 31.64 3ly1 n PRO 362 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3ly1 n PRO 363 N -0.71 1.78 -2.05 0.54 -0.04 -1.26 -4.92 135.00 128.33 3ly1 n PRO 363 Ca 0.10 -1.21 -0.42 0.00 -0.04 0.00 0.00 63.50 61.94 3ly1 n PRO 363 Cb 0.44 -1.28 0.00 0.00 -0.04 0.00 0.00 33.50 32.62 3ly1 n PRO 363 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3ly1 n ALA 364 N 0.47 5.69 0.26 0.55 0.00 -0.18 -4.76 120.51 122.54 3ly1 n ALA 364 Ca 0.12 -4.11 0.12 0.00 0.00 0.00 0.00 53.44 49.57 3ly1 n ALA 364 Cb 0.29 -3.16 0.71 0.00 0.00 0.00 0.00 19.45 17.29 3ly1 n ALA 364 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 3ly1 h ASP 365 N 5.67 0.00 -0.47 0.00 3.32 -1.94 -2.76 116.42 120.23 3ly1 h ASP 365 Ca 0.51 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.50 3ly1 h ASP 365 Cb 0.58 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.10 3ly1 h ASP 365 CO 1.71 0.12 0.05 -0.46 -1.72 0.00 0.00 179.24 178.94 3ly1 n ASN 366 N -3.65 4.67 -4.36 6.45 2.04 -1.26 -4.64 115.26 114.51 3ly1 n ASN 366 Ca -0.02 -3.08 -0.24 0.00 -0.44 0.00 0.00 54.58 50.80 3ly1 n ASN 366 Cb 0.24 -0.64 -0.12 0.00 -2.53 0.00 0.00 39.78 36.73 3ly1 n ASN 366 CO 0.00 0.00 0.00 0.26 -0.44 0.00 0.00 177.26 177.08 3ly1 s TRP 367 N -2.87 2.01 0.09 -2.53 0.52 -1.04 -0.34 118.94 114.77 3ly1 s TRP 367 Ca 0.50 -0.42 0.07 0.00 0.02 0.00 0.00 56.10 56.27 3ly1 s TRP 367 Cb 0.39 -1.01 -0.03 0.00 -1.15 0.00 0.00 33.47 31.67 3ly1 s TRP 367 CO 0.12 0.39 -0.18 0.00 0.02 0.00 0.00 176.95 177.29 3ly1 s ARG 369 N -1.83 3.97 -0.25 0.00 3.52 -1.26 -1.44 118.95 121.65 3ly1 s ARG 369 Ca 0.03 -0.31 -0.03 0.00 -0.13 0.00 0.00 55.73 55.29 3ly1 s ARG 369 Cb -0.10 -3.60 0.02 0.00 -1.56 0.00 0.00 34.95 29.70 3ly1 s ARG 369 CO 0.03 -0.11 -0.04 0.42 -0.81 0.00 0.00 175.30 174.80 3ly1 s ILE 370 N 1.54 3.10 0.62 4.11 -1.09 -0.02 -2.01 121.20 127.46 3ly1 s ILE 370 Ca 0.07 -0.89 -0.15 0.00 -2.23 0.00 0.00 60.65 57.45 3ly1 s ILE 370 Cb -0.15 -2.55 -0.02 0.00 -1.58 0.00 0.00 42.46 38.15 3ly1 s ILE 370 CO 0.09 0.22 1.07 -0.44 -1.23 0.00 0.00 174.94 174.64 3ly1 s SER 371 N 1.37 5.59 -0.37 3.58 0.01 -0.86 -0.97 113.70 122.05 3ly1 s SER 371 Ca 0.01 1.84 -0.18 0.00 1.31 0.00 0.00 55.95 58.93 3ly1 s SER 371 Cb -0.16 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.54 3ly1 s SER 371 CO -0.03 -1.30 0.52 -0.76 0.41 0.00 0.00 173.24 172.08 3ly1 s LEU 372 N -4.69 4.44 0.00 2.44 1.43 0.02 -4.80 118.68 117.52 3ly1 s LEU 372 Ca 0.64 -0.17 0.00 0.00 -1.03 0.00 0.00 54.13 53.57 3ly1 s LEU 372 Cb -0.17 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 43.48 3ly1 s LEU 372 CO 0.40 -0.54 0.00 0.61 0.23 0.00 0.00 176.35 177.05 3ly1 n GLY 373 N 4.88 -0.69 3.70 -3.19 0.00 -1.26 -4.61 105.19 104.02 3ly1 n GLY 373 Ca -0.05 -1.71 -0.31 0.00 0.00 0.00 0.00 46.02 43.95 3ly1 n GLY 373 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ly1 s THR 374 N -0.52 2.53 0.39 2.61 -4.23 -1.26 -4.78 115.64 110.38 3ly1 s THR 374 Ca 0.00 0.17 0.11 0.00 -1.18 0.00 0.00 61.69 60.79 3ly1 s THR 374 Cb 0.00 -2.38 0.33 0.00 1.34 0.00 0.00 72.50 71.79 3ly1 s THR 374 CO 0.00 -0.22 1.91 -0.65 -0.54 0.00 0.00 174.62 175.12 3ly1 h PRO 375 N -1.64 0.56 -0.20 3.99 0.11 -1.94 -1.16 132.00 131.73 3ly1 h PRO 375 Ca -0.44 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 65.44 3ly1 h PRO 375 Cb 1.26 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3ly1 h PRO 375 CO 0.46 0.37 -0.64 1.96 -0.21 0.00 0.00 178.00 179.94 3ly1 h GLN 376 N 0.58 0.72 -0.34 1.05 4.20 -1.97 -1.55 115.11 117.80 3ly1 h GLN 376 Ca 0.38 -0.51 0.00 0.00 0.06 0.00 0.00 58.65 58.58 3ly1 h GLN 376 Cb 0.67 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.53 3ly1 h GLN 376 CO -0.14 1.13 0.00 0.39 -0.67 0.00 0.00 178.83 179.54 3ly1 n GLU 377 N -3.95 0.11 0.00 1.46 1.02 -0.44 -2.48 120.64 116.36 3ly1 n GLU 377 Ca -0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 3ly1 n GLU 377 Cb 0.67 -1.11 0.00 0.00 -0.02 0.00 0.00 31.44 30.98 3ly1 n GLU 377 CO 0.00 0.00 0.00 0.94 1.18 0.00 0.00 177.13 179.25 3ly1 n GLN 379 N 0.51 0.00 -0.09 3.49 -0.06 -0.58 -1.30 117.38 119.34 3ly1 n GLN 379 Ca 0.00 0.00 -0.14 0.00 -2.00 0.00 0.00 57.00 54.86 3ly1 n GLN 379 Cb 0.03 0.00 -0.04 0.00 -4.06 0.00 0.00 30.24 26.17 3ly1 n GLN 379 CO 0.00 0.00 0.00 2.35 -0.20 0.00 0.00 177.06 179.21 3ly1 h TRP 380 N 0.00 0.92 -0.29 3.69 2.91 -1.76 -1.82 115.95 119.60 3ly1 h TRP 380 Ca 0.00 -0.29 -0.02 0.00 1.13 0.00 0.00 58.89 59.70 3ly1 h TRP 380 Cb 0.00 -0.19 -0.01 0.00 -0.51 0.00 0.00 29.16 28.45 3ly1 h TRP 380 CO 0.00 1.07 0.09 0.28 -1.03 0.00 0.00 178.44 178.84 3ly1 h VAL 381 N 0.51 1.20 -0.36 2.65 2.07 -1.47 -0.55 116.25 120.30 3ly1 h VAL 381 Ca 0.04 -0.66 0.05 0.00 0.82 0.00 0.00 66.70 66.95 3ly1 h VAL 381 Cb 0.94 1.09 -0.05 0.00 -1.52 0.00 0.00 31.29 31.76 3ly1 h VAL 381 CO 0.08 0.22 0.08 0.00 0.02 0.00 0.00 177.57 177.98 3ly1 h ALA 382 N 0.92 0.39 0.00 1.67 0.00 -1.80 -0.57 119.26 119.86 3ly1 h ALA 382 Ca 0.09 0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3ly1 h ALA 382 Cb 0.25 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 3ly1 h ALA 382 CO -0.00 -0.32 -0.21 -0.44 0.00 0.00 0.00 179.25 178.28 3ly1 h ASP 383 N 0.21 0.00 0.00 0.00 3.32 -1.28 -1.04 116.42 117.63 3ly1 h ASP 383 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 3ly1 h ASP 383 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 3ly1 h ASP 383 CO -0.21 0.21 0.00 0.41 -1.72 0.00 0.00 179.24 177.93 3ly1 n THR 384 N -4.20 0.52 0.00 0.35 -1.04 -0.22 -1.29 114.28 108.40 3ly1 n THR 384 Ca -0.02 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 3ly1 n THR 384 Cb 0.27 -0.78 0.00 0.00 -1.82 0.00 0.00 70.33 68.00 3ly1 n THR 384 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 3ly1 n ARG 386 N 0.84 0.00 -0.13 -2.82 1.74 -0.40 -0.53 116.66 115.36 3ly1 n ARG 386 Ca 0.00 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.04 3ly1 n ARG 386 Cb 0.24 0.00 0.15 0.00 -1.02 0.00 0.00 32.46 31.84 3ly1 n ARG 386 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 3ly1 h GLU 387 N 0.00 0.85 -0.72 5.56 4.39 -1.48 -2.80 114.58 120.38 3ly1 h GLU 387 Ca 0.00 -0.21 -0.00 0.00 0.34 0.00 0.00 59.36 59.49 3ly1 h GLU 387 Cb 0.00 -0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 28.51 3ly1 h GLU 387 CO 0.00 0.81 0.45 0.74 -1.16 0.00 0.00 179.01 179.85 3ly1 h PHE 388 N 0.80 0.95 -0.66 4.33 -1.00 -1.08 -2.79 116.94 117.49 3ly1 h PHE 388 Ca 0.16 0.00 0.02 0.00 2.81 0.00 0.00 57.97 60.97 3ly1 h PHE 388 Cb 0.39 -0.31 -0.04 0.00 3.61 0.00 0.00 35.95 39.60 3ly1 h PHE 388 CO 0.02 0.63 0.42 -0.09 -1.61 0.00 0.00 178.31 177.68 3ly1 h ARG 389 N 0.99 0.82 -0.68 1.51 9.65 -1.70 0.29 114.38 125.26 3ly1 h ARG 389 Ca 0.26 -0.05 0.15 0.00 -1.10 0.00 0.00 59.98 59.24 3ly1 h ARG 389 Cb -0.05 -0.18 -0.04 0.00 -1.39 0.00 0.00 29.97 28.31 3ly1 h ARG 389 CO -0.05 0.54 0.47 0.87 2.80 0.00 0.00 179.97 184.60 3ly1 h LYS 390 N 0.84 0.26 -0.38 0.20 1.57 -1.34 -1.22 116.57 116.50 3ly1 h LYS 390 Ca 0.26 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 3ly1 h LYS 390 Cb -0.03 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.22 3ly1 h LYS 390 CO -0.08 0.17 0.00 0.36 -0.57 0.00 0.00 179.45 179.33 3ly1 n LYS 391 N -4.44 3.52 -1.50 3.15 2.85 -0.64 -4.97 118.16 116.14 3ly1 n LYS 391 Ca 0.13 -2.89 -0.17 0.00 -1.05 0.00 0.00 58.31 54.33 3ly1 n LYS 391 Cb 0.56 -1.93 -0.07 0.00 -0.65 0.00 0.00 35.03 32.94 3ly1 n LYS 391 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 3ly1 n SER 392 N -0.02 -5.04 -0.15 -5.58 7.64 -0.46 -4.90 113.62 105.12 3ly1 n SER 392 Ca 0.23 0.42 0.14 0.00 1.01 0.00 0.00 58.87 60.66 3ly1 n SER 392 Cb 0.95 -4.04 0.53 0.00 -1.01 0.00 0.00 64.21 60.64 3ly1 n SER 392 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 3ly1 n TRP 393 N -2.52 0.00 -1.28 1.43 8.01 0.94 -4.97 117.44 119.05 3ly1 n TRP 393 Ca -0.17 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.02 3ly1 n TRP 393 Cb 0.56 -0.18 0.00 0.00 -2.01 0.00 0.00 31.31 29.68 3ly1 n TRP 393 CO 0.00 0.00 0.00 1.51 -1.01 0.00 0.00 177.69 178.19