#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1st4 s PRO 39 N 0.00 4.16 0.34 0.00 0.04 -1.26 -5.08 135.00 133.21 1st4 s PRO 39 Ca 0.00 1.10 0.00 0.00 0.04 0.00 0.00 61.00 62.15 1st4 s PRO 39 Cb 0.00 -2.17 -0.00 0.00 0.04 0.00 0.00 34.50 32.37 1st4 s PRO 39 CO 0.00 -0.09 0.01 1.33 0.04 0.00 0.00 177.00 178.28 1st4 n VAL 40 N -0.82 0.00 -4.48 -0.36 0.24 -1.26 -5.16 118.33 106.49 1st4 n VAL 40 Ca 0.07 -1.65 -0.26 0.00 -2.04 0.00 0.00 64.34 60.46 1st4 n VAL 40 Cb 0.54 0.35 -0.10 0.00 -1.47 0.00 0.00 33.84 33.16 1st4 n VAL 40 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1st4 s ARG 41 N -3.25 1.95 0.33 7.34 1.81 -1.26 -5.10 118.95 120.77 1st4 s ARG 41 Ca 0.01 -1.92 -0.26 0.00 -1.72 0.00 0.00 55.73 51.84 1st4 s ARG 41 Cb 0.00 -1.77 -0.14 0.00 -0.45 0.00 0.00 34.95 32.60 1st4 s ARG 41 CO 0.01 0.08 0.83 1.28 -0.68 0.00 0.00 175.30 176.81 1st4 n LEU 42 N -0.91 1.07 -0.45 2.53 4.77 -1.26 -4.83 117.00 117.93 1st4 n LEU 42 Ca -0.04 1.08 0.00 0.00 -0.03 0.00 0.00 56.01 57.02 1st4 n LEU 42 Cb 0.64 -1.21 0.00 0.00 -2.33 0.00 0.00 43.42 40.52 1st4 n LEU 42 CO 0.45 -1.99 0.18 -0.81 -1.33 0.00 0.00 177.39 173.89 1st4 n PRO 43 N 0.64 0.66 -4.02 3.23 -0.04 -1.26 -4.76 135.00 129.43 1st4 n PRO 43 Ca 0.11 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.48 1st4 n PRO 43 Cb 0.34 -1.29 -0.06 0.00 -0.04 0.00 0.00 33.50 32.45 1st4 n PRO 43 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1st4 s PHE 44 N -1.11 0.48 -0.09 0.54 -0.12 -1.26 -5.12 117.98 111.30 1st4 s PHE 44 Ca 0.00 -0.82 -0.04 0.00 -0.05 0.00 0.00 56.93 56.02 1st4 s PHE 44 Cb 0.00 0.06 -0.04 0.00 -0.63 0.00 0.00 43.02 42.41 1st4 s PHE 44 CO 0.00 -0.92 0.06 -1.12 -0.05 0.00 0.00 175.22 173.19 1st4 s SER 45 N -3.04 5.72 0.00 1.98 0.01 -1.26 -4.98 113.70 112.13 1st4 s SER 45 Ca 0.25 0.27 0.00 0.00 1.31 0.00 0.00 55.95 57.78 1st4 s SER 45 Cb 0.01 -1.72 0.00 0.00 0.21 0.00 0.00 66.02 64.52 1st4 s SER 45 CO 0.09 0.38 0.00 0.61 0.41 0.00 0.00 173.24 174.73 1st4 n GLY 46 N 2.02 -2.43 3.40 3.44 0.00 -1.26 -0.74 105.19 109.62 1st4 n GLY 46 Ca -0.19 -1.45 -0.03 0.00 0.00 0.00 0.00 46.02 44.34 1st4 n GLY 46 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1st4 s PHE 47 N -3.10 -1.16 -0.21 1.61 5.36 -1.26 -4.63 117.98 114.59 1st4 s PHE 47 Ca 0.00 1.88 -0.02 0.00 -0.96 0.00 0.00 56.93 57.83 1st4 s PHE 47 Cb 0.00 0.55 0.01 0.00 -0.34 0.00 0.00 43.02 43.24 1st4 s PHE 47 CO 0.00 -0.64 -0.11 0.50 -1.46 0.00 0.00 175.22 173.52 1st4 s ARG 48 N 2.77 3.17 -0.10 10.12 3.52 0.03 -4.89 118.95 133.57 1st4 s ARG 48 Ca 0.00 -0.74 -0.37 0.00 -0.13 0.00 0.00 55.73 54.49 1st4 s ARG 48 Cb -0.13 -2.83 -0.15 0.00 -1.56 0.00 0.00 34.95 30.28 1st4 s ARG 48 CO -0.17 -0.22 1.65 -0.11 -0.81 0.00 0.00 175.30 175.64 1st4 n LEU 49 N 4.72 2.49 -0.11 -0.88 7.94 -1.26 -0.79 117.00 129.11 1st4 n LEU 49 Ca -0.19 1.07 -0.13 0.00 -1.11 0.00 0.00 56.01 55.64 1st4 n LEU 49 Cb 0.50 -1.23 -0.12 0.00 0.53 0.00 0.00 43.42 43.10 1st4 n LEU 49 CO 0.28 -0.50 -1.20 0.00 -1.11 0.00 0.00 177.39 174.86 1st4 n GLN 50 N 4.69 0.76 -3.64 1.96 1.13 0.15 -4.86 117.38 117.57 1st4 n GLN 50 Ca 0.23 0.08 -0.04 0.00 -1.94 0.00 0.00 57.00 55.32 1st4 n GLN 50 Cb 0.20 -1.47 -0.07 0.00 0.11 0.00 0.00 30.24 29.01 1st4 n GLN 50 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 1st4 s LYS 51 N -2.46 0.38 -0.58 -1.09 2.20 -0.84 -5.02 119.74 112.33 1st4 s LYS 51 Ca -0.23 0.57 -0.28 0.00 -0.36 0.00 0.00 55.97 55.68 1st4 s LYS 51 Cb 0.07 0.12 0.03 0.00 -1.51 0.00 0.00 37.83 36.54 1st4 s LYS 51 CO 0.63 -0.07 1.18 0.08 -0.36 0.00 0.00 175.35 176.82 1st4 s VAL 52 N 0.91 4.03 0.16 4.02 1.01 -1.26 -0.12 120.40 129.14 1st4 s VAL 52 Ca -0.04 0.88 -0.09 0.00 0.00 0.00 0.00 61.98 62.72 1st4 s VAL 52 Cb -0.04 -4.72 -0.03 0.00 0.00 0.00 0.00 36.38 31.59 1st4 s VAL 52 CO -0.12 -1.34 1.51 -0.07 0.00 0.00 0.00 175.10 175.08 1st4 h LEU 53 N 11.89 0.95 -7.00 3.92 3.38 -1.34 -3.47 115.31 123.65 1st4 h LEU 53 Ca -0.25 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.29 1st4 h LEU 53 Cb 1.06 -0.27 -0.22 0.00 0.09 0.00 0.00 40.66 41.32 1st4 h LEU 53 CO 1.18 1.20 0.24 -0.60 0.09 0.00 0.00 178.44 180.56 1st4 s ARG 54 N -4.42 0.76 0.01 1.13 3.52 -1.15 -2.15 118.95 116.65 1st4 s ARG 54 Ca -0.10 0.79 -0.03 0.00 -0.13 0.00 0.00 55.73 56.25 1st4 s ARG 54 Cb 0.12 0.37 -0.01 0.00 -1.56 0.00 0.00 34.95 33.86 1st4 s ARG 54 CO 0.87 -0.11 0.05 -1.83 -0.81 0.00 0.00 175.30 173.47 1st4 s GLU 55 N 0.15 0.39 -0.11 5.12 -1.05 -1.26 -0.74 118.70 121.18 1st4 s GLU 55 Ca -0.00 -0.50 -0.03 0.00 -0.15 0.00 0.00 54.97 54.29 1st4 s GLU 55 Cb -0.04 0.15 0.04 0.00 -0.44 0.00 0.00 34.13 33.84 1st4 s GLU 55 CO -0.00 -0.08 0.04 0.45 0.95 0.00 0.00 175.26 176.62 1st4 s SER 56 N -1.40 1.93 0.27 0.83 0.15 -0.06 -5.01 113.70 110.42 1st4 s SER 56 Ca -0.15 -0.32 -0.01 0.00 0.70 0.00 0.00 55.95 56.17 1st4 s SER 56 Cb -0.09 -0.37 0.38 0.00 -1.71 0.00 0.00 66.02 64.23 1st4 s SER 56 CO 0.00 -0.26 1.79 0.00 1.20 0.00 0.00 173.24 175.97 1st4 h ALA 57 N 8.35 1.16 -0.76 5.45 0.00 -1.98 -1.51 119.26 129.97 1st4 h ALA 57 Ca -0.16 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.52 1st4 h ALA 57 Cb 1.13 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 1st4 h ALA 57 CO 0.26 0.55 0.50 -0.09 0.00 0.00 0.00 179.25 180.47 1st4 h ARG 58 N 0.73 0.98 -0.01 0.00 2.43 -1.96 -2.61 114.38 113.93 1st4 h ARG 58 Ca 0.15 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1st4 h ARG 58 Cb 0.40 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 1st4 h ARG 58 CO 0.01 0.65 -0.38 -0.25 -1.51 0.00 0.00 179.97 178.49 1st4 n ASP 59 N -4.57 1.71 -3.58 -3.80 8.00 -1.16 -4.97 116.55 108.18 1st4 n ASP 59 Ca 0.08 -1.32 -0.22 0.00 0.71 0.00 0.00 54.79 54.03 1st4 n ASP 59 Cb 0.03 0.34 0.05 0.00 -0.02 0.00 0.00 41.12 41.52 1st4 n ASP 59 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1st4 n LYS 60 N -0.19 -3.63 -3.92 -1.24 4.01 -0.59 -4.69 118.16 107.91 1st4 n LYS 60 Ca 0.11 0.65 -0.10 0.00 -0.51 0.00 0.00 58.31 58.46 1st4 n LYS 60 Cb 0.43 -5.12 -0.10 0.00 -0.51 0.00 0.00 35.03 29.73 1st4 n LYS 60 CO 0.00 0.00 0.00 -1.50 -1.11 0.00 0.00 177.40 174.79 1st4 s ILE 61 N -3.54 0.11 -0.06 -0.18 2.07 -1.11 -1.14 121.20 117.35 1st4 s ILE 61 Ca 0.20 -0.91 -0.04 0.00 -1.41 0.00 0.00 60.65 58.49 1st4 s ILE 61 Cb -0.05 -0.56 0.02 0.00 0.13 0.00 0.00 42.46 42.00 1st4 s ILE 61 CO 0.80 -0.50 0.14 -0.51 -1.91 0.00 0.00 174.94 172.97 1st4 s ILE 62 N -1.86 -0.01 -0.20 2.00 2.07 -0.36 -0.88 121.20 121.97 1st4 s ILE 62 Ca -0.11 0.04 0.01 0.00 -1.41 0.00 0.00 60.65 59.18 1st4 s ILE 62 Cb -0.06 -0.21 0.03 0.00 0.13 0.00 0.00 42.46 42.35 1st4 s ILE 62 CO -0.01 0.01 -0.17 -0.36 -1.91 0.00 0.00 174.94 172.50 1st4 s PHE 63 N 0.30 2.86 -0.04 3.50 0.40 0.08 -1.46 117.98 123.61 1st4 s PHE 63 Ca -0.02 -1.80 0.04 0.00 -0.60 0.00 0.00 56.93 54.55 1st4 s PHE 63 Cb -0.03 -1.89 -0.03 0.00 0.51 0.00 0.00 43.02 41.58 1st4 s PHE 63 CO -0.01 -0.82 -0.15 -0.51 0.70 0.00 0.00 175.22 174.43 1st4 s LEU 64 N 1.26 2.67 -0.30 -0.37 1.43 0.91 -0.91 118.68 123.37 1st4 s LEU 64 Ca 0.01 -0.22 -0.11 0.00 -1.03 0.00 0.00 54.13 52.78 1st4 s LEU 64 Cb -0.15 -1.54 -0.03 0.00 0.03 0.00 0.00 46.19 44.51 1st4 s LEU 64 CO -0.10 0.34 0.17 -2.28 0.23 0.00 0.00 176.35 174.71 1st4 s HIS 65 N -0.73 3.19 0.18 0.29 5.65 0.83 -0.85 115.29 123.85 1st4 s HIS 65 Ca 0.11 -0.21 0.09 0.00 0.25 0.00 0.00 55.06 55.30 1st4 s HIS 65 Cb -0.11 -2.38 -0.04 0.00 -1.18 0.00 0.00 32.58 28.88 1st4 s HIS 65 CO 0.00 -0.31 -0.12 0.20 -0.65 0.00 0.00 174.74 173.86 1st4 s GLY 66 N 1.69 1.73 -0.09 1.59 0.00 -0.28 0.35 107.32 112.31 1st4 s GLY 66 Ca 0.06 -1.50 -0.14 0.00 0.00 0.00 0.00 44.72 43.14 1st4 s GLY 66 CO 0.09 -1.52 0.36 0.54 0.00 0.00 0.00 173.10 172.56 1st4 s LYS 67 N -2.77 4.07 0.17 2.90 -0.14 0.03 -1.29 119.74 122.70 1st4 s LYS 67 Ca 0.24 0.26 0.04 0.00 -1.36 0.00 0.00 55.97 55.14 1st4 s LYS 67 Cb -0.09 -3.33 -0.05 0.00 -1.68 0.00 0.00 37.83 32.69 1st4 s LYS 67 CO 0.14 0.44 -0.06 0.14 -0.76 0.00 0.00 175.35 175.25 1st4 s VAL 68 N -0.22 1.04 -1.64 3.17 -7.23 0.30 -0.79 120.40 115.03 1st4 s VAL 68 Ca 0.21 -2.04 -0.03 0.00 -1.81 0.00 0.00 61.98 58.31 1st4 s VAL 68 Cb -0.15 -2.01 0.00 0.00 0.56 0.00 0.00 36.38 34.78 1st4 s VAL 68 CO 0.09 -0.60 0.37 0.59 -0.31 0.00 0.00 175.10 175.24 1st4 n ASN 69 N -0.26 -6.04 0.15 4.85 3.02 0.08 -1.06 115.26 116.00 1st4 n ASN 69 Ca -0.08 -0.18 0.13 0.00 -0.03 0.00 0.00 54.58 54.42 1st4 n ASN 69 Cb 0.62 -4.93 0.48 0.00 -0.61 0.00 0.00 39.78 35.34 1st4 n ASN 69 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1st4 h GLU 70 N -0.84 0.00 -0.96 3.52 5.08 -1.89 -3.11 114.58 116.38 1st4 h GLU 70 Ca -0.52 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 57.47 1st4 h GLU 70 Cb 1.37 0.00 -0.23 0.00 0.50 0.00 0.00 28.75 30.39 1st4 h GLU 70 CO 0.57 0.00 0.48 0.00 -1.00 0.00 0.00 179.01 179.06 1st4 n ALA 71 N -1.85 4.91 -2.15 3.43 0.00 -1.26 -4.21 120.51 119.38 1st4 n ALA 71 Ca 0.03 -2.31 -0.08 0.00 0.00 0.00 0.00 53.44 51.07 1st4 n ALA 71 Cb 0.31 -1.34 -0.10 0.00 0.00 0.00 0.00 19.45 18.32 1st4 n ALA 71 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1st4 s SER 72 N -0.88 0.39 1.78 0.00 1.04 -1.17 -5.00 113.70 109.85 1st4 s SER 72 Ca 0.47 -1.06 0.00 0.00 0.48 0.00 0.00 55.95 55.84 1st4 s SER 72 Cb 0.39 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.77 1st4 s SER 72 CO 0.10 -0.67 0.00 0.61 0.98 0.00 0.00 173.24 174.26 1st4 n GLY 73 N 0.01 3.58 0.25 7.32 0.00 -1.26 -0.92 105.19 114.16 1st4 n GLY 73 Ca -0.10 -0.06 0.09 0.00 0.00 0.00 0.00 46.02 45.95 1st4 n GLY 73 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1st4 n ASP 74 N 4.97 0.74 0.00 1.61 5.75 -1.26 -4.91 116.55 123.45 1st4 n ASP 74 Ca 0.00 -1.62 0.00 0.00 -0.01 0.00 0.00 54.79 53.16 1st4 n ASP 74 Cb 0.00 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.04 1st4 n ASP 74 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1st4 n GLY 75 N 0.91 0.97 0.07 6.12 0.00 -0.10 -4.89 105.19 108.28 1st4 n GLY 75 Ca 0.13 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.08 1st4 n GLY 75 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1st4 h ASP 76 N 0.00 0.00 0.00 1.61 3.32 -1.79 -3.46 116.42 116.10 1st4 h ASP 76 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1st4 h ASP 76 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1st4 h ASP 76 CO 0.00 0.97 0.00 0.61 -1.72 0.00 0.00 179.24 179.10 1st4 n GLY 77 N 1.43 0.23 3.22 2.75 0.00 -1.26 -4.87 105.19 106.69 1st4 n GLY 77 Ca -0.07 -0.92 -0.10 0.00 0.00 0.00 0.00 46.02 44.93 1st4 n GLY 77 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1st4 s GLU 78 N 0.00 1.04 0.00 1.61 2.02 -0.23 -4.92 118.70 118.23 1st4 s GLU 78 Ca 0.00 -1.39 -0.16 0.00 0.02 0.00 0.00 54.97 53.43 1st4 s GLU 78 Cb 0.00 0.29 -0.06 0.00 0.10 0.00 0.00 34.13 34.46 1st4 s GLU 78 CO 0.00 -0.33 0.46 -0.51 0.02 0.00 0.00 175.26 174.90 1st4 s ASP 79 N -3.04 6.86 0.13 -0.19 1.01 -1.26 -0.54 116.67 119.64 1st4 s ASP 79 Ca 0.24 1.03 0.02 0.00 0.71 0.00 0.00 52.55 54.55 1st4 s ASP 79 Cb 0.06 -2.29 -0.04 0.00 1.01 0.00 0.00 42.92 41.66 1st4 s ASP 79 CO 0.03 0.27 -0.06 0.00 0.21 0.00 0.00 175.17 175.62 1st4 s ALA 80 N -0.85 1.20 -0.09 5.23 0.00 -0.41 -0.81 121.76 126.02 1st4 s ALA 80 Ca 0.25 -1.45 0.04 0.00 0.00 0.00 0.00 51.96 50.80 1st4 s ALA 80 Cb -0.17 0.22 0.00 0.00 0.00 0.00 0.00 23.12 23.17 1st4 s ALA 80 CO 0.14 -0.22 -0.21 0.08 0.00 0.00 0.00 175.76 175.56 1st4 s VAL 81 N -3.55 1.85 -0.09 0.00 1.01 -0.43 -1.13 120.40 118.06 1st4 s VAL 81 Ca 0.16 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.26 1st4 s VAL 81 Cb 0.05 -1.61 -0.02 0.00 0.00 0.00 0.00 36.38 34.80 1st4 s VAL 81 CO -0.01 0.51 -0.15 -0.69 0.00 0.00 0.00 175.10 174.76 1st4 s VAL 82 N 0.39 2.94 -0.11 2.92 1.01 -0.03 -0.89 120.40 126.63 1st4 s VAL 82 Ca -0.17 -0.73 0.02 0.00 0.00 0.00 0.00 61.98 61.09 1st4 s VAL 82 Cb -0.17 -2.18 0.01 0.00 0.00 0.00 0.00 36.38 34.03 1st4 s VAL 82 CO 0.08 0.56 -0.17 -0.63 0.00 0.00 0.00 175.10 174.93 1st4 s ILE 83 N -0.12 1.63 -0.10 2.22 1.01 0.86 -0.06 121.20 126.63 1st4 s ILE 83 Ca -0.02 -0.73 0.03 0.00 0.00 0.00 0.00 60.65 59.93 1st4 s ILE 83 Cb -0.14 -1.47 0.01 0.00 0.01 0.00 0.00 42.46 40.87 1st4 s ILE 83 CO 0.04 0.47 -0.20 -0.76 0.00 0.00 0.00 174.94 174.48 1st4 s LEU 84 N 0.88 1.94 -0.08 2.97 1.43 -0.54 -0.67 118.68 124.62 1st4 s LEU 84 Ca -0.08 -0.50 0.01 0.00 -1.03 0.00 0.00 54.13 52.53 1st4 s LEU 84 Cb -0.15 -1.25 0.02 0.00 0.03 0.00 0.00 46.19 44.84 1st4 s LEU 84 CO -0.00 0.09 -0.07 -0.70 0.23 0.00 0.00 176.35 175.90 1st4 s GLU 85 N 0.62 1.30 0.63 1.70 2.12 0.27 -1.22 118.70 124.11 1st4 s GLU 85 Ca -0.13 -0.22 -0.18 0.00 0.36 0.00 0.00 54.97 54.80 1st4 s GLU 85 Cb -0.17 -1.28 -0.02 0.00 0.26 0.00 0.00 34.13 32.93 1st4 s GLU 85 CO 0.04 -0.14 1.21 0.15 -0.54 0.00 0.00 175.26 175.97 1st4 s LYS 86 N 1.25 2.76 0.20 4.30 -0.14 -0.29 -0.63 119.74 127.19 1st4 s LYS 86 Ca -0.05 1.79 0.03 0.00 -1.36 0.00 0.00 55.97 56.39 1st4 s LYS 86 Cb -0.14 -1.91 -0.03 0.00 -1.68 0.00 0.00 37.83 34.07 1st4 s LYS 86 CO -0.02 -1.37 0.34 0.95 -0.76 0.00 0.00 175.35 174.49 1st4 s THR 87 N -1.72 5.28 0.66 2.17 -4.23 -1.25 -4.83 115.64 111.73 1st4 s THR 87 Ca 0.76 -0.80 -0.17 0.00 -1.18 0.00 0.00 61.69 60.30 1st4 s THR 87 Cb -0.30 -3.80 -0.00 0.00 1.34 0.00 0.00 72.50 69.74 1st4 s THR 87 CO 0.37 -0.23 1.23 -2.84 -0.54 0.00 0.00 174.62 172.61 1st4 s PRO 88 N -3.64 2.55 0.51 3.99 0.02 -1.26 -5.00 135.00 132.16 1st4 s PRO 88 Ca 0.35 1.86 -0.20 0.00 0.02 0.00 0.00 61.00 63.02 1st4 s PRO 88 Cb -0.10 -1.87 -0.07 0.00 0.02 0.00 0.00 34.50 32.48 1st4 s PRO 88 CO 0.29 -1.54 1.10 -0.06 -0.33 0.00 0.00 177.00 176.45 1st4 s PHE 89 N -1.70 2.84 -0.45 6.54 0.40 -1.26 -5.04 117.98 119.31 1st4 s PHE 89 Ca 0.78 1.56 -0.12 0.00 -0.60 0.00 0.00 56.93 58.55 1st4 s PHE 89 Cb -0.32 -3.21 0.09 0.00 0.51 0.00 0.00 43.02 40.09 1st4 s PHE 89 CO 0.39 -1.25 0.33 -0.65 0.70 0.00 0.00 175.22 174.75 1st4 s GLN 90 N -3.16 2.73 0.33 0.44 -0.21 -1.26 -5.02 119.66 113.51 1st4 s GLN 90 Ca 0.69 -1.49 0.10 0.00 0.02 0.00 0.00 55.36 54.69 1st4 s GLN 90 Cb -0.22 -3.94 0.88 0.00 1.00 0.00 0.00 33.01 30.73 1st4 s GLN 90 CO 0.25 -1.04 1.77 0.28 -2.12 0.00 0.00 175.29 174.44 1st4 h VAL 91 N 5.97 0.62 -0.53 1.09 2.07 -1.99 -0.25 116.25 123.25 1st4 h VAL 91 Ca -0.25 -0.21 -0.07 0.00 0.82 0.00 0.00 66.70 66.99 1st4 h VAL 91 Cb 1.09 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.79 1st4 h VAL 91 CO 0.83 0.11 0.03 -0.33 0.02 0.00 0.00 177.57 178.23 1st4 h GLU 92 N 0.62 0.87 -0.35 1.57 5.08 -1.99 0.41 114.58 120.78 1st4 h GLU 92 Ca 0.59 -0.23 -0.14 0.00 -1.00 0.00 0.00 59.36 58.58 1st4 h GLU 92 Cb 1.12 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 1st4 h GLU 92 CO -0.37 0.85 -0.35 1.96 -1.00 0.00 0.00 179.01 180.09 1st4 h GLN 93 N 0.81 0.82 0.76 2.33 1.08 -1.51 -1.71 115.11 117.69 1st4 h GLN 93 Ca 0.16 -0.41 -0.04 0.00 -1.45 0.00 0.00 58.65 56.92 1st4 h GLN 93 Cb 0.44 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.88 1st4 h GLN 93 CO 0.02 1.04 -0.37 0.28 -0.95 0.00 0.00 178.83 178.85 1st4 h VAL 94 N 0.68 0.22 -0.95 -0.54 2.07 -0.76 -0.96 116.25 116.00 1st4 h VAL 94 Ca 0.06 -0.07 0.18 0.00 0.82 0.00 0.00 66.70 67.69 1st4 h VAL 94 Cb 0.91 0.24 -0.11 0.00 -1.52 0.00 0.00 31.29 30.82 1st4 h VAL 94 CO 0.08 0.01 0.55 0.00 0.02 0.00 0.00 177.57 178.23 1st4 h ALA 95 N -0.87 1.55 -0.25 1.67 0.00 -0.22 0.68 119.26 121.82 1st4 h ALA 95 Ca -0.10 0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1st4 h ALA 95 Cb 0.79 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1st4 h ALA 95 CO 0.17 -0.09 -0.19 0.37 0.00 0.00 0.00 179.25 179.52 1st4 h GLN 96 N 0.70 0.45 -0.31 0.00 5.75 -1.11 -2.47 115.11 118.11 1st4 h GLN 96 Ca 0.55 -0.15 -0.08 0.00 -0.15 0.00 0.00 58.65 58.82 1st4 h GLN 96 Cb 0.85 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.35 1st4 h GLN 96 CO -0.39 0.62 -0.12 1.25 -2.65 0.00 0.00 178.83 177.55 1st4 h LEU 97 N 0.41 0.64 -0.04 -2.39 5.85 0.52 -3.18 115.31 117.11 1st4 h LEU 97 Ca 0.07 -0.39 0.00 0.00 0.84 0.00 0.00 57.88 58.40 1st4 h LEU 97 Cb 0.57 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.42 1st4 h LEU 97 CO 0.04 0.88 0.00 0.18 -0.34 0.00 0.00 178.44 179.20 1st4 n LEU 98 N -4.42 0.19 0.18 2.25 4.77 -0.70 -2.24 117.00 117.02 1st4 n LEU 98 Ca -0.03 0.52 0.05 0.00 -0.03 0.00 0.00 56.01 56.52 1st4 n LEU 98 Cb 0.36 -0.47 0.29 0.00 -2.33 0.00 0.00 43.42 41.26 1st4 n LEU 98 CO 0.41 -0.12 0.64 0.00 -1.33 0.00 0.00 177.39 177.00 1st4 h THR 99 N 0.00 0.92 0.00 -5.08 1.03 -1.42 -3.47 112.91 104.89 1st4 h THR 99 Ca 0.00 -1.65 0.00 0.00 -0.01 0.00 0.00 66.41 64.75 1st4 h THR 99 Cb 0.49 2.00 0.00 0.00 -1.07 0.00 0.00 68.15 69.57 1st4 h THR 99 CO 0.00 0.40 0.00 0.61 -0.01 0.00 0.00 175.52 176.52 1st4 n GLY 100 N 0.35 0.79 2.68 2.99 0.00 -0.95 -5.08 105.19 105.97 1st4 n GLY 100 Ca -0.00 -0.29 -0.29 0.00 0.00 0.00 0.00 46.02 45.43 1st4 n GLY 100 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1st4 s SER 101 N -1.00 3.55 0.53 1.61 0.01 -1.26 -5.12 113.70 112.03 1st4 s SER 101 Ca 0.00 -2.58 -0.17 0.00 1.31 0.00 0.00 55.95 54.51 1st4 s SER 101 Cb 0.00 -0.96 -0.07 0.00 0.21 0.00 0.00 66.02 65.20 1st4 s SER 101 CO 0.00 -0.27 1.01 -2.84 0.41 0.00 0.00 173.24 171.55 1st4 s PRO 102 N 0.43 3.79 -0.17 12.44 0.02 -1.26 -4.98 135.00 145.26 1st4 s PRO 102 Ca 0.18 1.05 -0.29 0.00 0.02 0.00 0.00 61.00 61.96 1st4 s PRO 102 Cb -0.24 -2.11 -0.03 0.00 0.02 0.00 0.00 34.50 32.15 1st4 s PRO 102 CO 0.00 -0.41 1.49 -2.00 -0.33 0.00 0.00 177.00 175.76 1st4 s GLU 103 N -3.97 4.03 0.03 5.54 2.12 -1.26 -5.01 118.70 120.17 1st4 s GLU 103 Ca 0.61 1.75 0.02 0.00 0.36 0.00 0.00 54.97 57.71 1st4 s GLU 103 Cb -0.12 -3.93 -0.02 0.00 0.26 0.00 0.00 34.13 30.32 1st4 s GLU 103 CO 0.31 -1.00 -0.07 -0.51 -0.54 0.00 0.00 175.26 173.45 1st4 s LEU 104 N 4.35 2.18 0.00 2.70 1.43 -1.26 -1.24 118.68 126.84 1st4 s LEU 104 Ca 0.66 -0.42 0.06 0.00 -1.03 0.00 0.00 54.13 53.40 1st4 s LEU 104 Cb -0.25 -0.20 -0.02 0.00 0.03 0.00 0.00 46.19 45.75 1st4 s LEU 104 CO 0.25 -0.12 -0.17 -1.10 0.23 0.00 0.00 176.35 175.43 1st4 s GLN 105 N -1.15 1.33 -0.23 1.70 -0.21 -0.19 -4.96 119.66 115.95 1st4 s GLN 105 Ca -0.06 -0.69 -0.24 0.00 0.02 0.00 0.00 55.36 54.38 1st4 s GLN 105 Cb -0.08 -1.32 -0.01 0.00 1.00 0.00 0.00 33.01 32.60 1st4 s GLN 105 CO 0.00 0.35 0.81 -1.17 -2.12 0.00 0.00 175.29 173.17 1st4 s LEU 106 N -0.63 4.10 -0.21 2.90 2.96 -1.26 -0.01 118.68 126.52 1st4 s LEU 106 Ca 0.06 1.04 0.05 0.00 -0.22 0.00 0.00 54.13 55.06 1st4 s LEU 106 Cb -0.07 -3.17 -0.20 0.00 0.50 0.00 0.00 46.19 43.24 1st4 s LEU 106 CO 0.00 -0.48 -0.03 1.67 -1.32 0.00 0.00 176.35 176.19 1st4 n GLN 107 N 5.83 0.67 -3.89 1.98 7.27 0.58 -4.96 117.38 124.87 1st4 n GLN 107 Ca 0.05 0.14 -0.11 0.00 0.07 0.00 0.00 57.00 57.14 1st4 n GLN 107 Cb 0.48 -1.56 -0.12 0.00 2.41 0.00 0.00 30.24 31.45 1st4 n GLN 107 CO 0.00 0.00 0.00 -0.06 0.07 0.00 0.00 177.06 177.07 1st4 s PHE 108 N -2.52 0.03 -0.05 3.69 2.99 -0.86 -4.96 117.98 116.30 1st4 s PHE 108 Ca -0.26 -0.06 -0.02 0.00 0.00 0.00 0.00 56.93 56.59 1st4 s PHE 108 Cb 0.08 -0.04 0.04 0.00 0.00 0.00 0.00 43.02 43.09 1st4 s PHE 108 CO 0.69 -0.13 0.10 0.45 -0.00 0.00 0.00 175.22 176.33 1st4 s SER 109 N -0.67 0.32 -0.30 1.36 0.15 -1.26 -1.56 113.70 111.74 1st4 s SER 109 Ca -0.07 0.20 -0.06 0.00 0.70 0.00 0.00 55.95 56.71 1st4 s SER 109 Cb -0.05 0.08 0.18 0.00 -1.71 0.00 0.00 66.02 64.52 1st4 s SER 109 CO 0.00 -0.18 0.76 0.21 1.20 0.00 0.00 173.24 175.24 1st4 s ASN 110 N 1.54 -1.04 0.94 5.45 3.84 -0.41 -4.99 114.94 120.28 1st4 s ASN 110 Ca -0.04 0.74 0.00 0.00 0.21 0.00 0.00 52.86 53.77 1st4 s ASN 110 Cb -0.12 1.91 0.00 0.00 -0.55 0.00 0.00 41.25 42.49 1st4 s ASN 110 CO -0.05 -0.19 0.00 -0.67 -2.79 0.00 0.00 177.10 173.40 1st4 n ASP 111 N 5.42 0.00 -0.06 -4.21 2.03 -1.26 -1.68 116.55 116.79 1st4 n ASP 111 Ca -0.04 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.25 1st4 n ASP 111 Cb 0.52 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.76 1st4 n ASP 111 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 1st4 n ILE 112 N 0.00 0.90 -2.66 5.18 -5.35 -1.26 -4.98 119.36 111.19 1st4 n ILE 112 Ca 0.00 -0.72 -0.33 0.00 -0.27 0.00 0.00 62.75 61.43 1st4 n ILE 112 Cb 0.00 -0.34 -0.05 0.00 -1.74 0.00 0.00 39.64 37.51 1st4 n ILE 112 CO 0.00 0.00 0.00 -0.31 -1.76 0.00 0.00 176.55 174.48 1st4 s TYR 113 N -2.88 3.38 -0.28 4.28 1.51 -0.68 -5.10 117.35 117.58 1st4 s TYR 113 Ca -0.09 1.52 -0.27 0.00 -1.01 0.00 0.00 57.07 57.22 1st4 s TYR 113 Cb 0.09 -2.80 0.19 0.00 -0.11 0.00 0.00 41.96 39.33 1st4 s TYR 113 CO 0.86 -0.21 1.37 -1.54 -1.11 0.00 0.00 175.55 174.91 1st4 s SER 114 N -2.58 -0.07 -0.08 2.29 1.04 -1.26 -1.29 113.70 111.75 1st4 s SER 114 Ca 0.60 0.10 0.02 0.00 0.48 0.00 0.00 55.95 57.15 1st4 s SER 114 Cb -0.09 0.09 0.01 0.00 0.10 0.00 0.00 66.02 66.13 1st4 s SER 114 CO 0.21 -0.05 -0.12 -0.89 0.98 0.00 0.00 173.24 173.37 1st4 s THR 115 N -0.58 1.18 0.39 2.02 2.01 -0.60 -4.96 115.64 115.10 1st4 s THR 115 Ca 0.08 -0.48 0.08 0.00 0.31 0.00 0.00 61.69 61.67 1st4 s THR 115 Cb -0.03 -1.10 -0.06 0.00 0.01 0.00 0.00 72.50 71.32 1st4 s THR 115 CO -0.10 0.37 0.06 -0.31 -0.69 0.00 0.00 174.62 173.94 1st4 s TYR 116 N 0.84 2.55 -0.20 4.92 1.51 -1.26 -0.31 117.35 125.40 1st4 s TYR 116 Ca -0.11 -0.58 -0.07 0.00 -1.01 0.00 0.00 57.07 55.31 1st4 s TYR 116 Cb -0.15 -1.74 -0.03 0.00 -0.11 0.00 0.00 41.96 39.92 1st4 s TYR 116 CO 0.02 0.38 0.04 -1.01 -1.11 0.00 0.00 175.55 173.87 1st4 s HIS 117 N -2.62 3.14 -0.06 2.71 3.76 0.98 -4.83 115.29 118.37 1st4 s HIS 117 Ca 0.37 -0.19 0.02 0.00 -0.15 0.00 0.00 55.06 55.11 1st4 s HIS 117 Cb 0.05 -2.11 -0.03 0.00 1.11 0.00 0.00 32.58 31.60 1st4 s HIS 117 CO 0.20 -0.08 -0.11 -1.17 -0.85 0.00 0.00 174.74 172.73 1st4 s LEU 118 N 0.83 2.92 -0.41 0.89 2.96 -1.26 -1.02 118.68 123.58 1st4 s LEU 118 Ca 0.02 -0.13 0.03 0.00 -0.22 0.00 0.00 54.13 53.84 1st4 s LEU 118 Cb -0.14 -1.62 0.12 0.00 0.50 0.00 0.00 46.19 45.05 1st4 s LEU 118 CO 0.02 0.34 0.16 -0.36 -1.32 0.00 0.00 176.35 175.19 1st4 s PHE 119 N -0.70 2.99 0.84 5.38 0.40 -0.37 -5.02 117.98 121.49 1st4 s PHE 119 Ca 0.11 -2.79 -0.12 0.00 -0.60 0.00 0.00 56.93 53.53 1st4 s PHE 119 Cb -0.11 -2.55 0.09 0.00 0.51 0.00 0.00 43.02 40.96 1st4 s PHE 119 CO 0.01 -0.84 1.12 -2.14 0.70 0.00 0.00 175.22 174.07 1st4 s PRO 120 N 0.51 1.75 0.74 0.24 0.02 -1.26 -4.37 135.00 132.62 1st4 s PRO 120 Ca 0.14 0.46 -0.13 0.00 0.02 0.00 0.00 61.00 61.49 1st4 s PRO 120 Cb -0.22 -1.89 0.04 0.00 0.02 0.00 0.00 34.50 32.45 1st4 s PRO 120 CO -0.06 -1.82 1.13 -1.25 -0.33 0.00 0.00 177.00 174.67 1st4 s PRO 121 N -5.24 2.29 0.12 5.54 0.04 -1.26 -4.87 135.00 131.63 1st4 s PRO 121 Ca 0.62 1.41 -0.04 0.00 0.04 0.00 0.00 61.00 63.03 1st4 s PRO 121 Cb -0.14 -1.88 0.20 0.00 0.04 0.00 0.00 34.50 32.71 1st4 s PRO 121 CO 0.53 -1.65 0.69 -2.13 0.04 0.00 0.00 177.00 174.49 1st4 n ARG 122 N -3.03 -0.04 0.29 4.56 0.63 -1.26 -1.79 116.66 116.02 1st4 n ARG 122 Ca 0.11 0.69 0.17 0.00 -0.92 0.00 0.00 57.85 57.90 1st4 n ARG 122 Cb 0.52 -1.03 0.88 0.00 0.45 0.00 0.00 32.46 33.28 1st4 n ARG 122 CO 0.00 0.00 0.00 0.37 -2.51 0.00 0.00 177.63 175.49 1st4 h GLN 123 N 0.00 0.00 -0.24 -0.14 -0.00 -2.04 -0.61 115.11 112.08 1st4 h GLN 123 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.86 1st4 h GLN 123 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.80 1st4 h GLN 123 CO -0.46 0.05 0.00 1.28 0.00 0.00 0.00 178.83 179.70 1st4 n LEU 124 N -3.33 2.83 -1.07 -2.39 4.32 -0.74 -4.47 117.00 112.15 1st4 n LEU 124 Ca -0.02 -1.14 0.11 0.00 -0.02 0.00 0.00 56.01 54.94 1st4 n LEU 124 Cb 0.20 -0.15 0.20 0.00 -1.62 0.00 0.00 43.42 42.05 1st4 n LEU 124 CO 0.26 0.57 0.68 0.59 -1.22 0.00 0.00 177.39 178.27 1st4 n ASN 125 N 1.11 3.33 -4.63 -1.43 3.02 -0.24 -5.00 115.26 111.42 1st4 n ASN 125 Ca 0.18 -1.95 -0.52 0.00 -0.03 0.00 0.00 54.58 52.25 1st4 n ASN 125 Cb 0.53 -0.24 -0.06 0.00 -0.61 0.00 0.00 39.78 39.40 1st4 n ASN 125 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1st4 n ASP 126 N 1.35 2.16 -4.35 6.41 -0.08 -1.26 -4.96 116.55 115.82 1st4 n ASP 126 Ca 0.18 1.09 -0.33 0.00 -1.51 0.00 0.00 54.79 54.22 1st4 n ASP 126 Cb 0.57 -1.23 -0.15 0.00 2.34 0.00 0.00 41.12 42.65 1st4 n ASP 126 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1st4 s VAL 127 N 1.45 2.94 -0.23 5.18 1.01 -1.26 -3.74 120.40 125.74 1st4 s VAL 127 Ca 0.87 -0.70 -0.27 0.00 0.00 0.00 0.00 61.98 61.88 1st4 s VAL 127 Cb -0.92 -2.22 0.00 0.00 0.00 0.00 0.00 36.38 33.24 1st4 s VAL 127 CO 0.50 0.53 0.95 -0.75 0.00 0.00 0.00 175.10 176.32 1st4 s LYS 128 N 0.36 4.23 -0.14 2.72 2.20 0.20 -4.88 119.74 124.42 1st4 s LYS 128 Ca -0.12 1.18 0.02 0.00 -0.36 0.00 0.00 55.97 56.69 1st4 s LYS 128 Cb -0.16 -3.64 0.01 0.00 -1.51 0.00 0.00 37.83 32.53 1st4 s LYS 128 CO 0.06 -0.58 -0.19 0.99 -0.36 0.00 0.00 175.35 175.27 1st4 s THR 129 N 3.03 1.86 -0.05 3.43 2.01 -1.26 -0.56 115.64 124.10 1st4 s THR 129 Ca 0.40 -0.84 0.06 0.00 0.31 0.00 0.00 61.69 61.62 1st4 s THR 129 Cb -0.15 -1.67 -0.01 0.00 0.01 0.00 0.00 72.50 70.67 1st4 s THR 129 CO 0.07 0.51 -0.25 -0.89 -0.69 0.00 0.00 174.62 173.37 1st4 s THR 130 N 1.04 2.03 -0.09 -0.82 2.01 0.16 -4.98 115.64 114.98 1st4 s THR 130 Ca -0.03 -1.06 0.04 0.00 0.31 0.00 0.00 61.69 60.95 1st4 s THR 130 Cb -0.15 -1.71 -0.00 0.00 0.01 0.00 0.00 72.50 70.65 1st4 s THR 130 CO -0.05 0.57 -0.24 -0.69 -0.69 0.00 0.00 174.62 173.52 1st4 s VAL 131 N -0.21 2.10 -0.26 3.82 1.01 -1.26 -0.10 120.40 125.50 1st4 s VAL 131 Ca -0.02 -1.01 -0.04 0.00 0.00 0.00 0.00 61.98 60.91 1st4 s VAL 131 Cb -0.13 -1.80 0.01 0.00 0.00 0.00 0.00 36.38 34.47 1st4 s VAL 131 CO 0.03 0.56 -0.01 -0.69 0.00 0.00 0.00 175.10 174.99 1st4 s VAL 132 N 0.26 3.35 -0.23 2.92 1.01 -0.07 -4.99 120.40 122.66 1st4 s VAL 132 Ca -0.16 -0.81 -0.12 0.00 0.00 0.00 0.00 61.98 60.89 1st4 s VAL 132 Cb -0.17 -2.68 0.07 0.00 0.00 0.00 0.00 36.38 33.60 1st4 s VAL 132 CO 0.08 0.20 0.55 -0.47 0.00 0.00 0.00 175.10 175.46 1st4 s TYR 133 N 1.41 -0.86 0.48 5.22 5.04 -1.26 -1.31 117.35 126.07 1st4 s TYR 133 Ca 0.02 1.74 -0.22 0.00 -2.44 0.00 0.00 57.07 56.17 1st4 s TYR 133 Cb -0.16 0.47 -0.07 0.00 0.35 0.00 0.00 41.96 42.54 1st4 s TYR 133 CO -0.02 -0.45 1.20 -2.14 -1.34 0.00 0.00 175.55 172.80 1st4 s PRO 134 N 1.67 3.60 -0.01 4.97 0.02 -1.26 -5.11 135.00 138.86 1st4 s PRO 134 Ca -0.09 1.85 -0.15 0.00 0.02 0.00 0.00 61.00 62.63 1st4 s PRO 134 Cb -0.07 -2.34 -0.06 0.00 0.02 0.00 0.00 34.50 32.05 1st4 s PRO 134 CO -0.16 -0.71 0.41 0.00 -0.33 0.00 0.00 177.00 176.21 1st4 s ALA 135 N -1.51 3.68 0.56 -1.55 0.00 0.01 -5.01 121.76 117.94 1st4 s ALA 135 Ca 0.66 -0.23 -0.04 0.00 0.00 0.00 0.00 51.96 52.35 1st4 s ALA 135 Cb -0.31 -2.40 0.01 0.00 0.00 0.00 0.00 23.12 20.43 1st4 s ALA 135 CO 0.37 0.44 0.85 0.95 0.00 0.00 0.00 175.76 178.37 1st4 s THR 136 N -0.94 3.62 0.41 0.00 -4.23 -1.26 -4.67 115.64 108.57 1st4 s THR 136 Ca 0.24 -0.16 0.19 0.00 -1.18 0.00 0.00 61.69 60.77 1st4 s THR 136 Cb -0.16 -3.41 0.39 0.00 1.34 0.00 0.00 72.50 70.65 1st4 s THR 136 CO 0.13 -0.39 1.80 -0.08 -0.54 0.00 0.00 174.62 175.54 1st4 h GLU 137 N -0.05 0.38 0.00 3.99 4.57 -1.99 -1.46 114.58 120.02 1st4 h GLU 137 Ca -0.45 -0.02 -0.11 0.00 -1.18 0.00 0.00 59.36 57.59 1st4 h GLU 137 Cb 1.26 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.75 1st4 h GLU 137 CO 0.59 0.25 -0.53 0.87 -1.18 0.00 0.00 179.01 179.01 1st4 h LYS 138 N 0.39 0.00 0.08 1.92 1.57 -1.98 -1.48 116.57 117.06 1st4 h LYS 138 Ca 0.55 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.33 1st4 h LYS 138 Cb 1.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.72 1st4 h LYS 138 CO -0.24 0.53 -0.04 0.45 -0.57 0.00 0.00 179.45 179.58 1st4 h HIS 139 N 0.00 -0.10 -0.86 -1.35 3.86 -1.66 -1.04 115.15 114.01 1st4 h HIS 139 Ca -0.01 -0.00 0.13 0.00 -1.16 0.00 0.00 60.37 59.33 1st4 h HIS 139 Cb 1.13 0.03 -0.09 0.00 1.06 0.00 0.00 27.41 29.54 1st4 h HIS 139 CO 0.00 0.03 0.47 -0.07 0.86 0.00 0.00 177.93 179.22 1st4 h LEU 140 N -0.20 0.61 0.23 2.43 3.38 -1.25 -1.36 115.31 119.14 1st4 h LEU 140 Ca -0.01 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1st4 h LEU 140 Cb 0.17 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1st4 h LEU 140 CO 0.02 0.29 -0.11 1.56 0.09 0.00 0.00 178.44 180.29 1st4 h GLN 141 N 0.70 -0.29 -0.44 1.13 1.08 -1.11 -3.08 115.11 113.10 1st4 h GLN 141 Ca 0.45 0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 57.64 1st4 h GLN 141 Cb 0.57 0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 28.04 1st4 h GLN 141 CO -0.32 -0.05 0.15 0.87 -0.95 0.00 0.00 178.83 178.53 1st4 h LYS 142 N -0.50 0.63 0.00 1.46 1.57 -0.73 -2.76 116.57 116.25 1st4 h LYS 142 Ca -0.03 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1st4 h LYS 142 Cb 0.37 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.57 1st4 h LYS 142 CO 0.05 0.54 -0.19 0.66 -0.57 0.00 0.00 179.45 179.94 1st4 n TYR 143 N -4.35 0.56 -2.10 -1.35 0.53 -0.56 -4.85 117.16 105.04 1st4 n TYR 143 Ca 0.03 0.16 -0.39 0.00 -1.02 0.00 0.00 57.90 56.68 1st4 n TYR 143 Cb 0.17 -0.72 -0.01 0.00 -1.03 0.00 0.00 39.34 37.75 1st4 n TYR 143 CO 0.00 0.00 0.00 -1.17 -1.02 0.00 0.00 176.86 174.67 1st4 s LEU 144 N -3.99 4.24 0.00 7.72 2.96 -1.04 -4.19 118.68 124.38 1st4 s LEU 144 Ca 0.10 2.60 0.00 0.00 -0.22 0.00 0.00 54.13 56.62 1st4 s LEU 144 Cb 0.14 -3.89 0.00 0.00 0.50 0.00 0.00 46.19 42.95 1st4 s LEU 144 CO 0.62 -0.78 0.00 0.54 -1.32 0.00 0.00 176.35 175.41 1st4 n ARG 145 N 0.21 0.00 -1.49 1.98 5.12 -0.91 -4.87 116.66 116.70 1st4 n ARG 145 Ca 0.03 0.00 -0.42 0.00 -1.93 0.00 0.00 57.85 55.53 1st4 n ARG 145 Cb 0.44 0.00 -0.11 0.00 -1.16 0.00 0.00 32.46 31.63 1st4 n ARG 145 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1st4 n GLN 146 N -0.04 0.38 -3.80 5.56 1.13 -1.26 -4.93 117.38 114.42 1st4 n GLN 146 Ca 0.00 0.03 -0.35 0.00 -1.94 0.00 0.00 57.00 54.74 1st4 n GLN 146 Cb 0.00 -2.10 -0.11 0.00 0.11 0.00 0.00 30.24 28.13 1st4 n GLN 146 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1st4 s ASP 147 N 9.45 5.09 0.15 1.08 2.15 -1.26 -5.10 116.67 128.22 1st4 s ASP 147 Ca 1.22 -2.52 0.02 0.00 0.43 0.00 0.00 52.55 51.71 1st4 s ASP 147 Cb -0.96 -1.80 -0.04 0.00 -0.30 0.00 0.00 42.92 39.83 1st4 s ASP 147 CO 0.44 -0.42 0.29 -0.76 -0.17 0.00 0.00 175.17 174.56 1st4 s LEU 148 N 0.43 4.33 -0.01 -1.34 1.43 -1.26 -0.83 118.68 121.43 1st4 s LEU 148 Ca 0.13 0.20 0.01 0.00 -1.03 0.00 0.00 54.13 53.45 1st4 s LEU 148 Cb -0.22 -2.94 0.00 0.00 0.03 0.00 0.00 46.19 43.07 1st4 s LEU 148 CO -0.04 0.05 -0.05 -0.13 0.23 0.00 0.00 176.35 176.42 1st4 s ARG 149 N -3.18 0.47 0.41 1.70 1.81 -0.06 -4.82 118.95 115.26 1st4 s ARG 149 Ca 0.35 -0.15 -0.23 0.00 -1.72 0.00 0.00 55.73 53.98 1st4 s ARG 149 Cb -0.11 -0.48 -0.10 0.00 -0.45 0.00 0.00 34.95 33.81 1st4 s ARG 149 CO 0.28 0.07 0.98 -1.17 -0.68 0.00 0.00 175.30 174.78 1st4 s LEU 150 N 0.11 4.06 -0.05 2.53 2.96 -1.26 -0.83 118.68 126.20 1st4 s LEU 150 Ca -0.01 1.83 -0.06 0.00 -0.22 0.00 0.00 54.13 55.67 1st4 s LEU 150 Cb -0.05 -4.34 0.01 0.00 0.50 0.00 0.00 46.19 42.31 1st4 s LEU 150 CO -0.00 -0.37 0.17 -0.51 -1.32 0.00 0.00 176.35 174.31 1st4 s ILE 151 N -1.91 0.01 -0.29 6.68 1.10 0.16 -4.94 121.20 122.02 1st4 s ILE 151 Ca 0.59 -0.12 -0.08 0.00 -0.51 0.00 0.00 60.65 60.53 1st4 s ILE 151 Cb -0.15 -0.28 -0.00 0.00 0.15 0.00 0.00 42.46 42.17 1st4 s ILE 151 CO 0.19 -0.07 0.10 -0.13 -2.11 0.00 0.00 174.94 172.93 1st4 s ARG 152 N -0.17 3.28 -0.28 3.50 0.52 -1.26 -2.04 118.95 122.50 1st4 s ARG 152 Ca -0.03 -0.74 -0.07 0.00 -0.52 0.00 0.00 55.73 54.37 1st4 s ARG 152 Cb -0.02 -3.43 -0.00 0.00 0.52 0.00 0.00 34.95 32.01 1st4 s ARG 152 CO 0.00 -0.39 0.08 -2.00 0.02 0.00 0.00 175.30 173.02 1st4 s GLU 153 N 1.56 3.29 0.67 3.54 2.12 0.63 -4.89 118.70 125.62 1st4 s GLU 153 Ca 0.04 -0.72 -0.12 0.00 0.36 0.00 0.00 54.97 54.52 1st4 s GLU 153 Cb -0.17 -3.37 -0.00 0.00 0.26 0.00 0.00 34.13 30.85 1st4 s GLU 153 CO 0.04 -0.36 1.06 0.95 -0.54 0.00 0.00 175.26 176.41 1st4 s THR 154 N 1.55 3.93 0.41 -1.70 -4.23 -1.26 -1.24 115.64 113.09 1st4 s THR 154 Ca 0.04 0.71 0.19 0.00 -1.18 0.00 0.00 61.69 61.45 1st4 s THR 154 Cb -0.16 -3.37 0.40 0.00 1.34 0.00 0.00 72.50 70.70 1st4 s THR 154 CO 0.03 -0.73 1.78 1.23 -0.54 0.00 0.00 174.62 176.39 1st4 h GLY 155 N -0.37 1.12 0.21 3.99 0.00 -1.66 -1.84 103.07 104.53 1st4 h GLY 155 Ca -0.45 -0.19 -0.00 0.00 0.00 0.00 0.00 47.33 46.69 1st4 h GLY 155 CO 0.57 -0.11 -0.02 -0.55 0.00 0.00 0.00 176.54 176.43 1st4 h ASP 156 N 0.38 -0.04 -1.29 0.19 3.32 -1.89 -0.77 116.42 116.33 1st4 h ASP 156 Ca 0.58 -0.66 0.37 0.00 0.02 0.00 0.00 57.03 57.35 1st4 h ASP 156 Cb 1.50 0.01 -0.05 0.00 0.22 0.00 0.00 39.33 41.01 1st4 h ASP 156 CO -0.27 0.69 0.95 0.44 -1.72 0.00 0.00 179.24 179.33 1st4 h ASP 157 N -0.83 0.00 0.00 6.45 3.32 -1.86 0.18 116.42 123.68 1st4 h ASP 157 Ca -0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 1st4 h ASP 157 Cb 0.69 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.24 1st4 h ASP 157 CO 0.01 0.00 -0.00 0.22 -1.72 0.00 0.00 179.24 177.75 1st4 h TYR 158 N 0.00 -0.00 -0.81 4.55 3.20 -0.68 -1.13 116.97 122.11 1st4 h TYR 158 Ca 0.61 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.52 1st4 h TYR 158 Cb 2.51 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 40.73 1st4 h TYR 158 CO 0.00 0.94 0.53 0.00 -1.64 0.00 0.00 178.16 177.99 1st4 h ARG 159 N -0.99 0.94 0.00 1.82 3.08 -0.51 0.32 114.38 119.04 1st4 h ARG 159 Ca -0.00 -0.06 -0.27 0.00 0.07 0.00 0.00 59.98 59.72 1st4 h ARG 159 Cb 0.94 -0.21 -0.05 0.00 0.08 0.00 0.00 29.97 30.73 1st4 h ARG 159 CO 0.00 0.62 -1.82 0.09 -1.07 0.00 0.00 179.97 177.79 1st4 n ASN 160 N -4.46 0.63 0.05 7.04 3.02 0.58 -4.34 115.26 117.78 1st4 n ASN 160 Ca 0.11 0.29 0.00 0.00 -0.03 0.00 0.00 54.58 54.95 1st4 n ASN 160 Cb 0.13 0.32 0.00 0.00 -0.61 0.00 0.00 39.78 39.62 1st4 n ASN 160 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1st4 n ILE 161 N -2.91 0.77 0.29 2.41 2.08 -0.50 -4.74 119.36 116.76 1st4 n ILE 161 Ca -0.19 0.26 -0.13 0.00 0.56 0.00 0.00 62.75 63.25 1st4 n ILE 161 Cb 1.01 -1.40 -0.06 0.00 -0.75 0.00 0.00 39.64 38.44 1st4 n ILE 161 CO 0.00 0.00 0.00 0.74 0.56 0.00 0.00 176.55 177.85 1st4 h THR 162 N 0.00 0.09 -0.46 1.39 2.02 -1.35 -2.88 112.91 111.72 1st4 h THR 162 Ca 0.00 -0.42 0.05 0.00 0.77 0.00 0.00 66.41 66.82 1st4 h THR 162 Cb 0.22 0.14 -0.09 0.00 -1.74 0.00 0.00 68.15 66.68 1st4 h THR 162 CO 0.00 0.02 -0.56 0.25 0.37 0.00 0.00 175.52 175.60 1st4 h LEU 163 N -1.17 -1.89 -1.58 2.58 6.46 -1.15 -1.03 115.31 117.53 1st4 h LEU 163 Ca -0.08 0.25 0.00 0.00 -0.12 0.00 0.00 57.88 57.93 1st4 h LEU 163 Cb 0.63 0.78 0.00 0.00 -0.73 0.00 0.00 40.66 41.34 1st4 h LEU 163 CO 0.13 -0.39 0.00 1.55 -0.62 0.00 0.00 178.44 179.11 1st4 h PRO 164 N -0.37 0.00 -0.65 5.25 0.13 -1.76 0.66 132.00 135.27 1st4 h PRO 164 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1st4 h PRO 164 Cb 0.58 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.71 1st4 h PRO 164 CO -0.63 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 177.86 1st4 n HIS 165 N -2.82 1.26 -0.12 1.56 8.25 -0.44 -4.70 115.22 118.20 1st4 n HIS 165 Ca 0.00 -0.47 -0.05 0.00 -0.26 0.00 0.00 57.72 56.94 1st4 n HIS 165 Cb 0.22 -0.28 0.03 0.00 1.12 0.00 0.00 29.99 31.08 1st4 n HIS 165 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1st4 h LEU 166 N 2.90 0.12 -1.00 2.41 5.85 -0.27 -2.88 115.31 122.44 1st4 h LEU 166 Ca 0.00 0.05 0.20 0.00 0.84 0.00 0.00 57.88 58.97 1st4 h LEU 166 Cb 1.31 0.04 -0.19 0.00 0.37 0.00 0.00 40.66 42.19 1st4 h LEU 166 CO 0.25 0.11 -0.24 -0.62 -0.34 0.00 0.00 178.44 177.60 1st4 n GLU 167 N -5.03 -0.09 0.25 1.25 -0.58 -1.26 -1.57 120.64 113.61 1st4 n GLU 167 Ca 0.02 1.55 0.10 0.00 -0.42 0.00 0.00 57.16 58.41 1st4 n GLU 167 Cb 0.15 -2.33 0.66 0.00 -0.57 0.00 0.00 31.44 29.36 1st4 n GLU 167 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1st4 h SER 168 N 0.00 0.00 1.17 1.62 4.64 -1.89 -1.53 113.55 117.56 1st4 h SER 168 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 1st4 h SER 168 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 1st4 h SER 168 CO -1.02 0.11 -0.17 0.00 -0.87 0.00 0.00 176.83 174.88 1st4 n GLN 169 N -4.05 0.19 -4.50 4.77 1.13 -0.61 -5.00 117.38 109.31 1st4 n GLN 169 Ca -0.02 0.12 -0.32 0.00 -1.94 0.00 0.00 57.00 54.83 1st4 n GLN 169 Cb 0.20 -1.69 -0.11 0.00 0.11 0.00 0.00 30.24 28.75 1st4 n GLN 169 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1st4 s SER 170 N -4.00 4.62 0.10 1.08 1.04 -0.58 -4.91 113.70 111.05 1st4 s SER 170 Ca 0.11 -0.12 0.06 0.00 0.48 0.00 0.00 55.95 56.48 1st4 s SER 170 Cb 0.14 -1.09 -0.04 0.00 0.10 0.00 0.00 66.02 65.13 1st4 s SER 170 CO 0.61 0.30 -0.06 -0.76 0.98 0.00 0.00 173.24 174.31 1st4 s LEU 171 N -1.29 3.19 -0.08 2.42 1.43 -1.20 -4.97 118.68 118.18 1st4 s LEU 171 Ca 0.16 -0.32 -0.37 0.00 -1.03 0.00 0.00 54.13 52.57 1st4 s LEU 171 Cb -0.11 -1.96 -0.18 0.00 0.03 0.00 0.00 46.19 43.97 1st4 s LEU 171 CO 0.06 0.17 1.05 -0.24 0.23 0.00 0.00 176.35 177.62 1st4 n SER 172 N 0.61 0.18 -1.86 2.29 2.88 -1.26 -4.63 113.62 111.83 1st4 n SER 172 Ca -0.12 1.05 -0.03 0.00 -1.33 0.00 0.00 58.87 58.44 1st4 n SER 172 Cb 0.52 -0.83 0.29 0.00 -0.75 0.00 0.00 64.21 63.45 1st4 n SER 172 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 175.04 176.11 1st4 n ILE 173 N 1.74 2.62 -0.11 2.46 -5.35 -1.26 -4.59 119.36 114.88 1st4 n ILE 173 Ca 0.20 -1.40 0.11 0.00 -0.27 0.00 0.00 62.75 61.39 1st4 n ILE 173 Cb 0.05 -0.38 0.47 0.00 -1.74 0.00 0.00 39.64 38.04 1st4 n ILE 173 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 1st4 h GLN 174 N 2.63 0.46 -0.30 6.28 5.75 -2.00 -1.39 115.11 126.54 1st4 h GLN 174 Ca 0.19 -0.03 -0.04 0.00 -0.15 0.00 0.00 58.65 58.62 1st4 h GLN 174 Cb 2.11 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 30.54 1st4 h GLN 174 CO 0.62 0.31 0.00 0.11 -2.65 0.00 0.00 178.83 177.23 1st4 h TRP 175 N 0.48 0.46 0.05 3.99 5.08 -2.00 -0.03 115.95 123.98 1st4 h TRP 175 Ca 0.29 -0.04 -0.00 0.00 1.08 0.00 0.00 58.89 60.22 1st4 h TRP 175 Cb 0.51 -0.14 0.00 0.00 -3.00 0.00 0.00 29.16 26.53 1st4 h TRP 175 CO -0.00 0.46 -0.02 0.28 -1.28 0.00 0.00 178.44 177.88 1st4 h VAL 176 N 0.44 1.13 -0.99 0.12 2.07 -1.61 -2.55 116.25 114.86 1st4 h VAL 176 Ca 0.10 -0.57 0.14 0.00 0.82 0.00 0.00 66.70 67.19 1st4 h VAL 176 Cb 0.28 1.50 -0.09 0.00 -1.52 0.00 0.00 31.29 31.47 1st4 h VAL 176 CO 0.01 0.14 0.62 1.88 0.02 0.00 0.00 177.57 180.24 1st4 h TYR 177 N -0.31 1.08 -0.31 1.57 0.99 -1.21 -0.92 116.97 117.85 1st4 h TYR 177 Ca -0.01 0.03 -0.04 0.00 2.00 0.00 0.00 58.73 60.72 1st4 h TYR 177 Cb 0.28 -0.34 -0.02 0.00 1.00 0.00 0.00 36.73 37.66 1st4 h TYR 177 CO 0.01 0.37 0.04 -0.91 -0.00 0.00 0.00 178.16 177.67 1st4 h ASN 178 N 0.89 0.42 0.00 3.88 2.35 -0.72 0.31 115.58 122.72 1st4 h ASN 178 Ca 0.51 -0.06 -0.12 0.00 -0.55 0.00 0.00 56.30 56.08 1st4 h ASN 178 Cb 0.64 -0.11 0.01 0.00 0.05 0.00 0.00 38.32 38.91 1st4 h ASN 178 CO -0.29 0.46 -0.46 0.40 -1.65 0.00 0.00 177.43 175.89 1st4 h ILE 179 N 0.45 1.48 -0.24 2.81 2.04 -0.81 0.36 117.51 123.59 1st4 h ILE 179 Ca 0.10 -2.03 -0.04 0.00 1.00 0.00 0.00 64.86 63.89 1st4 h ILE 179 Cb 0.24 2.68 -0.01 0.00 -0.74 0.00 0.00 36.82 38.98 1st4 h ILE 179 CO 0.00 0.58 -0.04 -0.07 0.00 0.00 0.00 178.15 178.62 1st4 h LEU 180 N -0.27 0.35 -0.75 1.44 3.38 -0.93 -2.23 115.31 116.30 1st4 h LEU 180 Ca -0.06 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1st4 h LEU 180 Cb 1.20 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1st4 h LEU 180 CO 0.09 0.44 -0.06 0.47 0.09 0.00 0.00 178.44 179.47 1st4 n ASP 181 N -4.30 1.22 -1.47 -0.43 8.00 0.07 -4.93 116.55 114.71 1st4 n ASP 181 Ca 0.00 -1.27 -0.13 0.00 0.71 0.00 0.00 54.79 54.10 1st4 n ASP 181 Cb 0.23 0.03 -0.01 0.00 -0.02 0.00 0.00 41.12 41.35 1st4 n ASP 181 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1st4 n LYS 182 N -0.16 -1.05 -0.00 -1.24 4.76 -0.84 -4.92 118.16 114.71 1st4 n LYS 182 Ca 0.18 0.67 0.11 0.00 -2.87 0.00 0.00 58.31 56.39 1st4 n LYS 182 Cb 0.33 -4.89 -0.14 0.00 -1.84 0.00 0.00 35.03 28.50 1st4 n LYS 182 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1st4 n LYS 183 N -2.30 0.37 -3.90 1.97 5.02 0.12 -4.76 118.16 114.67 1st4 n LYS 183 Ca -0.16 -0.10 -0.11 0.00 -2.02 0.00 0.00 58.31 55.93 1st4 n LYS 183 Cb 0.61 -1.52 -0.10 0.00 -0.02 0.00 0.00 35.03 33.99 1st4 n LYS 183 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1st4 s ALA 184 N -3.29 -0.18 0.00 7.82 0.00 -0.82 -4.90 121.76 120.40 1st4 s ALA 184 Ca -0.01 -0.24 0.00 0.00 0.00 0.00 0.00 51.96 51.71 1st4 s ALA 184 Cb 0.15 0.10 0.00 0.00 0.00 0.00 0.00 23.12 23.37 1st4 s ALA 184 CO 0.89 -0.18 0.00 0.39 0.00 0.00 0.00 175.76 176.86 1st4 n GLU 185 N 1.64 -0.96 -0.36 0.00 1.02 -1.26 -4.19 120.64 116.52 1st4 n GLU 185 Ca -0.22 0.24 0.04 0.00 -0.02 0.00 0.00 57.16 57.20 1st4 n GLU 185 Cb 0.56 -3.96 0.20 0.00 -0.02 0.00 0.00 31.44 28.21 1st4 n GLU 185 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1st4 h ALA 186 N 0.00 1.42 0.00 0.62 0.00 -1.90 0.32 119.26 119.72 1st4 h ALA 186 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1st4 h ALA 186 Cb 0.48 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1st4 h ALA 186 CO 0.00 0.34 0.00 -0.40 0.00 0.00 0.00 179.25 179.19 1st4 n ASP 187 N -4.56 0.00 -0.00 0.00 5.75 -1.26 -2.68 116.55 113.79 1st4 n ASP 187 Ca 0.17 -1.36 0.09 0.00 -0.01 0.00 0.00 54.79 53.68 1st4 n ASP 187 Cb 0.25 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 40.23 1st4 n ASP 187 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1st4 n ARG 188 N -0.77 0.74 -1.67 0.11 1.74 0.11 -4.97 116.66 111.95 1st4 n ARG 188 Ca 0.12 -0.02 -0.52 0.00 -0.77 0.00 0.00 57.85 56.66 1st4 n ARG 188 Cb 0.05 -1.40 -0.06 0.00 -1.02 0.00 0.00 32.46 30.04 1st4 n ARG 188 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1st4 n ILE 189 N -1.51 0.29 0.03 0.55 5.41 -1.09 -4.36 119.36 118.68 1st4 n ILE 189 Ca 0.03 -0.05 -0.15 0.00 1.00 0.00 0.00 62.75 63.58 1st4 n ILE 189 Cb 0.31 -1.38 -0.14 0.00 -0.71 0.00 0.00 39.64 37.73 1st4 n ILE 189 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1st4 h VAL 190 N 4.70 1.02 -2.43 1.39 2.07 -0.90 -3.49 116.25 118.62 1st4 h VAL 190 Ca -0.47 -2.73 -0.08 0.00 0.82 0.00 0.00 66.70 64.23 1st4 h VAL 190 Cb 1.30 2.64 -0.20 0.00 -1.52 0.00 0.00 31.29 33.51 1st4 h VAL 190 CO 0.91 0.76 -0.01 0.12 0.02 0.00 0.00 177.57 179.37 1st4 s PHE 191 N -2.61 -0.48 -0.04 1.57 5.36 -1.13 -5.00 117.98 115.64 1st4 s PHE 191 Ca -0.10 0.88 0.01 0.00 -0.96 0.00 0.00 56.93 56.76 1st4 s PHE 191 Cb 0.07 0.27 0.02 0.00 -0.34 0.00 0.00 43.02 43.04 1st4 s PHE 191 CO 0.83 -0.48 -0.03 -2.00 -1.46 0.00 0.00 175.22 172.07 1st4 s GLU 192 N -1.01 0.68 -0.47 10.12 2.12 -1.26 -0.80 118.70 128.08 1st4 s GLU 192 Ca -0.10 -0.06 -0.16 0.00 0.36 0.00 0.00 54.97 55.01 1st4 s GLU 192 Cb -0.02 -0.74 0.06 0.00 0.26 0.00 0.00 34.13 33.69 1st4 s GLU 192 CO 0.07 -0.10 0.43 1.21 -0.54 0.00 0.00 175.26 176.33 1st4 s ASN 193 N 0.95 6.16 0.00 -1.70 3.84 -0.42 -4.97 114.94 118.80 1st4 s ASN 193 Ca -0.11 -1.17 0.30 0.00 0.21 0.00 0.00 52.86 52.08 1st4 s ASN 193 Cb -0.14 -2.20 1.38 0.00 -0.55 0.00 0.00 41.25 39.74 1st4 s ASN 193 CO -0.00 -0.67 1.95 -0.81 -2.79 0.00 0.00 177.10 174.78 1st4 n PRO 194 N 5.39 0.74 -1.65 0.43 -0.04 -1.26 0.29 135.00 138.91 1st4 n PRO 194 Ca -0.11 -0.19 -0.55 0.00 -0.04 0.00 0.00 63.50 62.61 1st4 n PRO 194 Cb 0.44 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.34 1st4 n PRO 194 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1st4 n ASP 195 N -0.96 1.96 0.26 3.54 -0.08 -1.26 -4.83 116.55 115.18 1st4 n ASP 195 Ca 0.16 1.10 0.09 0.00 -1.51 0.00 0.00 54.79 54.63 1st4 n ASP 195 Cb 0.25 -1.16 0.68 0.00 2.34 0.00 0.00 41.12 43.22 1st4 n ASP 195 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1st4 h PRO 196 N 5.78 0.00 0.00 -0.67 0.11 -1.93 -0.03 132.00 135.26 1st4 h PRO 196 Ca -0.47 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 65.29 1st4 h PRO 196 Cb 1.33 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.38 1st4 h PRO 196 CO 0.86 0.01 -2.32 0.45 -0.21 0.00 0.00 178.00 176.79 1st4 n SER 197 N -4.41 1.95 -0.22 -2.05 2.88 -1.26 -3.01 113.62 107.50 1st4 n SER 197 Ca -0.03 -0.11 0.02 0.00 -1.33 0.00 0.00 58.87 57.42 1st4 n SER 197 Cb 0.10 -0.19 0.05 0.00 -0.75 0.00 0.00 64.21 63.42 1st4 n SER 197 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1st4 n ASP 198 N -3.12 2.31 -5.02 -3.46 8.00 -1.19 -4.63 116.55 109.44 1st4 n ASP 198 Ca -0.40 -1.98 -0.21 0.00 0.71 0.00 0.00 54.79 52.91 1st4 n ASP 198 Cb 0.96 -0.08 0.06 0.00 -0.02 0.00 0.00 41.12 42.04 1st4 n ASP 198 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1st4 s GLY 199 N -0.99 1.81 -0.18 0.44 0.00 -0.03 -4.43 107.32 103.94 1st4 s GLY 199 Ca 0.08 -2.05 -0.35 0.00 0.00 0.00 0.00 44.72 42.40 1st4 s GLY 199 CO 0.06 -1.76 1.21 -0.11 0.00 0.00 0.00 173.10 172.50 1st4 s PHE 200 N -2.73 -0.13 -0.06 1.90 -0.12 0.15 -0.88 117.98 116.11 1st4 s PHE 200 Ca 0.58 0.07 0.04 0.00 -0.05 0.00 0.00 56.93 57.57 1st4 s PHE 200 Cb -0.05 0.52 -0.02 0.00 -0.63 0.00 0.00 43.02 42.84 1st4 s PHE 200 CO 0.37 -0.21 -0.19 0.08 -0.05 0.00 0.00 175.22 175.22 1st4 s VAL 201 N -2.42 2.60 -0.19 -2.49 1.01 -0.31 -1.30 120.40 117.30 1st4 s VAL 201 Ca 0.10 -0.87 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 1st4 s VAL 201 Cb -0.01 -2.00 -0.00 0.00 0.00 0.00 0.00 36.38 34.37 1st4 s VAL 201 CO -0.05 0.57 -0.09 -0.22 0.00 0.00 0.00 175.10 175.31 1st4 s LEU 202 N -0.32 2.72 0.05 3.92 2.96 0.02 -0.28 118.68 127.74 1st4 s LEU 202 Ca 0.02 -0.42 -0.03 0.00 -0.22 0.00 0.00 54.13 53.48 1st4 s LEU 202 Cb -0.13 -1.66 -0.03 0.00 0.50 0.00 0.00 46.19 44.88 1st4 s LEU 202 CO 0.02 0.03 0.03 0.27 -1.32 0.00 0.00 176.35 175.38 1st4 s ILE 203 N 1.17 0.18 0.26 6.68 -0.00 0.87 -0.14 121.20 130.22 1st4 s ILE 203 Ca 0.02 -1.45 -0.31 0.00 -0.00 0.00 0.00 60.65 58.91 1st4 s ILE 203 Cb -0.14 -1.21 -0.13 0.00 -0.00 0.00 0.00 42.46 40.98 1st4 s ILE 203 CO -0.03 -0.80 1.50 -2.65 -0.00 0.00 0.00 174.94 172.96 1st4 n PRO 204 N 0.41 2.35 -1.79 0.37 -0.02 -1.26 -0.26 135.00 134.79 1st4 n PRO 204 Ca -0.16 0.84 -0.39 0.00 -2.02 0.00 0.00 63.50 61.76 1st4 n PRO 204 Cb 0.60 -2.56 0.03 0.00 -0.02 0.00 0.00 33.50 31.55 1st4 n PRO 204 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1st4 s ASP 205 N 0.43 5.55 0.40 2.55 -1.08 -0.53 -4.64 116.67 119.35 1st4 s ASP 205 Ca 0.67 2.84 0.21 0.00 -0.52 0.00 0.00 52.55 55.75 1st4 s ASP 205 Cb -0.58 -2.64 1.19 0.00 -1.46 0.00 0.00 42.92 39.43 1st4 s ASP 205 CO 0.48 -1.39 1.72 0.25 0.52 0.00 0.00 175.17 176.75 1st4 h LEU 206 N 1.86 0.40 0.00 -1.34 6.46 -1.92 -2.17 115.31 118.61 1st4 h LEU 206 Ca -0.51 0.11 0.00 0.00 -0.12 0.00 0.00 57.88 57.36 1st4 h LEU 206 Cb 1.28 0.06 0.00 0.00 -0.73 0.00 0.00 40.66 41.27 1st4 h LEU 206 CO 0.59 -0.02 0.00 0.29 -0.62 0.00 0.00 178.44 178.68 1st4 n LYS 207 N -4.70 0.43 -4.06 1.25 5.02 -1.26 -4.77 118.16 110.07 1st4 n LYS 207 Ca 0.29 0.05 -0.35 0.00 -2.02 0.00 0.00 58.31 56.29 1st4 n LYS 207 Cb 1.04 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 34.44 1st4 n LYS 207 CO 0.00 0.00 0.00 -0.46 -0.52 0.00 0.00 177.40 176.42 1st4 s TRP 208 N -2.44 3.09 -2.44 2.13 -0.00 -0.82 -4.96 118.94 113.50 1st4 s TRP 208 Ca 0.26 -0.32 0.27 0.00 -0.00 0.00 0.00 56.10 56.31 1st4 s TRP 208 Cb 0.16 -2.09 0.83 0.00 -0.00 0.00 0.00 33.47 32.37 1st4 s TRP 208 CO 0.34 -0.15 1.62 0.27 -0.00 0.00 0.00 176.95 179.03 1st4 n ASN 209 N 4.10 1.67 -0.13 5.86 0.23 -1.26 -4.86 115.26 120.87 1st4 n ASN 209 Ca -0.17 -1.48 -0.02 0.00 -0.53 0.00 0.00 54.58 52.39 1st4 n ASN 209 Cb 0.52 0.04 -0.01 0.00 -2.08 0.00 0.00 39.78 38.25 1st4 n ASN 209 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1st4 n GLN 210 N 0.21 -0.44 0.06 -3.83 6.02 -1.26 -4.87 117.38 113.28 1st4 n GLN 210 Ca 0.17 0.31 0.07 0.00 -0.01 0.00 0.00 57.00 57.54 1st4 n GLN 210 Cb 0.40 -3.79 -0.05 0.00 1.02 0.00 0.00 30.24 27.82 1st4 n GLN 210 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1st4 n GLN 211 N -2.31 0.62 -3.94 -1.09 1.13 -1.26 -4.93 117.38 105.60 1st4 n GLN 211 Ca -0.02 0.11 -0.09 0.00 -1.94 0.00 0.00 57.00 55.06 1st4 n GLN 211 Cb 0.14 -1.77 -0.07 0.00 0.11 0.00 0.00 30.24 28.64 1st4 n GLN 211 CO 0.00 0.00 0.00 1.14 -1.44 0.00 0.00 177.06 176.76 1st4 s GLN 212 N -3.22 1.07 0.02 -1.09 0.00 -1.26 -5.06 119.66 110.12 1st4 s GLN 212 Ca -0.02 -1.13 0.26 0.00 -0.00 0.00 0.00 55.36 54.46 1st4 s GLN 212 Cb 0.10 0.36 0.68 0.00 0.00 0.00 0.00 33.01 34.15 1st4 s GLN 212 CO 0.81 -0.38 1.54 1.28 0.00 0.00 0.00 175.29 178.55 1st4 n LEU 213 N -0.17 0.41 0.23 2.60 4.77 -1.26 -4.00 117.00 119.57 1st4 n LEU 213 Ca -0.09 0.17 0.08 0.00 -0.03 0.00 0.00 56.01 56.14 1st4 n LEU 213 Cb 0.63 -0.31 0.54 0.00 -2.33 0.00 0.00 43.42 41.95 1st4 n LEU 213 CO 0.24 0.06 0.86 0.44 -1.33 0.00 0.00 177.39 177.66 1st4 h ASP 214 N 0.00 0.00 -0.03 -1.43 3.32 -1.97 -2.18 116.42 114.14 1st4 h ASP 214 Ca 0.00 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 1st4 h ASP 214 Cb 0.54 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 1st4 h ASP 214 CO 0.00 0.23 -0.48 -0.90 -1.72 0.00 0.00 179.24 176.37 1st4 n ASP 215 N -3.89 1.78 -4.46 6.45 3.85 -1.26 -4.04 116.55 114.98 1st4 n ASP 215 Ca -0.02 -3.90 -0.61 0.00 -0.71 0.00 0.00 54.79 49.55 1st4 n ASP 215 Cb 0.32 -0.54 -0.09 0.00 -1.35 0.00 0.00 41.12 39.46 1st4 n ASP 215 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.20 176.08 1st4 n LEU 216 N -1.12 0.64 -3.60 -2.12 0.00 -0.82 -4.80 117.00 105.18 1st4 n LEU 216 Ca 0.20 1.13 -0.16 0.00 0.00 0.00 0.00 56.01 57.18 1st4 n LEU 216 Cb 0.71 -0.86 -0.14 0.00 0.00 0.00 0.00 43.42 43.13 1st4 n LEU 216 CO -0.02 -1.27 -0.19 -0.47 0.00 0.00 0.00 177.39 175.44 1st4 s TYR 217 N 1.59 -0.31 0.24 1.96 6.04 -1.26 -1.34 117.35 124.27 1st4 s TYR 217 Ca 0.95 0.60 0.10 0.00 0.04 0.00 0.00 57.07 58.76 1st4 s TYR 217 Cb -1.34 -0.21 -0.05 0.00 -1.04 0.00 0.00 41.96 39.31 1st4 s TYR 217 CO 0.68 -0.43 -0.18 -0.51 -1.54 0.00 0.00 175.55 173.57 1st4 s LEU 218 N 2.35 2.56 -0.00 6.97 1.02 0.27 -1.45 118.68 130.40 1st4 s LEU 218 Ca 0.04 -1.00 0.06 0.00 0.02 0.00 0.00 54.13 53.24 1st4 s LEU 218 Cb -0.13 -0.94 -0.02 0.00 0.02 0.00 0.00 46.19 45.12 1st4 s LEU 218 CO -0.09 -0.03 -0.18 -0.51 0.02 0.00 0.00 176.35 175.56 1st4 s ILE 219 N -2.57 1.40 -0.25 -0.59 1.10 0.64 -1.25 121.20 119.66 1st4 s ILE 219 Ca 0.26 -0.81 -0.04 0.00 -0.51 0.00 0.00 60.65 59.54 1st4 s ILE 219 Cb -0.04 -1.17 0.01 0.00 0.15 0.00 0.00 42.46 41.41 1st4 s ILE 219 CO 0.11 0.35 -0.00 0.00 -2.11 0.00 0.00 174.94 173.29 1st4 s ALA 220 N -0.48 2.87 -0.16 1.50 0.00 0.26 -0.09 121.76 125.66 1st4 s ALA 220 Ca 0.07 -1.35 -0.04 0.00 0.00 0.00 0.00 51.96 50.63 1st4 s ALA 220 Cb -0.07 -1.86 -0.03 0.00 0.00 0.00 0.00 23.12 21.16 1st4 s ALA 220 CO -0.00 -0.72 -0.02 0.96 0.00 0.00 0.00 175.76 175.98 1st4 s ILE 221 N 1.44 4.07 0.52 0.00 -4.36 0.61 -1.30 121.20 122.19 1st4 s ILE 221 Ca 0.03 -0.29 -0.21 0.00 -0.26 0.00 0.00 60.65 59.92 1st4 s ILE 221 Cb -0.16 -2.80 -0.06 0.00 1.25 0.00 0.00 42.46 40.69 1st4 s ILE 221 CO -0.02 0.48 1.19 0.00 0.24 0.00 0.00 174.94 176.83 1st4 h HIS 223 N 1.48 1.18 -3.13 0.00 3.86 -1.29 -3.45 115.15 113.81 1st4 h HIS 223 Ca -0.50 -0.19 -0.53 0.00 -1.16 0.00 0.00 60.37 58.00 1st4 h HIS 223 Cb 1.27 -0.32 0.03 0.00 1.06 0.00 0.00 27.41 29.46 1st4 h HIS 223 CO 0.50 1.02 0.74 0.50 0.86 0.00 0.00 177.93 181.55 1st4 s ARG 224 N -5.10 4.31 0.52 2.45 3.52 -1.16 -4.99 118.95 118.49 1st4 s ARG 224 Ca -0.12 2.15 -0.09 0.00 -0.13 0.00 0.00 55.73 57.54 1st4 s ARG 224 Cb 0.14 -3.20 -0.05 0.00 -1.56 0.00 0.00 34.95 30.29 1st4 s ARG 224 CO 0.86 -0.42 0.88 1.03 -0.81 0.00 0.00 175.30 176.84 1st4 s ARG 225 N 0.58 3.64 0.00 5.12 0.52 -1.26 -4.53 118.95 123.02 1st4 s ARG 225 Ca 0.63 0.50 0.00 0.00 -0.52 0.00 0.00 55.73 56.34 1st4 s ARG 225 Cb -0.39 -2.26 0.00 0.00 0.52 0.00 0.00 34.95 32.83 1st4 s ARG 225 CO 0.34 -0.30 0.00 0.41 0.02 0.00 0.00 175.30 175.77 1st4 n GLY 226 N -2.19 0.79 3.53 -3.53 0.00 -1.26 -5.03 105.19 97.50 1st4 n GLY 226 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1st4 n GLY 226 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1st4 s ILE 227 N -2.98 4.70 0.07 -0.61 1.01 -1.26 -4.92 121.20 117.21 1st4 s ILE 227 Ca 0.00 0.27 0.02 0.00 0.00 0.00 0.00 60.65 60.94 1st4 s ILE 227 Cb 0.00 -4.30 -0.25 0.00 0.01 0.00 0.00 42.46 37.93 1st4 s ILE 227 CO 0.00 -0.71 1.12 0.03 0.00 0.00 0.00 174.94 175.38 1st4 h ARG 228 N 8.97 0.13 0.00 2.79 3.08 -1.95 -0.14 114.38 127.26 1st4 h ARG 228 Ca -0.25 -0.22 0.00 0.00 0.07 0.00 0.00 59.98 59.58 1st4 h ARG 228 Cb 1.09 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.22 1st4 h ARG 228 CO 0.95 1.05 0.00 -1.13 -1.07 0.00 0.00 179.97 179.77 1st4 n SER 229 N -3.40 0.00 -0.42 7.04 3.41 -1.26 -3.40 113.62 115.58 1st4 n SER 229 Ca -0.07 0.00 0.35 0.00 -0.26 0.00 0.00 58.87 58.89 1st4 n SER 229 Cb 0.99 0.00 0.63 0.00 -0.26 0.00 0.00 64.21 65.57 1st4 n SER 229 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1st4 h LEU 230 N 0.00 0.27 -1.91 1.04 5.85 -1.94 -0.67 115.31 117.95 1st4 h LEU 230 Ca 0.00 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1st4 h LEU 230 Cb 0.00 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.16 1st4 h LEU 230 CO 0.00 -0.19 0.00 0.03 -0.34 0.00 0.00 178.44 177.94 1st4 h ARG 231 N 0.10 0.00 -0.00 1.25 3.08 -1.95 -1.99 114.38 114.88 1st4 h ARG 231 Ca 0.81 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.86 1st4 h ARG 231 Cb 2.46 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.51 1st4 h ARG 231 CO -0.46 0.00 -0.18 -0.25 -1.07 0.00 0.00 179.97 178.01 1st4 n ASP 232 N -2.87 0.30 -4.72 7.04 8.00 -0.26 -4.45 116.55 119.59 1st4 n ASP 232 Ca -0.01 -0.08 -0.41 0.00 0.71 0.00 0.00 54.79 54.99 1st4 n ASP 232 Cb 0.18 -0.14 -0.04 0.00 -0.02 0.00 0.00 41.12 41.10 1st4 n ASP 232 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1st4 s LEU 233 N -2.82 4.45 0.30 0.64 1.43 -0.75 -5.00 118.68 116.93 1st4 s LEU 233 Ca 0.18 1.72 0.03 0.00 -1.03 0.00 0.00 54.13 55.03 1st4 s LEU 233 Cb 0.19 -3.55 -0.05 0.00 0.03 0.00 0.00 46.19 42.81 1st4 s LEU 233 CO 0.56 -0.13 0.11 0.42 0.23 0.00 0.00 176.35 177.55 1st4 s THR 234 N 0.35 0.60 0.61 5.49 -4.23 -1.26 -4.65 115.64 112.56 1st4 s THR 234 Ca 0.48 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 59.30 1st4 s THR 234 Cb -0.22 -2.59 0.36 0.00 1.34 0.00 0.00 72.50 71.38 1st4 s THR 234 CO 0.29 0.00 2.07 -0.65 -0.54 0.00 0.00 174.62 175.79 1st4 h PRO 235 N 2.22 0.00 -0.39 3.99 0.11 -1.86 0.73 132.00 136.79 1st4 h PRO 235 Ca -0.37 0.00 0.10 0.00 0.11 0.00 0.00 66.00 65.84 1st4 h PRO 235 Cb 1.25 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.34 1st4 h PRO 235 CO 0.59 0.00 0.28 1.49 -0.21 0.00 0.00 178.00 180.15 1st4 h GLU 236 N 0.00 0.07 0.00 1.05 4.81 -1.96 -2.53 114.58 116.02 1st4 h GLU 236 Ca 0.08 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1st4 h GLU 236 Cb 0.56 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.92 1st4 h GLU 236 CO -0.00 0.05 -0.24 0.72 -0.73 0.00 0.00 179.01 178.81 1st4 n HIS 237 N -4.44 0.48 -0.31 0.92 8.25 0.25 -4.44 115.22 115.93 1st4 n HIS 237 Ca 0.06 0.14 0.03 0.00 -0.26 0.00 0.00 57.72 57.69 1st4 n HIS 237 Cb 0.42 -0.66 0.10 0.00 1.12 0.00 0.00 29.99 30.97 1st4 n HIS 237 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1st4 h LEU 238 N 0.00 -0.87 -0.50 2.41 3.38 -1.52 0.82 115.31 119.03 1st4 h LEU 238 Ca 0.00 0.26 0.07 0.00 0.09 0.00 0.00 57.88 58.30 1st4 h LEU 238 Cb 0.65 0.56 -0.06 0.00 0.09 0.00 0.00 40.66 41.90 1st4 h LEU 238 CO 0.00 -0.29 0.17 -0.65 0.09 0.00 0.00 178.44 177.76 1st4 h PRO 239 N -0.01 0.33 0.03 1.13 0.11 -1.81 -1.24 132.00 130.54 1st4 h PRO 239 Ca 0.41 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.52 1st4 h PRO 239 Cb 0.63 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 31.62 1st4 h PRO 239 CO -0.89 0.22 -0.30 1.25 -0.21 0.00 0.00 178.00 178.07 1st4 h LEU 240 N 0.34 -0.88 -0.94 2.35 5.85 -1.23 -1.31 115.31 119.49 1st4 h LEU 240 Ca 0.24 0.11 0.13 0.00 0.84 0.00 0.00 57.88 59.20 1st4 h LEU 240 Cb 0.26 0.35 -0.09 0.00 0.37 0.00 0.00 40.66 41.56 1st4 h LEU 240 CO -0.25 -0.37 0.56 -0.07 -0.34 0.00 0.00 178.44 177.96 1st4 h LEU 241 N -0.47 0.78 -0.48 2.25 3.38 -0.54 -0.50 115.31 119.73 1st4 h LEU 241 Ca 0.05 0.06 -0.17 0.00 0.09 0.00 0.00 57.88 57.92 1st4 h LEU 241 Cb 0.54 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1st4 h LEU 241 CO -0.23 0.38 -0.70 0.03 0.09 0.00 0.00 178.44 178.01 1st4 h ARG 242 N 0.84 0.30 -0.15 1.13 3.08 -1.14 -0.35 114.38 118.09 1st4 h ARG 242 Ca 0.48 -0.24 -0.18 0.00 0.07 0.00 0.00 59.98 60.11 1st4 h ARG 242 Cb 0.56 0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.67 1st4 h ARG 242 CO -0.30 0.88 -0.60 -0.91 -1.07 0.00 0.00 179.97 177.97 1st4 h ASN 243 N 0.20 0.80 0.34 7.04 2.35 -0.48 0.56 115.58 126.39 1st4 h ASN 243 Ca -0.02 -0.62 -0.00 0.00 -0.55 0.00 0.00 56.30 55.11 1st4 h ASN 243 Cb 1.26 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 39.37 1st4 h ASN 243 CO 0.11 1.28 -0.43 0.40 -1.65 0.00 0.00 177.43 177.14 1st4 h ILE 244 N 0.36 0.14 -0.34 2.81 2.04 -0.91 0.98 117.51 122.59 1st4 h ILE 244 Ca -0.03 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.90 1st4 h ILE 244 Cb 1.24 0.14 -0.08 0.00 -0.74 0.00 0.00 36.82 37.37 1st4 h ILE 244 CO 0.13 0.00 -0.28 0.25 0.00 0.00 0.00 178.15 178.24 1st4 h LEU 245 N -0.82 -0.93 0.12 1.44 5.85 -1.08 0.23 115.31 120.12 1st4 h LEU 245 Ca -0.03 0.17 -0.34 0.00 0.84 0.00 0.00 57.88 58.52 1st4 h LEU 245 Cb 0.75 0.44 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 1st4 h LEU 245 CO -0.12 -0.30 -1.84 0.45 -0.34 0.00 0.00 178.44 176.30 1st4 h HIS 246 N -0.24 0.46 0.01 1.25 3.86 -0.76 -1.93 115.15 117.78 1st4 h HIS 246 Ca 0.16 -0.33 -0.22 0.00 -1.16 0.00 0.00 60.37 58.82 1st4 h HIS 246 Cb 0.51 -0.02 -0.03 0.00 1.06 0.00 0.00 27.41 28.93 1st4 h HIS 246 CO -0.48 1.59 -1.03 1.96 0.86 0.00 0.00 177.93 180.83 1st4 h GLN 247 N 0.07 0.02 0.13 2.45 4.20 -0.91 -1.97 115.11 119.10 1st4 h GLN 247 Ca -0.36 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.32 1st4 h GLN 247 Cb 2.04 0.01 0.00 0.00 0.30 0.00 0.00 27.48 29.83 1st4 h GLN 247 CO 0.12 1.00 -0.06 0.78 -0.67 0.00 0.00 178.83 179.99 1st4 h GLY 248 N 2.93 -0.18 0.99 3.46 0.00 -0.86 0.53 103.07 109.94 1st4 h GLY 248 Ca -0.02 0.07 -0.00 0.00 0.00 0.00 0.00 47.33 47.37 1st4 h GLY 248 CO 0.13 -0.07 0.32 1.46 0.00 0.00 0.00 176.54 178.39 1st4 h GLN 249 N -0.33 0.74 -0.89 4.80 4.20 -1.36 -1.64 115.11 120.63 1st4 h GLN 249 Ca -0.02 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 1st4 h GLN 249 Cb 0.26 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 27.85 1st4 h GLN 249 CO 0.03 0.54 0.50 1.49 -0.67 0.00 0.00 178.83 180.72 1st4 h GLU 250 N 0.73 1.23 -0.23 1.46 4.57 -1.33 -1.15 114.58 119.86 1st4 h GLU 250 Ca 0.19 -0.14 -0.06 0.00 -1.18 0.00 0.00 59.36 58.17 1st4 h GLU 250 Cb -0.01 -0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 28.32 1st4 h GLU 250 CO -0.04 0.89 -0.13 0.00 -1.18 0.00 0.00 179.01 178.55 1st4 h ALA 251 N 1.31 1.34 -0.21 2.92 0.00 -0.30 -1.92 119.26 122.40 1st4 h ALA 251 Ca 0.31 -0.25 -0.17 0.00 0.00 0.00 0.00 54.91 54.81 1st4 h ALA 251 Cb 0.01 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1st4 h ALA 251 CO -0.05 0.45 -0.55 0.82 0.00 0.00 0.00 179.25 179.92 1st4 h ILE 252 N 0.36 1.31 -0.68 0.00 2.04 -0.66 0.25 117.51 120.14 1st4 h ILE 252 Ca 0.07 -1.78 -0.01 0.00 1.00 0.00 0.00 64.86 64.14 1st4 h ILE 252 Cb 0.46 1.74 -0.03 0.00 -0.74 0.00 0.00 36.82 38.24 1st4 h ILE 252 CO 0.03 0.56 0.40 0.25 0.00 0.00 0.00 178.15 179.39 1st4 h LEU 253 N 0.48 0.83 0.08 1.44 5.85 -1.06 -0.29 115.31 122.63 1st4 h LEU 253 Ca 0.01 -0.07 -0.29 0.00 0.84 0.00 0.00 57.88 58.37 1st4 h LEU 253 Cb 1.10 -0.21 0.02 0.00 0.37 0.00 0.00 40.66 41.94 1st4 h LEU 253 CO 0.11 0.66 -1.21 1.56 -0.34 0.00 0.00 178.44 179.21 1st4 h GLN 254 N 0.93 0.53 -0.17 1.25 1.08 -1.20 0.29 115.11 117.83 1st4 h GLN 254 Ca 0.24 -0.72 -0.14 0.00 -1.45 0.00 0.00 58.65 56.59 1st4 h GLN 254 Cb -0.01 0.24 0.00 0.00 -0.05 0.00 0.00 27.48 27.66 1st4 h GLN 254 CO -0.04 1.31 -0.43 -0.09 -0.95 0.00 0.00 178.83 178.63 1st4 h ARG 255 N 0.23 0.58 0.00 1.46 9.65 -0.87 -3.40 114.38 122.04 1st4 h ARG 255 Ca -0.17 -0.41 0.00 0.00 -1.10 0.00 0.00 59.98 58.31 1st4 h ARG 255 Cb 1.88 0.06 0.00 0.00 -1.39 0.00 0.00 29.97 30.52 1st4 h ARG 255 CO 0.22 1.02 0.00 0.66 2.80 0.00 0.00 179.97 184.68 1st4 n TYR 256 N -4.25 0.00 -1.54 2.20 4.02 -0.14 -4.99 117.16 112.47 1st4 n TYR 256 Ca -0.07 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.67 1st4 n TYR 256 Cb 0.55 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.81 1st4 n TYR 256 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1st4 n ARG 257 N -0.40 -1.10 -3.47 -0.72 1.74 0.09 -4.96 116.66 107.84 1st4 n ARG 257 Ca 0.00 1.02 -0.39 0.00 -0.77 0.00 0.00 57.85 57.71 1st4 n ARG 257 Cb 0.01 -5.21 -0.10 0.00 -1.02 0.00 0.00 32.46 26.15 1st4 n ARG 257 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 1st4 s MET 258 N -3.47 3.96 0.60 5.56 1.75 -1.23 -4.94 119.30 121.53 1st4 s MET 258 Ca 0.00 -0.14 -0.18 0.00 -1.25 0.00 0.00 55.69 54.12 1st4 s MET 258 Cb 0.00 -3.67 -0.03 0.00 2.84 0.00 0.00 34.83 33.97 1st4 s MET 258 CO 0.00 -0.25 1.18 0.15 -0.65 0.00 0.00 175.02 175.44 1st4 s LYS 259 N 1.94 3.00 0.48 4.11 1.02 -1.26 -3.10 119.74 125.92 1st4 s LYS 259 Ca 0.11 1.73 0.18 0.00 0.02 0.00 0.00 55.97 58.01 1st4 s LYS 259 Cb -0.16 -1.94 1.16 0.00 -0.52 0.00 0.00 37.83 36.37 1st4 s LYS 259 CO 0.10 -1.16 2.04 0.78 -0.92 0.00 0.00 175.35 176.20 1st4 h GLY 260 N 0.81 0.00 0.82 -3.33 0.00 -1.95 0.36 103.07 99.77 1st4 h GLY 260 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.83 1st4 h GLY 260 CO 0.55 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.18 1st4 n ASP 261 N -4.21 0.00 -0.97 0.19 5.75 -1.26 -1.78 116.55 114.26 1st4 n ASP 261 Ca -0.02 -0.89 0.09 0.00 -0.01 0.00 0.00 54.79 53.96 1st4 n ASP 261 Cb 0.21 0.00 0.20 0.00 -1.03 0.00 0.00 41.12 40.50 1st4 n ASP 261 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1st4 n HIS 262 N -0.91 0.53 -4.99 2.11 8.25 0.13 -4.97 115.22 115.36 1st4 n HIS 262 Ca 0.15 -0.34 -0.30 0.00 -0.26 0.00 0.00 57.72 56.98 1st4 n HIS 262 Cb 0.07 -0.01 -0.15 0.00 1.12 0.00 0.00 29.99 31.02 1st4 n HIS 262 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1st4 s LEU 263 N -1.19 2.13 -0.32 2.41 1.43 -0.73 -0.85 118.68 121.56 1st4 s LEU 263 Ca 0.33 -0.54 -0.05 0.00 -1.03 0.00 0.00 54.13 52.85 1st4 s LEU 263 Cb 0.19 -1.26 0.04 0.00 0.03 0.00 0.00 46.19 45.19 1st4 s LEU 263 CO 0.26 0.26 0.06 -0.60 0.23 0.00 0.00 176.35 176.56 1st4 s ARG 264 N -1.04 2.59 -0.21 1.70 3.52 -0.26 -4.78 118.95 120.47 1st4 s ARG 264 Ca 0.11 -1.18 -0.03 0.00 -0.13 0.00 0.00 55.73 54.49 1st4 s ARG 264 Cb -0.10 -3.34 -0.01 0.00 -1.56 0.00 0.00 34.95 29.95 1st4 s ARG 264 CO 0.01 -0.63 -0.06 0.08 -0.81 0.00 0.00 175.30 173.89 1st4 s VAL 265 N 1.35 3.28 0.22 7.11 1.01 -1.26 -1.29 120.40 130.82 1st4 s VAL 265 Ca -0.03 -0.53 -0.22 0.00 0.00 0.00 0.00 61.98 61.20 1st4 s VAL 265 Cb -0.19 -2.47 0.04 0.00 0.00 0.00 0.00 36.38 33.76 1st4 s VAL 265 CO 0.01 0.44 0.72 -0.72 0.00 0.00 0.00 175.10 175.55 1st4 s TYR 266 N 1.31 -0.30 0.32 5.22 -0.85 0.04 -1.78 117.35 121.32 1st4 s TYR 266 Ca 0.04 -0.05 0.10 0.00 -0.52 0.00 0.00 57.07 56.63 1st4 s TYR 266 Cb -0.14 0.65 -0.05 0.00 0.38 0.00 0.00 41.96 42.79 1st4 s TYR 266 CO -0.03 -1.04 -0.07 -0.51 -1.52 0.00 0.00 175.55 172.38 1st4 s LEU 267 N -2.85 2.84 -0.07 -3.49 1.02 -0.26 -0.71 118.68 115.16 1st4 s LEU 267 Ca 0.08 -1.02 -0.03 0.00 0.02 0.00 0.00 54.13 53.17 1st4 s LEU 267 Cb -0.04 -1.23 -0.04 0.00 0.02 0.00 0.00 46.19 44.90 1st4 s LEU 267 CO -0.00 -0.13 0.09 -1.00 0.02 0.00 0.00 176.35 175.32 1st4 s HIS 268 N -2.52 3.39 -0.11 0.29 3.76 -1.26 -0.59 115.29 118.24 1st4 s HIS 268 Ca 0.33 0.33 -0.04 0.00 -0.15 0.00 0.00 55.06 55.53 1st4 s HIS 268 Cb -0.01 -1.83 0.05 0.00 1.11 0.00 0.00 32.58 31.90 1st4 s HIS 268 CO 0.18 0.61 0.12 -0.47 -0.85 0.00 0.00 174.74 174.32 1st4 s TYR 269 N -1.07 -0.01 0.41 1.40 5.04 -0.41 -3.40 117.35 119.31 1st4 s TYR 269 Ca 0.18 0.18 -0.22 0.00 -2.44 0.00 0.00 57.07 54.77 1st4 s TYR 269 Cb -0.12 -0.47 -0.10 0.00 0.35 0.00 0.00 41.96 41.62 1st4 s TYR 269 CO 0.08 -0.36 0.97 -0.51 -1.34 0.00 0.00 175.55 174.38 1st4 s LEU 270 N 2.22 4.05 0.70 6.97 1.02 -1.26 -4.51 118.68 127.86 1st4 s LEU 270 Ca 0.04 1.78 -0.09 0.00 0.02 0.00 0.00 54.13 55.88 1st4 s LEU 270 Cb -0.14 -4.38 0.04 0.00 0.02 0.00 0.00 46.19 41.73 1st4 s LEU 270 CO -0.07 -0.34 1.05 -2.16 0.02 0.00 0.00 176.35 174.85 1st4 s PRO 271 N -2.85 2.50 -0.04 1.29 0.04 -1.22 -4.99 135.00 129.73 1st4 s PRO 271 Ca 0.59 0.09 0.15 0.00 0.04 0.00 0.00 61.00 61.88 1st4 s PRO 271 Cb -0.13 -2.10 -0.21 0.00 0.04 0.00 0.00 34.50 32.10 1st4 s PRO 271 CO 0.18 -1.14 0.58 0.43 0.04 0.00 0.00 177.00 177.09 1st4 n SER 272 N -2.96 0.65 -4.16 6.66 7.64 -1.26 -4.82 113.62 115.38 1st4 n SER 272 Ca 0.07 0.30 -0.34 0.00 1.01 0.00 0.00 58.87 59.91 1st4 n SER 272 Cb 0.59 0.31 -0.14 0.00 -1.01 0.00 0.00 64.21 63.95 1st4 n SER 272 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1st4 s TYR 273 N -2.71 3.13 -1.06 1.43 1.51 -1.26 -3.21 117.35 115.18 1st4 s TYR 273 Ca -0.05 -1.80 -0.07 0.00 -1.01 0.00 0.00 57.07 54.13 1st4 s TYR 273 Cb 0.08 -2.03 -0.06 0.00 -0.11 0.00 0.00 41.96 39.84 1st4 s TYR 273 CO 0.83 -0.79 2.95 0.66 -1.11 0.00 0.00 175.55 178.09 1st4 n TYR 274 N 4.60 1.83 -3.74 2.71 4.02 -1.26 -4.64 117.16 120.68 1st4 n TYR 274 Ca -0.16 -2.54 -0.23 0.00 -0.01 0.00 0.00 57.90 54.96 1st4 n TYR 274 Cb 0.45 -2.01 -0.17 0.00 -0.02 0.00 0.00 39.34 37.59 1st4 n TYR 274 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 1st4 s HIS 275 N 0.64 0.61 0.04 -0.72 2.46 -1.22 -4.36 115.29 112.74 1st4 s HIS 275 Ca 0.64 -0.21 -0.36 0.00 0.47 0.00 0.00 55.06 55.60 1st4 s HIS 275 Cb 0.24 -0.78 -0.18 0.00 -0.13 0.00 0.00 32.58 31.72 1st4 s HIS 275 CO -0.08 -0.36 0.92 -0.11 -2.47 0.00 0.00 174.74 172.64 1st4 n LEU 276 N 5.16 -0.23 -3.77 8.88 7.94 -0.06 -4.95 117.00 129.98 1st4 n LEU 276 Ca -0.07 1.10 -0.13 0.00 -1.11 0.00 0.00 56.01 55.80 1st4 n LEU 276 Cb 0.50 -0.88 -0.11 0.00 0.53 0.00 0.00 43.42 43.46 1st4 n LEU 276 CO 0.10 -2.00 -0.02 0.54 -1.11 0.00 0.00 177.39 174.89 1st4 s ASN 277 N -0.18 -0.30 -0.04 1.96 2.20 -1.26 -3.68 114.94 113.64 1st4 s ASN 277 Ca 0.82 0.56 0.06 0.00 -0.94 0.00 0.00 52.86 53.36 1st4 s ASN 277 Cb -1.15 0.59 -0.02 0.00 -2.00 0.00 0.00 41.25 38.68 1st4 s ASN 277 CO 0.54 -0.14 -0.22 -0.69 -2.94 0.00 0.00 177.10 173.65 1st4 s VAL 278 N 0.00 2.40 -0.17 3.54 1.01 -0.42 -4.55 120.40 122.21 1st4 s VAL 278 Ca -0.01 -0.97 -0.03 0.00 0.00 0.00 0.00 61.98 60.96 1st4 s VAL 278 Cb -0.03 -1.88 -0.02 0.00 0.00 0.00 0.00 36.38 34.45 1st4 s VAL 278 CO 0.01 0.58 -0.05 -1.00 0.00 0.00 0.00 175.10 174.64 1st4 s HIS 279 N -0.57 2.98 -0.23 5.22 3.76 0.11 -0.57 115.29 125.98 1st4 s HIS 279 Ca 0.08 -0.48 -0.02 0.00 -0.15 0.00 0.00 55.06 54.50 1st4 s HIS 279 Cb -0.11 -1.98 0.02 0.00 1.11 0.00 0.00 32.58 31.62 1st4 s HIS 279 CO 0.00 -0.18 -0.07 -0.06 -0.85 0.00 0.00 174.74 173.58 1st4 s PHE 280 N 0.63 3.01 0.06 1.40 0.40 -0.38 -0.78 117.98 122.33 1st4 s PHE 280 Ca -0.03 -1.44 0.07 0.00 -0.60 0.00 0.00 56.93 54.93 1st4 s PHE 280 Cb -0.15 -2.05 -0.03 0.00 0.51 0.00 0.00 43.02 41.30 1st4 s PHE 280 CO 0.02 -0.70 -0.19 0.95 0.70 0.00 0.00 175.22 176.00 1st4 s THR 281 N 1.35 1.53 0.24 0.64 -4.23 -0.41 -0.56 115.64 114.20 1st4 s THR 281 Ca 0.02 -1.28 -0.31 0.00 -1.18 0.00 0.00 61.69 58.94 1st4 s THR 281 Cb -0.16 -1.37 -0.13 0.00 1.34 0.00 0.00 72.50 72.18 1st4 s THR 281 CO -0.05 0.05 1.45 0.00 -0.54 0.00 0.00 174.62 175.53 1st4 n ALA 282 N 1.57 1.34 -0.26 3.99 0.00 -0.45 -1.10 120.51 125.60 1st4 n ALA 282 Ca -0.18 0.41 -0.06 0.00 0.00 0.00 0.00 53.44 53.61 1st4 n ALA 282 Cb 0.54 -2.31 0.05 0.00 0.00 0.00 0.00 19.45 17.73 1st4 n ALA 282 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1st4 h LEU 283 N 4.47 0.90 0.00 0.00 5.85 -1.30 -0.55 115.31 124.69 1st4 h LEU 283 Ca -0.45 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.16 1st4 h LEU 283 Cb 1.27 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.07 1st4 h LEU 283 CO 0.78 0.76 0.00 0.61 -0.34 0.00 0.00 178.44 180.24 1st4 n GLY 284 N -1.03 -1.19 3.62 3.75 0.00 -1.26 -4.59 105.19 104.49 1st4 n GLY 284 Ca 0.06 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 1st4 n GLY 284 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1st4 s PHE 285 N -2.46 3.19 -1.29 1.61 5.99 -0.22 -4.97 117.98 119.83 1st4 s PHE 285 Ca 0.31 0.92 -0.17 0.00 0.00 0.00 0.00 56.93 58.00 1st4 s PHE 285 Cb 0.20 -3.37 0.09 0.00 0.00 0.00 0.00 43.02 39.94 1st4 s PHE 285 CO 0.42 -0.63 1.72 0.39 -0.00 0.00 0.00 175.22 177.12 1st4 n GLU 286 N 6.41 3.22 -2.16 10.12 -0.58 -1.26 -4.80 120.64 131.58 1st4 n GLU 286 Ca 0.06 -3.35 -0.41 0.00 -0.42 0.00 0.00 57.16 53.05 1st4 n GLU 286 Cb 0.48 -3.38 -0.02 0.00 -0.57 0.00 0.00 31.44 27.94 1st4 n GLU 286 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1st4 s ALA 287 N 3.53 3.49 0.45 0.62 0.00 -1.26 -4.97 121.76 123.63 1st4 s ALA 287 Ca 0.51 1.21 -0.25 0.00 0.00 0.00 0.00 51.96 53.43 1st4 s ALA 287 Cb 0.04 -3.46 -0.08 0.00 0.00 0.00 0.00 23.12 19.61 1st4 s ALA 287 CO 0.05 -0.58 1.42 -1.25 0.00 0.00 0.00 175.76 175.40 1st4 s PRO 288 N -1.57 3.69 -0.17 0.00 0.04 -1.26 -2.11 135.00 133.61 1st4 s PRO 288 Ca 0.49 2.40 0.00 0.00 0.04 0.00 0.00 61.00 63.93 1st4 s PRO 288 Cb -0.39 -2.65 0.00 0.00 0.04 0.00 0.00 34.50 31.50 1st4 s PRO 288 CO 0.50 -0.81 0.00 0.41 0.04 0.00 0.00 177.00 177.14 1st4 n GLY 289 N 0.59 0.53 1.46 0.56 0.00 -1.26 -4.93 105.19 102.14 1st4 n GLY 289 Ca 0.05 -0.58 0.10 0.00 0.00 0.00 0.00 46.02 45.60 1st4 n GLY 289 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1st4 n SER 290 N 0.89 4.28 -4.80 1.61 3.41 -0.90 -4.29 113.62 113.82 1st4 n SER 290 Ca -0.02 -2.21 -0.34 0.00 -0.26 0.00 0.00 58.87 56.04 1st4 n SER 290 Cb 0.08 -0.53 -0.04 0.00 -0.26 0.00 0.00 64.21 63.46 1st4 n SER 290 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1st4 s GLY 291 N -0.94 2.50 0.53 5.00 0.00 -1.26 -4.69 107.32 108.46 1st4 s GLY 291 Ca 0.49 0.57 0.31 0.00 0.00 0.00 0.00 44.72 46.09 1st4 s GLY 291 CO 0.29 0.88 1.90 -0.24 0.00 0.00 0.00 173.10 175.93 1st4 h VAL 292 N 1.66 0.57 0.00 1.40 3.04 -1.95 0.21 116.25 121.19 1st4 h VAL 292 Ca -0.49 -0.01 0.00 0.00 -1.01 0.00 0.00 66.70 65.19 1st4 h VAL 292 Cb 1.21 0.55 0.00 0.00 -2.01 0.00 0.00 31.29 31.04 1st4 h VAL 292 CO 0.60 0.00 0.00 -1.84 -1.01 0.00 0.00 177.57 175.32 1st4 n GLU 293 N -4.29 0.51 0.00 4.17 0.00 -1.26 -4.23 120.64 115.55 1st4 n GLU 293 Ca 0.18 0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.36 1st4 n GLU 293 Cb 0.93 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 30.87 1st4 n GLU 293 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 1st4 n ARG 294 N -1.05 0.00 -3.30 3.44 0.63 0.33 -4.12 116.66 112.58 1st4 n ARG 294 Ca 0.13 0.00 -0.38 0.00 -0.92 0.00 0.00 57.85 56.68 1st4 n ARG 294 Cb 0.08 -0.42 -0.06 0.00 0.45 0.00 0.00 32.46 32.51 1st4 n ARG 294 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1st4 s ALA 295 N -1.00 3.59 -0.14 5.13 0.00 0.46 -1.29 121.76 128.51 1st4 s ALA 295 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 51.96 51.95 1st4 s ALA 295 Cb 0.00 -2.61 0.04 0.00 0.00 0.00 0.00 23.12 20.55 1st4 s ALA 295 CO 0.00 0.41 -0.02 -1.01 0.00 0.00 0.00 175.76 175.14 1st4 s HIS 296 N -1.16 1.19 0.20 0.00 3.76 0.24 -4.66 115.29 114.86 1st4 s HIS 296 Ca 0.30 -0.70 -0.31 0.00 -0.15 0.00 0.00 55.06 54.20 1st4 s HIS 296 Cb -0.19 -1.07 -0.10 0.00 1.11 0.00 0.00 32.58 32.33 1st4 s HIS 296 CO 0.19 -0.51 1.49 -0.51 -0.85 0.00 0.00 174.74 174.54 1st4 s LEU 297 N 1.80 4.38 0.18 0.89 1.43 -1.26 -1.10 118.68 124.99 1st4 s LEU 297 Ca 0.02 2.62 -0.14 0.00 -1.03 0.00 0.00 54.13 55.60 1st4 s LEU 297 Cb -0.14 -3.61 0.08 0.00 0.03 0.00 0.00 46.19 42.55 1st4 s LEU 297 CO -0.07 -0.75 1.84 0.25 0.23 0.00 0.00 176.35 177.85 1st4 h LEU 298 N 5.89 0.60 -0.74 1.79 6.46 -1.68 -1.02 115.31 126.61 1st4 h LEU 298 Ca -0.44 -0.01 0.16 0.00 -0.12 0.00 0.00 57.88 57.46 1st4 h LEU 298 Cb 1.21 -0.15 -0.11 0.00 -0.73 0.00 0.00 40.66 40.89 1st4 h LEU 298 CO 0.84 0.43 0.21 0.00 -0.62 0.00 0.00 178.44 179.30 1st4 h ALA 299 N 1.21 0.98 -0.18 1.25 0.00 -1.91 -0.98 119.26 119.63 1st4 h ALA 299 Ca 0.20 0.15 -0.14 0.00 0.00 0.00 0.00 54.91 55.12 1st4 h ALA 299 Cb -0.06 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1st4 h ALA 299 CO -0.05 -0.31 -0.50 0.93 0.00 0.00 0.00 179.25 179.32 1st4 h GLU 300 N 0.31 0.48 -0.33 0.00 5.08 -1.78 -2.70 114.58 115.65 1st4 h GLU 300 Ca 0.41 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 1st4 h GLU 300 Cb 0.69 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 1st4 h GLU 300 CO -0.48 0.87 0.15 0.28 -1.00 0.00 0.00 179.01 178.83 1st4 h VAL 301 N 0.38 1.16 -0.42 3.13 2.07 -0.21 0.21 116.25 122.58 1st4 h VAL 301 Ca 0.02 -0.47 0.04 0.00 0.82 0.00 0.00 66.70 67.11 1st4 h VAL 301 Cb 1.01 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.61 1st4 h VAL 301 CO 0.09 0.17 0.19 0.40 0.02 0.00 0.00 177.57 178.44 1st4 h ILE 302 N 0.39 0.93 -0.01 4.57 2.04 -1.14 -1.98 117.51 122.32 1st4 h ILE 302 Ca 0.11 -0.13 -0.18 0.00 1.00 0.00 0.00 64.86 65.66 1st4 h ILE 302 Cb 0.13 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 1st4 h ILE 302 CO -0.01 0.07 -0.80 -0.33 0.00 0.00 0.00 178.15 177.07 1st4 h GLU 303 N 0.38 0.13 -0.67 2.37 5.08 -1.11 -1.85 114.58 118.91 1st4 h GLU 303 Ca 0.19 -0.13 0.05 0.00 -1.00 0.00 0.00 59.36 58.47 1st4 h GLU 303 Cb 0.12 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.36 1st4 h GLU 303 CO -0.15 0.86 0.39 -0.91 -1.00 0.00 0.00 179.01 178.19 1st4 h ASN 304 N 0.08 0.59 -0.05 1.42 2.35 -0.25 -1.16 115.58 118.55 1st4 h ASN 304 Ca -0.03 0.02 -0.10 0.00 -0.55 0.00 0.00 56.30 55.65 1st4 h ASN 304 Cb 1.40 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 39.66 1st4 h ASN 304 CO 0.12 0.39 -0.27 -0.07 -1.65 0.00 0.00 177.43 175.95 1st4 h LEU 305 N 0.72 0.50 -0.46 1.61 3.38 -0.90 -1.73 115.31 118.44 1st4 h LEU 305 Ca 0.29 -0.17 -0.16 0.00 0.09 0.00 0.00 57.88 57.92 1st4 h LEU 305 Cb 0.14 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1st4 h LEU 305 CO -0.16 0.75 -0.49 -0.33 0.09 0.00 0.00 178.44 178.30 1st4 h GLU 306 N 0.43 0.72 0.00 1.13 5.08 -0.78 -3.16 114.58 118.00 1st4 h GLU 306 Ca 0.06 -0.43 0.00 0.00 -1.00 0.00 0.00 59.36 58.00 1st4 h GLU 306 Cb 0.69 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.98 1st4 h GLU 306 CO 0.05 1.05 0.00 0.00 -1.00 0.00 0.00 179.01 179.11 1st4 n ASP 308 N -2.39 -2.14 -0.35 0.00 2.03 -0.65 -5.04 116.55 108.01 1st4 n ASP 308 Ca 0.05 -2.63 0.32 0.00 0.52 0.00 0.00 54.79 53.04 1st4 n ASP 308 Cb 0.40 1.34 0.59 0.00 -0.72 0.00 0.00 41.12 42.73 1st4 n ASP 308 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1st4 h PRO 309 N 3.53 0.05 -0.51 -0.67 0.13 -1.78 0.69 132.00 133.44 1st4 h PRO 309 Ca -0.19 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.94 1st4 h PRO 309 Cb 1.11 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1st4 h PRO 309 CO 0.09 0.03 0.00 0.54 -0.23 0.00 0.00 178.00 178.43 1st4 n ARG 310 N -5.14 4.16 -0.24 0.86 1.74 -1.26 -4.33 116.66 112.45 1st4 n ARG 310 Ca 0.37 -3.01 0.03 0.00 -0.77 0.00 0.00 57.85 54.47 1st4 n ARG 310 Cb 1.29 -2.07 0.15 0.00 -1.02 0.00 0.00 32.46 30.81 1st4 n ARG 310 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1st4 h HIS 311 N 3.42 0.51 0.00 -1.55 2.76 0.09 -0.63 115.15 119.75 1st4 h HIS 311 Ca 0.00 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 1st4 h HIS 311 Cb 1.72 -0.12 0.00 0.00 1.55 0.00 0.00 27.41 30.56 1st4 h HIS 311 CO 0.87 0.11 0.00 1.88 -1.30 0.00 0.00 177.93 179.49 1st4 h TYR 312 N 0.47 0.00 0.01 5.26 -1.99 -1.82 -1.46 116.97 117.44 1st4 h TYR 312 Ca 0.37 0.00 -0.27 0.00 2.00 0.00 0.00 58.73 60.83 1st4 h TYR 312 Cb 0.49 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 39.18 1st4 h TYR 312 CO -0.15 0.00 -1.49 1.96 -0.00 0.00 0.00 178.16 178.48 1st4 h GLN 313 N 0.00 0.02 0.13 4.88 7.50 -1.51 -3.42 115.11 122.71 1st4 h GLN 313 Ca 0.00 -0.04 -0.36 0.00 0.50 0.00 0.00 58.65 58.75 1st4 h GLN 313 Cb 0.70 0.01 -0.01 0.00 0.05 0.00 0.00 27.48 28.24 1st4 h GLN 313 CO 0.00 0.71 -1.94 1.96 -1.50 0.00 0.00 178.83 178.06 1st4 h GLN 314 N 0.01 0.28 -7.36 1.46 4.20 -1.09 -3.39 115.11 109.22 1st4 h GLN 314 Ca -0.20 -0.49 -0.46 0.00 0.06 0.00 0.00 58.65 57.56 1st4 h GLN 314 Cb 1.94 0.18 0.08 0.00 0.30 0.00 0.00 27.48 29.98 1st4 h GLN 314 CO 0.10 1.22 0.27 1.03 -0.67 0.00 0.00 178.83 180.78 1st4 s ARG 315 N -2.56 2.29 -0.08 1.46 1.81 -0.56 -3.80 118.95 117.51 1st4 s ARG 315 Ca -0.20 -0.09 -0.14 0.00 -1.72 0.00 0.00 55.73 53.58 1st4 s ARG 315 Cb 0.06 -2.12 -0.05 0.00 -0.45 0.00 0.00 34.95 32.39 1st4 s ARG 315 CO 0.79 -1.23 0.35 0.99 -0.68 0.00 0.00 175.30 175.52 1st4 s THR 316 N -3.29 5.20 -0.11 0.02 2.01 -1.26 -3.64 115.64 114.56 1st4 s THR 316 Ca 0.60 0.69 0.01 0.00 0.31 0.00 0.00 61.69 63.30 1st4 s THR 316 Cb -0.11 -3.66 -0.01 0.00 0.01 0.00 0.00 72.50 68.72 1st4 s THR 316 CO 0.46 0.49 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.97 1st4 s LEU 317 N -0.34 2.63 -0.16 4.42 1.43 -0.37 -4.86 118.68 121.42 1st4 s LEU 317 Ca 0.21 -0.34 -0.12 0.00 -1.03 0.00 0.00 54.13 52.85 1st4 s LEU 317 Cb -0.15 -1.57 -0.05 0.00 0.03 0.00 0.00 46.19 44.45 1st4 s LEU 317 CO 0.09 0.20 0.23 -0.89 0.23 0.00 0.00 176.35 176.20 1st4 s THR 318 N 0.15 5.35 0.23 5.49 2.01 -1.26 -0.27 115.64 127.34 1st4 s THR 318 Ca -0.08 0.41 -0.11 0.00 0.31 0.00 0.00 61.69 62.22 1st4 s THR 318 Cb -0.15 -3.56 -0.01 0.00 0.01 0.00 0.00 72.50 68.79 1st4 s THR 318 CO 0.05 0.43 0.42 0.72 -0.69 0.00 0.00 174.62 175.55 1st4 s PHE 319 N 0.26 0.44 -0.06 4.92 -0.12 -0.86 -4.60 117.98 117.96 1st4 s PHE 319 Ca 0.14 -0.79 -0.02 0.00 -0.05 0.00 0.00 56.93 56.20 1st4 s PHE 319 Cb -0.12 0.08 -0.04 0.00 -0.63 0.00 0.00 43.02 42.31 1st4 s PHE 319 CO 0.02 -0.92 0.07 0.00 -0.05 0.00 0.00 175.22 174.34 1st4 s ALA 320 N -4.02 3.54 0.06 1.99 0.00 -1.26 -0.66 121.76 121.41 1st4 s ALA 320 Ca 0.23 -0.79 0.05 0.00 0.00 0.00 0.00 51.96 51.45 1st4 s ALA 320 Cb 0.01 -1.63 -0.03 0.00 0.00 0.00 0.00 23.12 21.47 1st4 s ALA 320 CO 0.08 0.64 -0.15 -0.51 0.00 0.00 0.00 175.76 175.82 1st4 s LEU 321 N -1.26 2.23 0.32 0.00 1.43 -0.01 -4.89 118.68 116.49 1st4 s LEU 321 Ca 0.18 -0.56 -0.27 0.00 -1.03 0.00 0.00 54.13 52.45 1st4 s LEU 321 Cb -0.12 -0.61 -0.13 0.00 0.03 0.00 0.00 46.19 45.36 1st4 s LEU 321 CO 0.07 -0.01 0.98 0.54 0.23 0.00 0.00 176.35 178.16 1st4 n ARG 322 N 1.53 1.29 -0.29 1.70 1.74 -1.26 -0.89 116.66 120.49 1st4 n ARG 322 Ca -0.20 0.46 0.04 0.00 -0.77 0.00 0.00 57.85 57.38 1st4 n ARG 322 Cb 0.54 -1.84 0.13 0.00 -1.02 0.00 0.00 32.46 30.27 1st4 n ARG 322 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1st4 h ALA 323 N 1.84 0.65 -0.05 7.54 0.00 -1.30 -1.93 119.26 126.01 1st4 h ALA 323 Ca -0.40 0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1st4 h ALA 323 Cb 1.34 0.60 0.00 0.00 0.00 0.00 0.00 17.79 19.73 1st4 h ALA 323 CO 0.59 -0.42 0.00 -0.40 0.00 0.00 0.00 179.25 179.02 1st4 n ASP 324 N -5.50 1.93 -4.70 0.00 3.85 -1.26 -4.82 116.55 106.05 1st4 n ASP 324 Ca 0.13 -1.65 -0.44 0.00 -0.71 0.00 0.00 54.79 52.12 1st4 n ASP 324 Cb 0.46 -0.02 -0.03 0.00 -1.35 0.00 0.00 41.12 40.18 1st4 n ASP 324 CO 0.00 0.00 0.00 -0.67 -1.01 0.00 0.00 177.20 175.52 1st4 n ASP 325 N 0.51 3.55 -0.07 -1.12 4.64 -0.73 -4.85 116.55 118.48 1st4 n ASP 325 Ca 0.18 1.08 0.16 0.00 -1.38 0.00 0.00 54.79 54.82 1st4 n ASP 325 Cb 0.42 -1.51 0.57 0.00 -1.04 0.00 0.00 41.12 39.56 1st4 n ASP 325 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 1st4 h PRO 326 N 6.21 0.25 0.00 -0.67 0.13 -1.91 -2.67 132.00 133.34 1st4 h PRO 326 Ca -0.44 -0.01 -0.10 0.00 -0.87 0.00 0.00 66.00 64.57 1st4 h PRO 326 Cb 1.23 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 1st4 h PRO 326 CO 0.91 0.16 -0.48 1.25 -0.23 0.00 0.00 178.00 179.62 1st4 h LEU 327 N 0.26 0.00 0.30 1.56 5.85 -1.95 -0.61 115.31 120.72 1st4 h LEU 327 Ca 0.29 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 59.00 1st4 h LEU 327 Cb 0.79 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.83 1st4 h LEU 327 CO -0.06 0.48 -0.14 0.25 -0.34 0.00 0.00 178.44 178.63 1st4 h LEU 328 N 0.00 -0.34 -0.20 2.25 5.85 -1.79 0.32 115.31 121.40 1st4 h LEU 328 Ca -0.00 -0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.72 1st4 h LEU 328 Cb 1.02 0.09 -0.06 0.00 0.37 0.00 0.00 40.66 42.07 1st4 h LEU 328 CO 0.06 -0.16 -0.21 0.11 -0.34 0.00 0.00 178.44 177.91 1st4 h LYS 329 N -0.50 -0.22 -0.50 1.25 1.79 -1.50 1.36 116.57 118.26 1st4 h LYS 329 Ca -0.04 0.01 0.10 0.00 -2.18 0.00 0.00 60.65 58.54 1st4 h LYS 329 Cb 0.37 0.05 -0.08 0.00 -1.58 0.00 0.00 32.23 30.99 1st4 h LYS 329 CO 0.07 -0.14 0.00 -0.07 -1.08 0.00 0.00 179.45 178.22 1st4 h LEU 330 N -0.22 -0.21 -0.15 2.94 3.38 -0.96 -1.05 115.31 119.03 1st4 h LEU 330 Ca 0.12 0.12 -0.23 0.00 0.09 0.00 0.00 57.88 57.98 1st4 h LEU 330 Cb 0.41 0.21 0.01 0.00 0.09 0.00 0.00 40.66 41.38 1st4 h LEU 330 CO -0.33 -0.07 -0.82 -0.07 0.09 0.00 0.00 178.44 177.24 1st4 h LEU 331 N 0.12 0.91 -0.79 1.67 3.38 0.11 -2.64 115.31 118.07 1st4 h LEU 331 Ca 0.25 -0.62 0.08 0.00 0.09 0.00 0.00 57.88 57.68 1st4 h LEU 331 Cb 0.37 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 1st4 h LEU 331 CO -0.41 1.42 0.46 1.56 0.09 0.00 0.00 178.44 181.56 1st4 h GLN 332 N 0.51 0.79 0.00 1.13 4.20 0.23 -2.46 115.11 119.50 1st4 h GLN 332 Ca -0.06 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.60 1st4 h GLN 332 Cb 1.45 -0.18 0.00 0.00 0.30 0.00 0.00 27.48 29.05 1st4 h GLN 332 CO 0.17 0.52 0.00 0.93 -0.67 0.00 0.00 178.83 179.78 1st4 h GLU 333 N 0.82 0.00 -0.26 1.46 5.08 -1.13 -1.25 114.58 119.30 1st4 h GLU 333 Ca 0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 1st4 h GLU 333 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1st4 h GLU 333 CO -0.21 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 177.80 1st4 n ALA 334 N -2.06 2.48 0.00 3.43 0.00 -0.93 -4.41 120.51 119.02 1st4 n ALA 334 Ca 0.01 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.80 1st4 n ALA 334 Cb 0.32 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.75 1st4 n ALA 334 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1st4 n GLN 335 N 0.62 1.30 0.22 0.00 10.64 -1.03 -4.88 117.38 124.25 1st4 n GLN 335 Ca 0.16 0.00 -0.15 0.00 -1.83 0.00 0.00 57.00 55.18 1st4 n GLN 335 Cb 0.38 -0.78 -0.08 0.00 -0.86 0.00 0.00 30.24 28.91 1st4 n GLN 335 CO 0.00 0.00 0.00 1.96 -1.83 0.00 0.00 177.06 177.19 1st4 h GLN 336 N 0.00 -0.49 0.00 2.61 1.08 -1.46 -3.52 115.11 113.33 1st4 h GLN 336 Ca 0.00 0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 1st4 h GLN 336 Cb 0.56 0.11 0.00 0.00 -0.05 0.00 0.00 27.48 28.10 1st4 h GLN 336 CO 0.00 -0.33 0.00 0.45 -0.95 0.00 0.00 178.83 178.00