#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z4i s ALA 35 N 0.00 3.43 0.13 5.13 0.00 -1.26 -4.99 121.76 124.20 1z4i s ALA 35 Ca 0.00 0.96 -0.31 0.00 0.00 0.00 0.00 51.96 52.61 1z4i s ALA 35 Cb 0.00 -3.40 -0.07 0.00 0.00 0.00 0.00 23.12 19.65 1z4i s ALA 35 CO 0.00 -0.34 1.27 -1.17 0.00 0.00 0.00 175.76 175.51 1z4i s LEU 36 N -0.59 4.40 -0.17 0.00 2.96 0.17 -4.87 118.68 120.57 1z4i s LEU 36 Ca 0.51 2.22 -0.02 0.00 -0.22 0.00 0.00 54.13 56.62 1z4i s LEU 36 Cb -0.33 -3.59 -0.01 0.00 0.50 0.00 0.00 46.19 42.76 1z4i s LEU 36 CO 0.39 -0.50 -0.10 -0.60 -1.32 0.00 0.00 176.35 174.21 1z4i s ARG 37 N 0.56 3.36 -0.11 1.98 3.52 -1.26 -0.77 118.95 126.22 1z4i s ARG 37 Ca 0.58 -0.67 0.02 0.00 -0.13 0.00 0.00 55.73 55.53 1z4i s ARG 37 Cb -0.33 -2.78 0.01 0.00 -1.56 0.00 0.00 34.95 30.29 1z4i s ARG 37 CO 0.33 0.02 -0.16 0.08 -0.81 0.00 0.00 175.30 174.76 1z4i s VAL 38 N 0.86 1.55 -0.20 7.11 1.01 -0.26 -0.94 120.40 129.53 1z4i s VAL 38 Ca -0.03 -0.67 -0.14 0.00 0.00 0.00 0.00 61.98 61.15 1z4i s VAL 38 Cb -0.15 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 1z4i s VAL 38 CO 0.00 0.45 0.29 -0.76 0.00 0.00 0.00 175.10 175.09 1z4i s LEU 39 N 1.02 4.17 -0.20 3.92 1.43 0.21 -1.30 118.68 127.92 1z4i s LEU 39 Ca -0.06 0.38 -0.02 0.00 -1.03 0.00 0.00 54.13 53.41 1z4i s LEU 39 Cb -0.15 -2.34 -0.00 0.00 0.03 0.00 0.00 46.19 43.73 1z4i s LEU 39 CO -0.02 0.02 -0.10 -0.69 0.23 0.00 0.00 176.35 175.79 1z4i s VAL 40 N 0.98 2.95 0.77 -1.59 1.01 0.42 -0.86 120.40 124.09 1z4i s VAL 40 Ca 0.15 -0.64 -0.12 0.00 0.00 0.00 0.00 61.98 61.36 1z4i s VAL 40 Cb -0.14 -2.31 0.06 0.00 0.00 0.00 0.00 36.38 33.99 1z4i s VAL 40 CO 0.05 0.46 1.13 0.21 0.00 0.00 0.00 175.10 176.96 1z4i s ASN 41 N 1.36 4.25 -0.01 3.32 3.04 -0.42 -1.36 114.94 125.12 1z4i s ASN 41 Ca 0.05 2.05 -0.01 0.00 0.04 0.00 0.00 52.86 54.99 1z4i s ASN 41 Cb -0.14 -2.55 -0.00 0.00 -1.54 0.00 0.00 41.25 37.01 1z4i s ASN 41 CO -0.06 -2.21 -0.02 0.80 -3.04 0.00 0.00 177.10 172.57 1z4i n MET 42 N -3.23 0.04 -2.27 0.43 0.00 -1.24 -3.58 117.12 107.27 1z4i n MET 42 Ca 0.11 0.12 -0.42 0.00 -0.00 0.00 0.00 57.70 57.50 1z4i n MET 42 Cb 0.52 -0.67 -0.03 0.00 0.00 0.00 0.00 33.22 33.04 1z4i n MET 42 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1z4i s ASP 43 N -3.95 6.92 0.00 6.12 1.01 -1.26 -0.42 116.67 125.08 1z4i s ASP 43 Ca -0.02 2.17 0.00 0.00 0.71 0.00 0.00 52.55 55.42 1z4i s ASP 43 Cb 0.00 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 41.35 1z4i s ASP 43 CO 0.03 -0.60 0.00 0.61 0.21 0.00 0.00 175.17 175.41 1z4i n GLY 44 N 3.43 1.20 1.44 0.21 0.00 -0.17 -4.78 105.19 106.53 1z4i n GLY 44 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1z4i n GLY 44 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1z4i n VAL 45 N -2.00 0.46 -0.06 1.61 0.31 -0.90 -4.73 118.33 113.02 1z4i n VAL 45 Ca 0.00 0.15 -0.22 0.00 -0.01 0.00 0.00 64.34 64.27 1z4i n VAL 45 Cb 0.00 -1.11 -0.13 0.00 -0.91 0.00 0.00 33.84 31.69 1z4i n VAL 45 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1z4i n LEU 46 N -3.25 2.45 -4.57 7.52 4.77 0.44 -4.69 117.00 119.67 1z4i n LEU 46 Ca 0.00 0.22 -0.34 0.00 -0.03 0.00 0.00 56.01 55.86 1z4i n LEU 46 Cb 0.10 -1.02 -0.11 0.00 -2.33 0.00 0.00 43.42 40.06 1z4i n LEU 46 CO 0.00 0.70 -0.35 0.00 -1.33 0.00 0.00 177.39 176.42 1z4i s ALA 47 N -2.50 3.07 -1.33 -1.18 0.00 -0.24 -0.85 121.76 118.73 1z4i s ALA 47 Ca -0.28 -0.83 -0.15 0.00 0.00 0.00 0.00 51.96 50.70 1z4i s ALA 47 Cb 0.08 -1.46 0.08 0.00 0.00 0.00 0.00 23.12 21.82 1z4i s ALA 47 CO 0.67 0.39 1.85 -3.47 0.00 0.00 0.00 175.76 175.21 1z4i n ASP 48 N 2.86 4.69 -0.16 0.00 2.03 0.19 -1.00 116.55 125.17 1z4i n ASP 48 Ca -0.18 -2.92 -0.08 0.00 0.52 0.00 0.00 54.79 52.13 1z4i n ASP 48 Cb 0.53 -1.67 0.01 0.00 -0.72 0.00 0.00 41.12 39.26 1z4i n ASP 48 CO 0.00 0.00 0.00 0.15 -1.92 0.00 0.00 177.20 175.43 1z4i h PHE 49 N 6.89 0.63 -0.21 -0.67 3.04 -1.92 -2.07 116.94 122.62 1z4i h PHE 49 Ca 0.46 -0.01 -0.02 0.00 3.98 0.00 0.00 57.97 62.38 1z4i h PHE 49 Cb 0.78 -0.20 -0.01 0.00 2.56 0.00 0.00 35.95 39.08 1z4i h PHE 49 CO 1.38 0.47 0.07 0.93 -2.02 0.00 0.00 178.31 179.13 1z4i h GLU 50 N 0.60 0.32 -0.40 1.11 4.39 -1.99 -0.19 114.58 118.43 1z4i h GLU 50 Ca 0.16 -0.07 -0.14 0.00 0.34 0.00 0.00 59.36 59.65 1z4i h GLU 50 Cb 0.05 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 1z4i h GLU 50 CO -0.03 0.42 -0.32 0.78 -1.16 0.00 0.00 179.01 178.70 1z4i h GLY 51 N 0.17 0.96 0.96 -3.84 0.00 -1.97 -1.48 103.07 97.87 1z4i h GLY 51 Ca 0.07 -0.92 -0.10 0.00 0.00 0.00 0.00 47.33 46.38 1z4i h GLY 51 CO -0.00 0.83 -0.18 -1.33 0.00 0.00 0.00 176.54 175.86 1z4i h GLY 52 N 0.87 0.78 0.90 4.60 0.00 -1.25 -2.12 103.07 106.85 1z4i h GLY 52 Ca 0.08 -0.71 -0.00 0.00 0.00 0.00 0.00 47.33 46.69 1z4i h GLY 52 CO 0.08 0.65 -0.03 -2.75 0.00 0.00 0.00 176.54 174.49 1z4i h PHE 53 N 0.49 -0.08 -0.62 5.60 3.57 -0.98 -2.02 116.94 122.90 1z4i h PHE 53 Ca 0.07 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.58 1z4i h PHE 53 Cb 0.72 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.46 1z4i h PHE 53 CO 0.06 0.05 0.41 1.25 -2.23 0.00 0.00 178.31 177.85 1z4i h LEU 54 N -0.18 0.70 -0.05 0.59 5.85 -1.22 0.23 115.31 121.23 1z4i h LEU 54 Ca -0.01 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.71 1z4i h LEU 54 Cb 0.16 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1z4i h LEU 54 CO 0.01 0.51 -0.06 -0.09 -0.34 0.00 0.00 178.44 178.47 1z4i h ARG 55 N 0.83 -0.09 -0.16 1.25 2.43 -1.36 -1.58 114.38 115.71 1z4i h ARG 55 Ca 0.23 0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.29 1z4i h ARG 55 Cb -0.09 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 1z4i h ARG 55 CO -0.05 -0.06 -0.41 0.87 -1.51 0.00 0.00 179.97 178.80 1z4i h LYS 56 N -0.09 0.38 0.03 0.20 1.57 -0.96 -1.94 116.57 115.75 1z4i h LYS 56 Ca 0.04 -0.19 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1z4i h LYS 56 Cb 0.15 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1z4i h LYS 56 CO -0.10 0.73 -0.01 0.35 -0.57 0.00 0.00 179.45 179.84 1z4i h PHE 57 N 0.31 -0.03 -0.54 -1.35 3.04 -0.39 -1.78 116.94 116.21 1z4i h PHE 57 Ca 0.03 -0.00 0.03 0.00 3.98 0.00 0.00 57.97 62.01 1z4i h PHE 57 Cb 0.86 0.01 -0.04 0.00 2.56 0.00 0.00 35.95 39.35 1z4i h PHE 57 CO 0.02 0.16 0.31 0.00 -2.02 0.00 0.00 178.31 176.79 1z4i h ARG 58 N -0.22 0.60 -0.45 1.11 3.08 -1.25 0.17 114.38 117.43 1z4i h ARG 58 Ca -0.00 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 59.94 1z4i h ARG 58 Cb 0.21 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 1z4i h ARG 58 CO 0.01 0.40 -0.00 0.00 -1.07 0.00 0.00 179.97 179.30 1z4i h ALA 59 N 1.25 1.16 0.09 0.04 0.00 -1.30 -2.47 119.26 118.03 1z4i h ALA 59 Ca 0.22 -0.25 -0.28 0.00 0.00 0.00 0.00 54.91 54.60 1z4i h ALA 59 Cb 0.05 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1z4i h ALA 59 CO -0.11 0.54 -1.42 -0.09 0.00 0.00 0.00 179.25 178.18 1z4i h ARG 60 N 0.68 0.18 -2.19 0.00 2.43 -0.92 -3.38 114.38 111.19 1z4i h ARG 60 Ca 0.14 -0.31 -0.56 0.00 -0.81 0.00 0.00 59.98 58.44 1z4i h ARG 60 Cb 0.43 0.12 -0.41 0.00 -0.42 0.00 0.00 29.97 29.68 1z4i h ARG 60 CO 0.02 1.04 -0.81 1.19 -1.51 0.00 0.00 179.97 179.90 1z4i n PHE 61 N -3.40 2.80 0.22 2.20 3.72 0.58 -4.94 117.46 118.63 1z4i n PHE 61 Ca -0.13 -3.95 0.03 0.00 -0.05 0.00 0.00 57.45 53.36 1z4i n PHE 61 Cb 1.02 -0.47 0.13 0.00 -0.94 0.00 0.00 39.48 39.22 1z4i n PHE 61 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1z4i n PRO 62 N 0.04 0.04 -0.10 -1.08 -0.04 -0.93 -1.84 135.00 131.09 1z4i n PRO 62 Ca 0.29 0.32 0.05 0.00 -0.04 0.00 0.00 63.50 64.12 1z4i n PRO 62 Cb 0.47 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.53 1z4i n PRO 62 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1z4i n ASP 63 N -1.40 2.45 -4.94 3.54 8.00 -1.26 -4.96 116.55 117.98 1z4i n ASP 63 Ca 0.02 -1.78 -0.26 0.00 0.71 0.00 0.00 54.79 53.48 1z4i n ASP 63 Cb 0.05 -0.13 -0.03 0.00 -0.02 0.00 0.00 41.12 41.00 1z4i n ASP 63 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1z4i s GLN 64 N -0.93 3.48 0.72 -1.24 -1.52 -0.76 -5.10 119.66 114.30 1z4i s GLN 64 Ca 0.17 -0.48 -0.11 0.00 -1.95 0.00 0.00 55.36 52.99 1z4i s GLN 64 Cb 0.10 -2.88 0.02 0.00 -0.22 0.00 0.00 33.01 30.02 1z4i s GLN 64 CO 0.13 0.44 1.07 -1.25 -0.25 0.00 0.00 175.29 175.43 1z4i s PRO 65 N -3.40 2.78 0.26 2.91 0.04 -1.26 -5.06 135.00 131.26 1z4i s PRO 65 Ca 0.37 0.78 -0.02 0.00 0.04 0.00 0.00 61.00 62.17 1z4i s PRO 65 Cb -0.11 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.42 1z4i s PRO 65 CO 0.29 -1.17 0.28 -0.59 0.04 0.00 0.00 177.00 175.86 1z4i s PHE 66 N -3.13 1.09 -0.30 0.56 -0.12 -1.26 -5.09 117.98 109.72 1z4i s PHE 66 Ca 0.58 -1.28 -0.06 0.00 -0.05 0.00 0.00 56.93 56.12 1z4i s PHE 66 Cb -0.13 -0.36 0.02 0.00 -0.63 0.00 0.00 43.02 41.92 1z4i s PHE 66 CO 0.54 -0.83 0.07 0.42 -0.05 0.00 0.00 175.22 175.37 1z4i s ILE 67 N -3.83 3.76 0.61 -4.49 -1.09 -1.26 -5.08 121.20 109.82 1z4i s ILE 67 Ca 0.35 -0.88 -0.19 0.00 -2.23 0.00 0.00 60.65 57.69 1z4i s ILE 67 Cb 0.03 -3.00 -0.03 0.00 -1.58 0.00 0.00 42.46 37.89 1z4i s ILE 67 CO 0.15 0.01 1.32 0.00 -1.23 0.00 0.00 174.94 175.20 1z4i n ALA 68 N 4.82 1.34 -0.35 9.38 0.00 -1.26 -4.82 120.51 129.62 1z4i n ALA 68 Ca -0.14 0.05 0.05 0.00 0.00 0.00 0.00 53.44 53.40 1z4i n ALA 68 Cb 0.47 -2.34 0.22 0.00 0.00 0.00 0.00 19.45 17.80 1z4i n ALA 68 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1z4i h LEU 69 N 0.88 0.96 -2.20 0.00 3.38 -1.98 -0.10 115.31 116.26 1z4i h LEU 69 Ca -0.51 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.47 1z4i h LEU 69 Cb 1.33 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 1z4i h LEU 69 CO 0.55 0.57 -0.06 -0.33 0.09 0.00 0.00 178.44 179.25 1z4i h GLU 70 N 1.06 0.00 -0.01 1.13 5.08 -1.93 -1.69 114.58 118.22 1z4i h GLU 70 Ca 0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.82 1z4i h GLU 70 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1z4i h GLU 70 CO -0.21 0.06 -0.30 -0.25 -1.00 0.00 0.00 179.01 177.31 1z4i n ASP 71 N -3.66 1.32 -4.75 1.42 8.00 -0.09 -4.95 116.55 113.85 1z4i n ASP 71 Ca -0.02 -1.08 -0.41 0.00 0.71 0.00 0.00 54.79 53.98 1z4i n ASP 71 Cb 0.17 0.21 -0.02 0.00 -0.02 0.00 0.00 41.12 41.46 1z4i n ASP 71 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1z4i s ARG 72 N -2.47 4.20 -0.04 -1.24 1.81 -0.64 -4.92 118.95 115.66 1z4i s ARG 72 Ca 0.23 2.42 -0.02 0.00 -1.72 0.00 0.00 55.73 56.64 1z4i s ARG 72 Cb 0.19 -3.07 0.02 0.00 -0.45 0.00 0.00 34.95 31.64 1z4i s ARG 72 CO 0.52 -0.51 0.08 1.03 -0.68 0.00 0.00 175.30 175.74 1z4i s ARG 73 N -0.41 0.06 0.00 3.54 1.81 -1.26 -3.98 118.95 118.71 1z4i s ARG 73 Ca 0.61 0.19 0.00 0.00 -1.72 0.00 0.00 55.73 54.82 1z4i s ARG 73 Cb -0.44 -0.08 0.00 0.00 -0.45 0.00 0.00 34.95 33.97 1z4i s ARG 73 CO 0.45 -0.09 0.00 0.41 -0.68 0.00 0.00 175.30 175.39 1z4i n GLY 74 N 3.62 -2.15 0.28 -3.53 0.00 -0.95 -4.78 105.19 97.67 1z4i n GLY 74 Ca -0.20 -1.28 0.04 0.00 0.00 0.00 0.00 46.02 44.58 1z4i n GLY 74 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1z4i h PHE 75 N 0.00 0.59 -1.96 1.61 3.57 -1.94 -3.40 116.94 115.41 1z4i h PHE 75 Ca 0.00 0.03 -0.59 0.00 3.53 0.00 0.00 57.97 60.94 1z4i h PHE 75 Cb 0.00 -0.15 -0.11 0.00 2.79 0.00 0.00 35.95 38.48 1z4i h PHE 75 CO 0.00 0.15 1.12 -1.58 -2.23 0.00 0.00 178.31 175.76 1z4i s TRP 76 N -6.03 2.52 0.21 0.41 0.52 -1.26 -4.87 118.94 110.44 1z4i s TRP 76 Ca -0.12 -0.55 -0.10 0.00 0.02 0.00 0.00 56.10 55.34 1z4i s TRP 76 Cb 0.19 -4.57 0.30 0.00 -1.15 0.00 0.00 33.47 28.25 1z4i s TRP 76 CO 0.76 -1.90 1.67 0.28 0.02 0.00 0.00 176.95 177.78 1z4i h VAL 77 N 6.27 0.50 -0.74 4.03 2.07 -1.92 -2.49 116.25 123.98 1z4i h VAL 77 Ca -0.06 -0.05 -0.03 0.00 0.82 0.00 0.00 66.70 67.38 1z4i h VAL 77 Cb 1.04 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 1z4i h VAL 77 CO 1.30 0.02 0.34 0.77 0.02 0.00 0.00 177.57 180.02 1z4i h SER 78 N 0.13 0.98 -0.43 0.57 4.64 -1.91 -1.27 113.55 116.27 1z4i h SER 78 Ca 0.33 -0.12 -0.10 0.00 -0.47 0.00 0.00 61.79 61.43 1z4i h SER 78 Cb 0.53 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 1z4i h SER 78 CO -0.52 0.84 -0.10 -0.33 -0.87 0.00 0.00 176.83 175.85 1z4i h GLU 79 N 1.06 0.83 -0.60 4.77 5.08 -1.84 -0.51 114.58 123.37 1z4i h GLU 79 Ca 0.26 -0.32 -0.08 0.00 -1.00 0.00 0.00 59.36 58.22 1z4i h GLU 79 Cb 0.14 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1z4i h GLU 79 CO -0.03 0.94 0.06 0.37 -1.00 0.00 0.00 179.01 179.36 1z4i h GLN 80 N 0.66 0.99 -0.28 2.33 4.15 -1.22 -1.53 115.11 120.20 1z4i h GLN 80 Ca 0.11 -0.27 -0.12 0.00 0.77 0.00 0.00 58.65 59.14 1z4i h GLN 80 Cb 0.64 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 28.20 1z4i h GLN 80 CO 0.04 0.94 -0.32 1.88 -1.93 0.00 0.00 178.83 179.44 1z4i h TYR 81 N 0.93 0.70 -0.75 3.99 0.05 -1.12 -2.51 116.97 118.26 1z4i h TYR 81 Ca 0.18 -0.18 -0.03 0.00 0.05 0.00 0.00 58.73 58.76 1z4i h TYR 81 Cb 0.45 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 38.00 1z4i h TYR 81 CO 0.03 0.85 0.36 0.78 -1.05 0.00 0.00 178.16 179.13 1z4i h GLY 82 N 1.02 1.16 2.00 3.88 0.00 -0.75 -2.06 103.07 108.32 1z4i h GLY 82 Ca 0.06 -0.58 -0.05 0.00 0.00 0.00 0.00 47.33 46.76 1z4i h GLY 82 CO 0.07 0.55 -0.25 3.21 0.00 0.00 0.00 176.54 180.11 1z4i h ARG 83 N 1.06 0.00 -0.00 4.80 3.08 -1.20 -3.10 114.38 119.01 1z4i h ARG 83 Ca 0.26 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 60.16 1z4i h ARG 83 Cb 0.12 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 1z4i h ARG 83 CO -0.03 0.25 -0.69 1.25 -1.07 0.00 0.00 179.97 179.68 1z4i h LEU 84 N 0.00 0.02 0.00 3.04 5.85 -0.91 -3.47 115.31 119.84 1z4i h LEU 84 Ca -0.00 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1z4i h LEU 84 Cb 0.66 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.68 1z4i h LEU 84 CO 0.03 0.70 0.00 -1.14 -0.34 0.00 0.00 178.44 177.70 1z4i n ARG 85 N -3.73 0.00 -1.77 1.25 3.00 -1.11 -5.09 116.66 109.21 1z4i n ARG 85 Ca -0.01 0.00 -0.39 0.00 -0.00 0.00 0.00 57.85 57.45 1z4i n ARG 85 Cb 0.67 0.00 0.04 0.00 0.00 0.00 0.00 32.46 33.17 1z4i n ARG 85 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.63 175.49 1z4i s PRO 86 N -0.08 3.22 0.00 -0.14 0.02 -1.26 -2.30 135.00 134.46 1z4i s PRO 86 Ca 0.00 2.28 0.00 0.00 0.02 0.00 0.00 61.00 63.30 1z4i s PRO 86 Cb 0.00 -2.32 0.00 0.00 0.02 0.00 0.00 34.50 32.20 1z4i s PRO 86 CO 0.00 -1.15 0.00 0.41 -0.33 0.00 0.00 177.00 175.93 1z4i n GLY 87 N 0.70 2.61 0.15 0.52 0.00 -1.26 -4.92 105.19 102.99 1z4i n GLY 87 Ca 0.10 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.04 1z4i n GLY 87 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1z4i h LEU 88 N 0.00 0.32 -0.67 0.99 5.85 -1.71 -2.52 115.31 117.57 1z4i h LEU 88 Ca 0.00 -0.23 0.14 0.00 0.84 0.00 0.00 57.88 58.63 1z4i h LEU 88 Cb 0.00 -0.10 -0.10 0.00 0.37 0.00 0.00 40.66 40.83 1z4i h LEU 88 CO 0.00 0.97 0.12 -1.28 -0.34 0.00 0.00 178.44 177.91 1z4i h SER 89 N 0.17 -0.06 0.19 1.25 0.87 -1.77 -0.72 113.55 113.48 1z4i h SER 89 Ca -0.03 0.14 -0.21 0.00 -1.23 0.00 0.00 61.79 60.46 1z4i h SER 89 Cb 1.34 0.20 0.00 0.00 -0.44 0.00 0.00 62.40 63.51 1z4i h SER 89 CO 0.12 -0.04 -0.83 -0.33 -0.53 0.00 0.00 176.83 175.21 1z4i h GLU 90 N 0.23 0.50 -0.62 2.24 3.07 -1.88 -1.33 114.58 116.80 1z4i h GLU 90 Ca 0.37 -0.46 -0.08 0.00 -0.50 0.00 0.00 59.36 58.69 1z4i h GLU 90 Cb 0.60 0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.60 1z4i h GLU 90 CO -0.49 1.10 0.09 0.87 -1.40 0.00 0.00 179.01 179.18 1z4i h LYS 91 N 0.32 1.03 -0.18 2.33 1.57 -1.23 -2.21 116.57 118.20 1z4i h LYS 91 Ca -0.06 -0.28 0.02 0.00 -1.87 0.00 0.00 60.65 58.46 1z4i h LYS 91 Cb 1.45 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.62 1z4i h LYS 91 CO 0.15 0.97 0.04 0.00 -0.57 0.00 0.00 179.45 180.04 1z4i h ALA 92 N 1.02 0.18 -0.79 3.86 0.00 -0.84 -2.50 119.26 120.19 1z4i h ALA 92 Ca 0.19 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1z4i h ALA 92 Cb 0.45 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1z4i h ALA 92 CO 0.01 -0.40 0.51 0.82 0.00 0.00 0.00 179.25 180.20 1z4i h ILE 93 N 0.11 1.21 0.00 0.00 2.04 -1.15 -1.63 117.51 118.09 1z4i h ILE 93 Ca 0.08 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 1z4i h ILE 93 Cb 0.07 0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.21 1z4i h ILE 93 CO -0.10 0.20 -0.04 0.77 0.00 0.00 0.00 178.15 178.98 1z4i h SER 94 N 1.07 0.00 0.34 1.72 4.64 -0.94 -1.49 113.55 118.89 1z4i h SER 94 Ca 0.29 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.59 1z4i h SER 94 Cb -0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 61.99 1z4i h SER 94 CO -0.06 0.04 -0.16 0.40 -0.87 0.00 0.00 176.83 176.18 1z4i h ILE 95 N 0.00 0.60 0.00 0.95 1.08 -1.16 -3.02 117.51 115.96 1z4i h ILE 95 Ca -0.00 -0.63 0.00 0.00 -0.39 0.00 0.00 64.86 63.84 1z4i h ILE 95 Cb 0.28 0.88 0.00 0.00 -3.07 0.00 0.00 36.82 34.91 1z4i h ILE 95 CO 0.01 0.11 0.00 -2.67 -0.69 0.00 0.00 178.15 174.90 1z4i n TRP 96 N -5.14 0.54 0.89 1.37 2.14 -1.06 -2.41 117.44 113.78 1z4i n TRP 96 Ca -0.09 0.17 0.13 0.00 2.07 0.00 0.00 57.50 59.77 1z4i n TRP 96 Cb 0.27 -0.77 0.55 0.00 -0.81 0.00 0.00 31.31 30.55 1z4i n TRP 96 CO 0.00 0.00 0.00 0.39 2.07 0.00 0.00 177.69 180.15 1z4i n GLU 97 N -1.95 0.01 -2.85 -2.67 1.02 -0.59 -4.80 120.64 108.82 1z4i n GLU 97 Ca 0.05 0.06 -0.35 0.00 -0.02 0.00 0.00 57.16 56.90 1z4i n GLU 97 Cb 0.34 -1.51 -0.07 0.00 -0.02 0.00 0.00 31.44 30.19 1z4i n GLU 97 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1z4i s SER 98 N -3.06 7.13 0.40 1.62 0.01 -1.01 -4.93 113.70 113.86 1z4i s SER 98 Ca 0.13 1.71 -0.25 0.00 1.31 0.00 0.00 55.95 58.84 1z4i s SER 98 Cb 0.17 -2.54 -0.11 0.00 0.21 0.00 0.00 66.02 63.76 1z4i s SER 98 CO 0.48 -0.18 1.15 1.17 0.41 0.00 0.00 173.24 176.27 1z4i n LYS 99 N 0.05 1.67 -0.78 12.44 4.81 -1.26 -2.54 118.16 132.55 1z4i n LYS 99 Ca 0.04 0.60 0.00 0.00 -0.87 0.00 0.00 58.31 58.07 1z4i n LYS 99 Cb 0.52 -2.20 0.00 0.00 0.02 0.00 0.00 35.03 33.36 1z4i n LYS 99 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1z4i n ASN 100 N 0.44 0.00 0.26 3.14 3.02 -1.26 -4.91 115.26 115.96 1z4i n ASN 100 Ca 0.08 0.00 -0.16 0.00 -0.03 0.00 0.00 54.58 54.47 1z4i n ASN 100 Cb 0.38 -0.94 -0.08 0.00 -0.61 0.00 0.00 39.78 38.53 1z4i n ASN 100 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 1z4i h PHE 101 N 0.00 -0.60 -0.35 3.10 3.57 -1.79 -1.84 116.94 119.03 1z4i h PHE 101 Ca 0.00 -0.01 -0.16 0.00 3.53 0.00 0.00 57.97 61.33 1z4i h PHE 101 Cb 0.00 0.20 -0.00 0.00 2.79 0.00 0.00 35.95 38.94 1z4i h PHE 101 CO 0.00 -0.37 -0.41 0.74 -2.23 0.00 0.00 178.31 176.04 1z4i h PHE 102 N -0.63 1.09 -0.77 0.41 0.04 -1.87 -3.12 116.94 112.09 1z4i h PHE 102 Ca -0.06 -0.34 0.01 0.00 2.80 0.00 0.00 57.97 60.38 1z4i h PHE 102 Cb 0.49 -0.22 -0.04 0.00 2.20 0.00 0.00 35.95 38.38 1z4i h PHE 102 CO -0.06 1.16 0.51 0.35 -0.60 0.00 0.00 178.31 179.68 1z4i h PHE 103 N 0.71 0.97 -0.09 -0.55 3.57 -1.77 -2.64 116.94 117.14 1z4i h PHE 103 Ca 0.05 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1z4i h PHE 103 Cb 1.00 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 39.41 1z4i h PHE 103 CO 0.07 0.61 0.00 0.39 -2.23 0.00 0.00 178.31 177.15 1z4i n GLU 104 N -4.42 1.74 -1.75 1.11 1.02 -0.70 -4.86 120.64 112.79 1z4i n GLU 104 Ca 0.09 -1.10 -0.42 0.00 -0.02 0.00 0.00 57.16 55.71 1z4i n GLU 104 Cb 0.03 -1.45 -0.01 0.00 -0.02 0.00 0.00 31.44 30.00 1z4i n GLU 104 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1z4i n LEU 105 N 0.32 4.48 -4.78 -4.62 4.77 -1.00 -4.99 117.00 111.19 1z4i n LEU 105 Ca 0.18 1.17 -0.37 0.00 -0.03 0.00 0.00 56.01 56.96 1z4i n LEU 105 Cb 0.36 -1.60 -0.06 0.00 -2.33 0.00 0.00 43.42 39.79 1z4i n LEU 105 CO 0.15 0.15 0.67 -1.61 -1.33 0.00 0.00 177.39 175.42 1z4i s GLU 106 N -1.01 4.54 0.51 3.23 2.02 -1.26 -4.83 118.70 121.89 1z4i s GLU 106 Ca 0.61 1.38 -0.22 0.00 0.02 0.00 0.00 54.97 56.75 1z4i s GLU 106 Cb -0.49 -2.80 -0.06 0.00 0.10 0.00 0.00 34.13 30.89 1z4i s GLU 106 CO 0.53 0.22 1.31 -2.14 0.02 0.00 0.00 175.26 175.21 1z4i s PRO 107 N -2.06 3.38 0.57 0.39 0.02 -1.26 -0.64 135.00 135.40 1z4i s PRO 107 Ca 0.51 2.13 -0.18 0.00 0.02 0.00 0.00 61.00 63.47 1z4i s PRO 107 Cb -0.20 -2.35 -0.04 0.00 0.02 0.00 0.00 34.50 31.93 1z4i s PRO 107 CO 0.25 -0.97 1.09 -0.51 -0.33 0.00 0.00 177.00 176.54 1z4i s LEU 108 N -3.29 3.63 0.13 -5.54 1.43 -0.03 -4.69 118.68 110.33 1z4i s LEU 108 Ca 0.68 2.02 -0.35 0.00 -1.03 0.00 0.00 54.13 55.45 1z4i s LEU 108 Cb -0.37 -4.56 -0.15 0.00 0.03 0.00 0.00 46.19 41.13 1z4i s LEU 108 CO 0.45 -1.23 1.47 -2.65 0.23 0.00 0.00 176.35 174.62 1z4i n PRO 109 N -1.65 1.70 -0.32 1.29 -0.02 -1.26 -1.79 135.00 132.95 1z4i n PRO 109 Ca 0.10 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 1z4i n PRO 109 Cb 0.52 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 1z4i n PRO 109 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1z4i n GLY 110 N 2.98 1.83 0.07 -1.23 0.00 -1.26 -4.42 105.19 103.16 1z4i n GLY 110 Ca 0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.07 1z4i n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z4i h ALA 111 N 0.00 0.07 -0.18 4.61 0.00 -1.68 -1.08 119.26 121.00 1z4i h ALA 111 Ca 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 1z4i h ALA 111 Cb 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1z4i h ALA 111 CO 0.00 -0.25 -0.05 0.28 0.00 0.00 0.00 179.25 179.23 1z4i h VAL 112 N -0.23 1.29 -0.51 0.00 2.07 -1.90 -1.40 116.25 115.58 1z4i h VAL 112 Ca 0.01 -1.03 0.07 0.00 0.82 0.00 0.00 66.70 66.56 1z4i h VAL 112 Cb 0.36 1.61 -0.06 0.00 -1.52 0.00 0.00 31.29 31.68 1z4i h VAL 112 CO 0.00 0.31 0.20 -0.08 0.02 0.00 0.00 177.57 178.02 1z4i h GLU 113 N 0.05 0.38 -0.39 1.57 4.81 -1.95 -1.43 114.58 117.62 1z4i h GLU 113 Ca 0.04 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.18 1z4i h GLU 113 Cb 0.50 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 1z4i h GLU 113 CO 0.02 0.25 -0.03 0.00 -0.73 0.00 0.00 179.01 178.52 1z4i h ALA 114 N 1.33 0.53 -0.44 2.92 0.00 -1.05 -1.54 119.26 121.00 1z4i h ALA 114 Ca 0.24 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 1z4i h ALA 114 Cb 0.24 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1z4i h ALA 114 CO -0.23 0.33 -0.24 0.28 0.00 0.00 0.00 179.25 179.40 1z4i h VAL 115 N 0.52 1.27 -0.51 0.00 2.07 -1.13 0.18 116.25 118.66 1z4i h VAL 115 Ca 0.11 -1.38 0.00 0.00 0.82 0.00 0.00 66.70 66.24 1z4i h VAL 115 Cb 0.52 1.18 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 1z4i h VAL 115 CO 0.03 0.47 0.33 0.11 0.02 0.00 0.00 177.57 178.52 1z4i h LYS 116 N 0.78 0.67 -0.38 1.57 1.57 -1.20 -0.37 116.57 119.21 1z4i h LYS 116 Ca 0.10 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1z4i h LYS 116 Cb 0.79 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.94 1z4i h LYS 116 CO 0.07 0.46 0.12 1.49 -0.57 0.00 0.00 179.45 181.01 1z4i h GLU 117 N 0.68 0.58 -0.34 3.15 4.81 -1.03 -2.55 114.58 119.88 1z4i h GLU 117 Ca 0.18 -0.13 0.04 0.00 -0.13 0.00 0.00 59.36 59.33 1z4i h GLU 117 Cb -0.06 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.20 1z4i h GLU 117 CO -0.04 0.59 0.12 1.98 -0.73 0.00 0.00 179.01 180.93 1z4i h MET 118 N 0.46 0.25 -0.04 1.92 4.05 -0.37 -2.22 114.93 118.98 1z4i h MET 118 Ca 0.12 -0.02 -0.06 0.00 -0.28 0.00 0.00 59.70 59.47 1z4i h MET 118 Cb 0.25 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 30.99 1z4i h MET 118 CO -0.00 0.17 -0.24 0.00 0.23 0.00 0.00 176.91 177.06 1z4i h ALA 119 N 1.22 1.51 0.00 0.39 0.00 -1.00 -2.60 119.26 118.79 1z4i h ALA 119 Ca 0.16 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1z4i h ALA 119 Cb 0.13 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1z4i h ALA 119 CO -0.16 0.36 0.00 -1.13 0.00 0.00 0.00 179.25 178.31 1z4i n SER 120 N -4.22 0.50 -4.76 0.00 3.41 -0.87 -4.84 113.62 102.84 1z4i n SER 120 Ca -0.02 0.56 -0.37 0.00 -0.26 0.00 0.00 58.87 58.79 1z4i n SER 120 Cb 0.32 -0.69 0.01 0.00 -0.26 0.00 0.00 64.21 63.58 1z4i n SER 120 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1z4i s LEU 121 N -3.98 3.89 0.41 1.04 1.43 -0.98 -4.96 118.68 115.53 1z4i s LEU 121 Ca 0.10 2.43 -0.25 0.00 -1.03 0.00 0.00 54.13 55.37 1z4i s LEU 121 Cb 0.13 -4.33 -0.08 0.00 0.03 0.00 0.00 46.19 41.94 1z4i s LEU 121 CO 0.52 -1.22 1.26 -1.10 0.23 0.00 0.00 176.35 176.04 1z4i s GLN 122 N -2.90 3.94 -1.45 1.70 -1.52 -1.26 -3.16 119.66 115.01 1z4i s GLN 122 Ca 0.69 2.04 -0.09 0.00 -1.95 0.00 0.00 55.36 56.05 1z4i s GLN 122 Cb -0.31 -2.69 0.03 0.00 -0.22 0.00 0.00 33.01 29.81 1z4i s GLN 122 CO 0.37 -0.48 0.92 0.09 -0.25 0.00 0.00 175.29 175.94 1z4i n ASN 123 N 0.02 -5.85 -3.64 5.90 3.02 -1.26 -4.94 115.26 108.51 1z4i n ASN 123 Ca 0.04 -0.49 -0.17 0.00 -0.03 0.00 0.00 54.58 53.93 1z4i n ASN 123 Cb 0.45 -4.66 -0.15 0.00 -0.61 0.00 0.00 39.78 34.80 1z4i n ASN 123 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1z4i s THR 124 N -3.24 -0.27 -0.18 3.41 2.01 -1.19 -0.66 115.64 115.52 1z4i s THR 124 Ca 0.50 0.27 -0.03 0.00 0.31 0.00 0.00 61.69 62.74 1z4i s THR 124 Cb -0.23 -0.37 -0.01 0.00 0.01 0.00 0.00 72.50 71.90 1z4i s THR 124 CO 0.62 0.08 -0.07 -1.81 -0.69 0.00 0.00 174.62 172.75 1z4i s ASP 125 N 2.30 4.31 -0.17 3.53 1.01 0.05 -4.73 116.67 122.98 1z4i s ASP 125 Ca 0.03 -0.31 -0.02 0.00 0.71 0.00 0.00 52.55 52.96 1z4i s ASP 125 Cb -0.13 -1.71 -0.01 0.00 1.01 0.00 0.00 42.92 42.08 1z4i s ASP 125 CO -0.07 0.08 -0.08 -0.69 0.21 0.00 0.00 175.17 174.62 1z4i s VAL 126 N 0.86 3.34 0.02 -1.27 1.01 -1.26 -1.10 120.40 122.00 1z4i s VAL 126 Ca -0.02 -0.54 0.06 0.00 0.00 0.00 0.00 61.98 61.49 1z4i s VAL 126 Cb -0.15 -2.46 -0.03 0.00 0.00 0.00 0.00 36.38 33.74 1z4i s VAL 126 CO 0.01 0.48 -0.17 -0.36 0.00 0.00 0.00 175.10 175.07 1z4i s PHE 127 N 0.76 2.60 -0.26 5.22 0.40 -0.42 -4.86 117.98 121.42 1z4i s PHE 127 Ca -0.03 -0.23 -0.14 0.00 -0.60 0.00 0.00 56.93 55.93 1z4i s PHE 127 Cb -0.15 -1.50 -0.04 0.00 0.51 0.00 0.00 43.02 41.84 1z4i s PHE 127 CO 0.02 0.25 0.32 0.42 0.70 0.00 0.00 175.22 176.93 1z4i s ILE 128 N -0.90 5.22 -0.23 0.64 1.01 0.12 -0.43 121.20 126.63 1z4i s ILE 128 Ca 0.14 0.47 0.00 0.00 0.00 0.00 0.00 60.65 61.27 1z4i s ILE 128 Cb -0.11 -3.65 0.03 0.00 0.01 0.00 0.00 42.46 38.74 1z4i s ILE 128 CO 0.05 0.20 -0.11 0.00 0.00 0.00 0.00 174.94 175.07 1z4i s THR 130 N 1.27 0.12 -0.28 0.00 -1.32 -0.66 -3.66 115.64 111.11 1z4i s THR 130 Ca -0.00 -0.48 -0.09 0.00 -1.21 0.00 0.00 61.69 59.90 1z4i s THR 130 Cb -0.16 -0.19 -0.03 0.00 -1.51 0.00 0.00 72.50 70.61 1z4i s THR 130 CO -0.07 -0.23 0.13 -0.44 -2.21 0.00 0.00 174.62 171.80 1z4i s SER 131 N -0.74 5.53 0.70 8.08 0.01 -1.23 -1.28 113.70 124.76 1z4i s SER 131 Ca -0.07 -0.25 -0.11 0.00 1.31 0.00 0.00 55.95 56.82 1z4i s SER 131 Cb -0.05 -2.01 0.01 0.00 0.21 0.00 0.00 66.02 64.18 1z4i s SER 131 CO -0.00 -0.09 1.06 -2.16 0.41 0.00 0.00 173.24 172.45 1z4i s PRO 132 N 1.66 2.93 1.00 12.44 0.04 -1.26 -4.99 135.00 146.81 1z4i s PRO 132 Ca 0.06 0.89 -0.15 0.00 0.04 0.00 0.00 61.00 61.84 1z4i s PRO 132 Cb -0.16 -1.99 0.19 0.00 0.04 0.00 0.00 34.50 32.57 1z4i s PRO 132 CO 0.07 -1.08 1.16 0.96 0.04 0.00 0.00 177.00 178.15 1z4i s ILE 133 N -3.08 1.90 0.18 0.56 -4.36 -1.26 -4.93 121.20 110.21 1z4i s ILE 133 Ca 0.58 0.00 -0.08 0.00 -0.26 0.00 0.00 60.65 60.89 1z4i s ILE 133 Cb -0.14 -2.72 0.03 0.00 1.25 0.00 0.00 42.46 40.89 1z4i s ILE 133 CO 0.55 0.00 1.60 0.11 0.24 0.00 0.00 174.94 177.43 1z4i h LYS 134 N -1.82 0.94 -6.15 0.37 1.57 -2.01 -3.40 116.57 106.06 1z4i h LYS 134 Ca -0.48 -0.37 -0.59 0.00 -1.87 0.00 0.00 60.65 57.34 1z4i h LYS 134 Cb 1.30 -0.05 -0.08 0.00 0.08 0.00 0.00 32.23 33.49 1z4i h LYS 134 CO 0.50 1.03 0.67 1.41 -0.57 0.00 0.00 179.45 182.50 1z4i s MET 135 N -4.71 3.92 0.00 3.15 1.75 -1.26 -4.92 119.30 117.23 1z4i s MET 135 Ca -0.11 0.74 0.13 0.00 -1.25 0.00 0.00 55.69 55.20 1z4i s MET 135 Cb 0.13 -3.78 0.36 0.00 2.84 0.00 0.00 34.83 34.38 1z4i s MET 135 CO 0.86 -0.93 1.29 1.97 -0.65 0.00 0.00 175.02 177.56 1z4i n PHE 136 N 6.80 0.53 -0.27 4.11 -1.74 -1.26 -4.49 117.46 121.14 1z4i n PHE 136 Ca 0.09 -0.46 -0.05 0.00 -0.56 0.00 0.00 57.45 56.47 1z4i n PHE 136 Cb 0.48 -0.02 0.06 0.00 1.52 0.00 0.00 39.48 41.52 1z4i n PHE 136 CO 0.00 0.00 0.00 -0.22 -0.56 0.00 0.00 176.76 175.98 1z4i h LYS 137 N 2.55 1.00 0.00 3.97 1.63 -1.96 -3.38 116.57 120.38 1z4i h LYS 137 Ca 0.00 -0.09 -0.10 0.00 -0.85 0.00 0.00 60.65 59.61 1z4i h LYS 137 Cb 0.77 -0.21 -0.02 0.00 -0.60 0.00 0.00 32.23 32.17 1z4i h LYS 137 CO 0.00 0.70 -1.37 0.66 -3.45 0.00 0.00 179.45 175.99 1z4i n TYR 138 N -4.52 0.00 0.16 1.91 4.01 -1.26 -4.83 117.16 112.63 1z4i n TYR 138 Ca 0.07 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.67 1z4i n TYR 138 Cb 0.05 -0.26 -0.08 0.00 -0.31 0.00 0.00 39.34 38.74 1z4i n TYR 138 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1z4i h PRO 140 N -0.62 -0.05 -0.32 0.00 0.11 -1.91 -0.79 132.00 128.42 1z4i h PRO 140 Ca -0.04 0.00 0.06 0.00 0.11 0.00 0.00 66.00 66.13 1z4i h PRO 140 Cb 0.45 0.01 -0.05 0.00 0.11 0.00 0.00 31.00 31.52 1z4i h PRO 140 CO 0.07 -0.03 -0.02 -0.92 -0.21 0.00 0.00 178.00 176.88 1z4i h TYR 141 N -0.05 -0.05 0.00 0.65 3.20 -1.83 -1.80 116.97 117.08 1z4i h TYR 141 Ca 0.13 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.95 1z4i h TYR 141 Cb 0.26 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 1z4i h TYR 141 CO -0.29 -0.08 -0.38 0.93 -1.64 0.00 0.00 178.16 176.70 1z4i h GLU 142 N 0.07 0.00 -0.19 1.82 5.08 -0.38 -1.28 114.58 119.70 1z4i h GLU 142 Ca 0.15 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.43 1z4i h GLU 142 Cb 0.21 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 1z4i h GLU 142 CO -0.27 0.38 -0.19 0.87 -1.00 0.00 0.00 179.01 178.80 1z4i h LYS 143 N 0.00 0.47 -0.46 2.33 1.57 -0.69 0.19 116.57 119.97 1z4i h LYS 143 Ca -0.00 -0.24 0.02 0.00 -1.87 0.00 0.00 60.65 58.55 1z4i h LYS 143 Cb 0.74 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.03 1z4i h LYS 143 CO 0.05 0.82 0.29 1.88 -0.57 0.00 0.00 179.45 181.91 1z4i h TYR 144 N 0.14 0.54 -0.69 -1.35 -1.99 -1.10 -1.69 116.97 110.84 1z4i h TYR 144 Ca 0.03 0.02 -0.02 0.00 2.00 0.00 0.00 58.73 60.75 1z4i h TYR 144 Cb 0.73 -0.18 -0.03 0.00 2.00 0.00 0.00 36.73 39.25 1z4i h TYR 144 CO 0.08 0.32 0.33 0.00 -0.00 0.00 0.00 178.16 178.89 1z4i h ALA 145 N 1.19 1.29 -0.38 3.88 0.00 -1.01 -0.94 119.26 123.29 1z4i h ALA 145 Ca 0.18 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.91 1z4i h ALA 145 Cb -0.01 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1z4i h ALA 145 CO -0.07 0.55 0.05 2.35 0.00 0.00 0.00 179.25 182.14 1z4i h TRP 146 N 0.97 0.68 -0.63 0.00 7.01 -0.33 -1.15 115.95 122.50 1z4i h TRP 146 Ca 0.24 -0.10 -0.06 0.00 2.11 0.00 0.00 58.89 61.08 1z4i h TRP 146 Cb 0.10 -0.18 -0.03 0.00 -2.10 0.00 0.00 29.16 26.95 1z4i h TRP 146 CO 0.01 0.68 0.15 0.28 -2.79 0.00 0.00 178.44 176.78 1z4i h VAL 147 N 0.48 1.25 -0.57 2.65 2.07 -0.88 -1.46 116.25 119.79 1z4i h VAL 147 Ca 0.11 -0.92 0.01 0.00 0.82 0.00 0.00 66.70 66.72 1z4i h VAL 147 Cb 0.38 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 1z4i h VAL 147 CO 0.01 0.35 0.37 -0.08 0.02 0.00 0.00 177.57 178.24 1z4i h GLU 148 N 0.92 0.73 -0.27 1.57 4.81 -1.01 0.13 114.58 121.46 1z4i h GLU 148 Ca 0.20 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1z4i h GLU 148 Cb 0.36 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1z4i h GLU 148 CO 0.00 0.48 0.16 -0.22 -0.73 0.00 0.00 179.01 178.70 1z4i h LYS 149 N 0.75 0.37 0.00 1.92 3.64 -0.65 -0.87 116.57 121.73 1z4i h LYS 149 Ca 0.22 -0.04 -0.20 0.00 -1.27 0.00 0.00 60.65 59.36 1z4i h LYS 149 Cb -0.06 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 31.65 1z4i h LYS 149 CO -0.06 0.30 -1.54 0.66 -2.27 0.00 0.00 179.45 176.54 1z4i n TYR 150 N -4.86 0.92 0.00 1.91 4.01 -0.60 -4.51 117.16 114.03 1z4i n TYR 150 Ca -0.02 0.31 0.00 0.00 -0.16 0.00 0.00 57.90 58.03 1z4i n TYR 150 Cb 0.06 -1.09 0.00 0.00 -0.31 0.00 0.00 39.34 38.00 1z4i n TYR 150 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1z4i n PHE 151 N -2.90 0.00 0.00 -0.72 3.72 0.44 -5.04 117.46 112.96 1z4i n PHE 151 Ca -0.12 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.28 1z4i n PHE 151 Cb 0.89 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.43 1z4i n PHE 151 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1z4i n GLY 152 N 1.01 1.13 0.35 1.37 0.00 -0.33 -4.39 105.19 104.32 1z4i n GLY 152 Ca 0.00 -1.77 0.11 0.00 0.00 0.00 0.00 46.02 44.36 1z4i n GLY 152 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1z4i h PRO 153 N 0.00 0.75 0.00 1.61 0.11 -1.88 -1.97 132.00 130.62 1z4i h PRO 153 Ca 0.00 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.06 1z4i h PRO 153 Cb 0.00 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 30.94 1z4i h PRO 153 CO 0.00 0.49 -0.01 -0.44 -0.21 0.00 0.00 178.00 177.84 1z4i h ASP 154 N 0.77 0.00 1.27 -2.05 3.32 -1.96 -2.16 116.42 115.62 1z4i h ASP 154 Ca 0.54 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.59 1z4i h ASP 154 Cb 0.79 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.34 1z4i h ASP 154 CO -0.36 0.01 0.00 0.33 -1.72 0.00 0.00 179.24 177.49 1z4i n PHE 155 N -3.12 0.56 0.16 4.55 -0.00 -0.74 -3.68 117.46 115.19 1z4i n PHE 155 Ca -0.01 0.17 0.06 0.00 -0.00 0.00 0.00 57.45 57.67 1z4i n PHE 155 Cb 0.20 -0.77 0.56 0.00 -0.00 0.00 0.00 39.48 39.46 1z4i n PHE 155 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 1z4i h LEU 156 N 0.00 0.18 -2.41 -2.13 3.38 -1.50 -0.65 115.31 112.18 1z4i h LEU 156 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1z4i h LEU 156 Cb 0.64 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1z4i h LEU 156 CO 0.00 0.13 0.00 -0.33 0.09 0.00 0.00 178.44 178.33 1z4i h GLU 157 N 0.22 0.00 -0.31 1.13 5.08 -1.78 -2.56 114.58 116.35 1z4i h GLU 157 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1z4i h GLU 157 Cb -0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.23 1z4i h GLU 157 CO -0.01 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.04 1z4i n GLN 158 N -2.86 2.03 -3.30 2.33 1.13 -0.25 -4.94 117.38 111.52 1z4i n GLN 158 Ca -0.02 -1.57 -0.38 0.00 -1.94 0.00 0.00 57.00 53.09 1z4i n GLN 158 Cb 0.09 -1.41 -0.06 0.00 0.11 0.00 0.00 30.24 28.97 1z4i n GLN 158 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1z4i s ILE 159 N -1.59 5.13 -0.22 5.09 1.01 -0.97 -0.70 121.20 128.95 1z4i s ILE 159 Ca 0.34 1.01 0.02 0.00 0.00 0.00 0.00 60.65 62.01 1z4i s ILE 159 Cb 0.18 -3.84 0.04 0.00 0.01 0.00 0.00 42.46 38.86 1z4i s ILE 159 CO 0.26 0.35 -0.15 -0.69 0.00 0.00 0.00 174.94 174.72 1z4i s VAL 160 N 0.39 2.17 -0.29 2.92 1.01 0.60 -4.93 120.40 122.26 1z4i s VAL 160 Ca 0.27 -1.29 -0.12 0.00 0.00 0.00 0.00 61.98 60.85 1z4i s VAL 160 Cb -0.16 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 1z4i s VAL 160 CO 0.12 0.24 0.21 -0.76 0.00 0.00 0.00 175.10 174.90 1z4i s LEU 161 N 1.20 4.13 -0.14 3.92 1.43 -1.26 -1.66 118.68 126.30 1z4i s LEU 161 Ca -0.02 -0.09 -0.25 0.00 -1.03 0.00 0.00 54.13 52.74 1z4i s LEU 161 Cb -0.17 -2.13 0.06 0.00 0.03 0.00 0.00 46.19 43.98 1z4i s LEU 161 CO -0.09 -0.10 0.62 0.28 0.23 0.00 0.00 176.35 177.30 1z4i s THR 162 N 1.76 0.01 -0.66 5.49 -1.32 -0.41 -4.99 115.64 115.51 1z4i s THR 162 Ca 0.07 -0.05 0.25 0.00 -1.21 0.00 0.00 61.69 60.75 1z4i s THR 162 Cb -0.16 -0.90 0.28 0.00 -1.51 0.00 0.00 72.50 70.20 1z4i s THR 162 CO 0.11 -0.03 1.70 0.03 -2.21 0.00 0.00 174.62 174.22 1z4i h ARG 163 N 4.21 0.00 -4.79 7.08 2.47 -1.92 -3.27 114.38 118.15 1z4i h ARG 163 Ca -0.28 0.00 -0.67 0.00 -1.26 0.00 0.00 59.98 57.77 1z4i h ARG 163 Cb 1.16 0.00 -0.37 0.00 -1.65 0.00 0.00 29.97 29.10 1z4i h ARG 163 CO 0.24 0.00 -0.76 0.34 0.56 0.00 0.00 179.97 180.35 1z4i s ASP 164 N -4.83 4.62 0.40 7.04 -1.08 -1.26 -4.97 116.67 116.58 1z4i s ASP 164 Ca 0.09 -1.64 0.23 0.00 -0.52 0.00 0.00 52.55 50.71 1z4i s ASP 164 Cb 0.11 -1.60 0.29 0.00 -1.46 0.00 0.00 42.92 40.26 1z4i s ASP 164 CO 0.62 -0.27 1.53 0.11 0.52 0.00 0.00 175.17 177.68 1z4i h LYS 165 N 7.75 0.00 0.00 4.34 1.57 -1.83 -3.31 116.57 125.09 1z4i h LYS 165 Ca -0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1z4i h LYS 165 Cb 1.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.35 1z4i h LYS 165 CO 0.49 0.00 0.00 1.79 -0.57 0.00 0.00 179.45 181.16 1z4i h THR 166 N 0.00 0.00 -0.14 -0.16 1.35 -1.90 -1.98 112.91 110.07 1z4i h THR 166 Ca 0.00 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.47 1z4i h THR 166 Cb 1.00 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 68.77 1z4i h THR 166 CO 0.00 0.00 0.00 1.33 -0.25 0.00 0.00 175.52 176.60 1z4i n VAL 167 N -2.99 0.18 -3.58 6.82 0.24 -1.25 -4.62 118.33 113.13 1z4i n VAL 167 Ca 0.00 -0.35 -0.37 0.00 -2.04 0.00 0.00 64.34 61.58 1z4i n VAL 167 Cb 0.26 0.46 -0.08 0.00 -1.47 0.00 0.00 33.84 33.00 1z4i n VAL 167 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1z4i s VAL 168 N -1.82 5.32 -0.10 3.34 1.01 -0.75 -5.08 120.40 122.32 1z4i s VAL 168 Ca 0.34 0.37 -0.09 0.00 0.00 0.00 0.00 61.98 62.59 1z4i s VAL 168 Cb 0.19 -3.57 -0.05 0.00 0.00 0.00 0.00 36.38 32.95 1z4i s VAL 168 CO 0.28 0.34 0.21 -0.94 0.00 0.00 0.00 175.10 175.00 1z4i s SER 169 N 0.86 6.49 0.09 3.32 1.04 -1.26 -4.74 113.70 119.50 1z4i s SER 169 Ca 0.12 0.58 -0.26 0.00 0.48 0.00 0.00 55.95 56.87 1z4i s SER 169 Cb -0.13 -2.12 0.09 0.00 0.10 0.00 0.00 66.02 63.95 1z4i s SER 169 CO 0.04 0.36 1.12 0.00 0.98 0.00 0.00 173.24 175.74 1z4i s ALA 170 N -0.88 -1.91 0.03 5.32 0.00 -1.26 -5.00 121.76 118.05 1z4i s ALA 170 Ca 0.17 0.20 0.04 0.00 0.00 0.00 0.00 51.96 52.37 1z4i s ALA 170 Cb -0.13 0.60 -0.24 0.00 0.00 0.00 0.00 23.12 23.34 1z4i s ALA 170 CO 0.06 -1.06 0.96 -0.44 0.00 0.00 0.00 175.76 175.27 1z4i h ASP 171 N 2.00 0.16 -4.13 0.00 5.19 -1.30 -2.48 116.42 115.86 1z4i h ASP 171 Ca -0.27 -0.22 -0.22 0.00 -0.62 0.00 0.00 57.03 55.70 1z4i h ASP 171 Cb 1.21 -0.05 -0.26 0.00 0.18 0.00 0.00 39.33 40.41 1z4i h ASP 171 CO 0.29 1.19 -0.72 -0.76 -3.12 0.00 0.00 179.24 176.12 1z4i s LEU 172 N -6.67 2.08 -0.17 1.55 1.43 -1.04 -1.32 118.68 114.54 1z4i s LEU 172 Ca -0.04 -0.16 0.01 0.00 -1.03 0.00 0.00 54.13 52.90 1z4i s LEU 172 Cb 0.08 0.02 0.03 0.00 0.03 0.00 0.00 46.19 46.35 1z4i s LEU 172 CO 0.84 -0.09 -0.12 -0.22 0.23 0.00 0.00 176.35 176.98 1z4i s LEU 173 N -0.47 1.95 -0.34 1.79 2.96 -0.38 -0.62 118.68 123.56 1z4i s LEU 173 Ca -0.05 -0.67 -0.11 0.00 -0.22 0.00 0.00 54.13 53.08 1z4i s LEU 173 Cb -0.03 -1.19 0.00 0.00 0.50 0.00 0.00 46.19 45.47 1z4i s LEU 173 CO -0.00 -0.10 0.20 -0.63 -1.32 0.00 0.00 176.35 174.49 1z4i s ILE 174 N 1.45 4.77 -0.24 6.68 1.01 -0.03 -0.38 121.20 134.46 1z4i s ILE 174 Ca 0.02 -0.53 -0.18 0.00 0.00 0.00 0.00 60.65 59.97 1z4i s ILE 174 Cb -0.14 -3.52 0.07 0.00 0.01 0.00 0.00 42.46 38.87 1z4i s ILE 174 CO -0.09 -0.06 0.60 -0.62 0.00 0.00 0.00 174.94 174.76 1z4i s ASP 175 N 1.62 -0.72 0.00 3.58 -1.08 -0.97 -1.30 116.67 117.81 1z4i s ASP 175 Ca 0.04 1.27 0.29 0.00 -0.52 0.00 0.00 52.55 53.63 1z4i s ASP 175 Cb -0.18 1.22 1.31 0.00 -1.46 0.00 0.00 42.92 43.81 1z4i s ASP 175 CO 0.07 -0.22 1.94 -0.90 0.52 0.00 0.00 175.17 176.59 1z4i n ASP 176 N 3.48 0.07 -4.66 -0.34 5.75 -1.26 -1.80 116.55 117.79 1z4i n ASP 176 Ca -0.17 0.10 -0.41 0.00 -0.01 0.00 0.00 54.79 54.30 1z4i n ASP 176 Cb 0.57 -0.33 -0.04 0.00 -1.03 0.00 0.00 41.12 40.28 1z4i n ASP 176 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 1z4i s ARG 177 N -2.78 4.27 0.18 0.11 3.52 -1.26 -4.79 118.95 118.19 1z4i s ARG 177 Ca 0.21 0.99 -0.09 0.00 -0.13 0.00 0.00 55.73 56.70 1z4i s ARG 177 Cb 0.20 -3.59 0.08 0.00 -1.56 0.00 0.00 34.95 30.08 1z4i s ARG 177 CO 0.51 -0.36 1.67 -1.35 -0.81 0.00 0.00 175.30 174.95 1z4i h PRO 178 N 7.41 1.07 -4.26 5.12 0.11 -1.97 -3.40 132.00 136.06 1z4i h PRO 178 Ca -0.28 -0.30 -0.74 0.00 0.11 0.00 0.00 66.00 64.79 1z4i h PRO 178 Cb 1.12 -0.12 -0.26 0.00 0.11 0.00 0.00 31.00 31.86 1z4i h PRO 178 CO 0.84 1.00 -0.34 0.16 -0.21 0.00 0.00 178.00 179.45 1z4i s ASP 179 N -6.47 5.94 -0.35 -2.05 -4.77 -1.26 -5.02 116.67 102.69 1z4i s ASP 179 Ca -0.12 -1.67 -0.01 0.00 -3.30 0.00 0.00 52.55 47.45 1z4i s ASP 179 Cb 0.14 -2.11 0.08 0.00 -1.09 0.00 0.00 42.92 39.95 1z4i s ASP 179 CO 0.85 -0.71 0.09 -0.63 0.70 0.00 0.00 175.17 175.47 1z4i s ILE 180 N 1.51 2.95 0.28 2.11 1.01 -1.26 -5.08 121.20 122.72 1z4i s ILE 180 Ca 0.04 -1.84 0.02 0.00 0.00 0.00 0.00 60.65 58.87 1z4i s ILE 180 Cb -0.26 -2.91 -0.05 0.00 0.01 0.00 0.00 42.46 39.24 1z4i s ILE 180 CO 0.03 -0.43 0.09 0.42 0.00 0.00 0.00 174.94 175.04 1z4i s THR 181 N 1.14 0.76 -2.66 2.92 -4.23 -1.26 -4.92 115.64 107.38 1z4i s THR 181 Ca 0.03 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.54 1z4i s THR 181 Cb -0.21 -2.68 0.00 0.00 1.34 0.00 0.00 72.50 70.95 1z4i s THR 181 CO -0.04 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.65 1z4i n GLY 182 N -0.55 -0.64 0.18 3.99 0.00 -1.26 -4.67 105.19 102.24 1z4i n GLY 182 Ca -0.01 -0.54 0.05 0.00 0.00 0.00 0.00 46.02 45.52 1z4i n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z4i h ALA 183 N 0.00 0.98 -2.38 4.61 0.00 -1.96 -3.40 119.26 117.10 1z4i h ALA 183 Ca 0.00 -0.37 -0.69 0.00 0.00 0.00 0.00 54.91 53.85 1z4i h ALA 183 Cb 0.00 -0.07 -0.18 0.00 0.00 0.00 0.00 17.79 17.54 1z4i h ALA 183 CO 0.00 0.51 -0.19 -2.00 0.00 0.00 0.00 179.25 177.57 1z4i s GLU 184 N -3.58 3.16 0.54 0.00 2.56 -1.26 -4.95 118.70 115.17 1z4i s GLU 184 Ca 0.00 -0.69 0.33 0.00 0.00 0.00 0.00 54.97 54.61 1z4i s GLU 184 Cb 0.11 -3.95 1.42 0.00 2.00 0.00 0.00 34.13 33.72 1z4i s GLU 184 CO 0.70 -0.83 2.01 -1.00 -0.56 0.00 0.00 175.26 175.58 1z4i h PRO 185 N 8.71 0.00 -2.49 4.30 0.13 -1.94 -3.35 132.00 137.35 1z4i h PRO 185 Ca -0.27 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.27 1z4i h PRO 185 Cb 1.11 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.84 1z4i h PRO 185 CO 0.79 0.05 -0.75 2.41 -0.23 0.00 0.00 178.00 180.27 1z4i n THR 186 N -3.20 0.87 -1.67 1.56 -1.04 -1.26 -5.10 114.28 104.44 1z4i n THR 186 Ca -0.00 -4.53 -0.39 0.00 -2.04 0.00 0.00 64.05 57.09 1z4i n THR 186 Cb 0.29 -2.01 0.04 0.00 -1.82 0.00 0.00 70.33 66.83 1z4i n THR 186 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1z4i n PRO 187 N 1.71 1.27 0.20 -2.82 -0.02 -1.26 -4.92 135.00 129.17 1z4i n PRO 187 Ca 0.25 0.48 0.08 0.00 -2.02 0.00 0.00 63.50 62.29 1z4i n PRO 187 Cb 0.43 -2.33 0.25 0.00 -0.02 0.00 0.00 33.50 31.83 1z4i n PRO 187 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1z4i h SER 188 N 0.99 0.00 -4.06 2.55 4.64 -1.84 -3.46 113.55 112.37 1z4i h SER 188 Ca -0.49 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.36 1z4i h SER 188 Cb 1.34 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.43 1z4i h SER 188 CO 0.54 0.25 0.31 -1.66 -0.87 0.00 0.00 176.83 175.40 1z4i s TRP 189 N -3.29 3.44 -0.22 4.77 1.48 -0.93 -4.64 118.94 119.54 1z4i s TRP 189 Ca 0.03 1.39 -0.25 0.00 -1.06 0.00 0.00 56.10 56.22 1z4i s TRP 189 Cb 0.08 -2.72 -0.01 0.00 -1.16 0.00 0.00 33.47 29.66 1z4i s TRP 189 CO 0.68 -0.27 0.82 -2.00 -4.06 0.00 0.00 176.95 172.11 1z4i s GLU 190 N -3.88 4.22 -0.29 3.25 2.12 -0.43 -4.89 118.70 118.79 1z4i s GLU 190 Ca 0.58 0.94 -0.29 0.00 0.36 0.00 0.00 54.97 56.56 1z4i s GLU 190 Cb -0.10 -3.62 0.00 0.00 0.26 0.00 0.00 34.13 30.68 1z4i s GLU 190 CO 0.29 -0.44 1.25 -1.58 -0.54 0.00 0.00 175.26 174.24 1z4i s HIS 191 N 2.55 2.79 -0.27 5.30 5.65 -1.26 -1.25 115.29 128.79 1z4i s HIS 191 Ca 0.36 0.94 -0.10 0.00 0.25 0.00 0.00 55.06 56.50 1z4i s HIS 191 Cb -0.16 -3.84 -0.05 0.00 -1.18 0.00 0.00 32.58 27.36 1z4i s HIS 191 CO 0.09 -1.53 0.16 0.08 -0.65 0.00 0.00 174.74 172.90 1z4i s VAL 192 N 4.16 5.11 -0.23 0.89 1.01 0.49 -4.49 120.40 127.34 1z4i s VAL 192 Ca 0.54 0.10 -0.29 0.00 0.00 0.00 0.00 61.98 62.33 1z4i s VAL 192 Cb -0.16 -3.43 -0.01 0.00 0.00 0.00 0.00 36.38 32.78 1z4i s VAL 192 CO 0.21 0.27 1.36 -0.22 0.00 0.00 0.00 175.10 176.72 1z4i s LEU 193 N 1.70 4.00 -0.11 3.92 2.96 -0.04 -2.28 118.68 128.83 1z4i s LEU 193 Ca 0.07 1.49 -0.29 0.00 -0.22 0.00 0.00 54.13 55.18 1z4i s LEU 193 Cb -0.16 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 42.98 1z4i s LEU 193 CO 0.09 -1.00 0.97 0.12 -1.32 0.00 0.00 176.35 175.22 1z4i s PHE 194 N 4.21 3.51 0.28 5.38 5.36 -0.74 -0.73 117.98 135.25 1z4i s PHE 194 Ca 0.59 1.54 -0.30 0.00 -0.96 0.00 0.00 56.93 57.81 1z4i s PHE 194 Cb -0.20 -3.15 -0.10 0.00 -0.34 0.00 0.00 43.02 39.23 1z4i s PHE 194 CO 0.22 -0.20 1.42 0.99 -1.46 0.00 0.00 175.22 176.19 1z4i s THR 195 N 1.92 2.58 0.07 0.12 2.01 -0.57 -4.15 115.64 117.63 1z4i s THR 195 Ca 0.47 0.52 -0.04 0.00 0.31 0.00 0.00 61.69 62.95 1z4i s THR 195 Cb -0.18 -3.33 -0.03 0.00 0.01 0.00 0.00 72.50 68.97 1z4i s THR 195 CO 0.18 0.10 0.06 0.00 -0.69 0.00 0.00 174.62 174.26 1z4i s ALA 196 N -0.36 0.28 0.29 7.40 0.00 -1.26 -4.86 121.76 123.26 1z4i s ALA 196 Ca 0.57 -1.03 0.02 0.00 0.00 0.00 0.00 51.96 51.52 1z4i s ALA 196 Cb -0.42 0.40 0.73 0.00 0.00 0.00 0.00 23.12 23.83 1z4i s ALA 196 CO 0.48 -0.43 1.63 0.00 0.00 0.00 0.00 175.76 177.43 1z4i h HIS 198 N 0.16 0.00 -0.01 0.00 2.07 -1.85 -3.16 115.15 112.37 1z4i h HIS 198 Ca 0.57 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.09 1z4i h HIS 198 Cb 1.17 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.15 1z4i h HIS 198 CO -0.30 0.00 0.00 0.27 -3.07 0.00 0.00 177.93 174.83 1z4i n ASN 199 N -2.97 1.24 0.31 3.10 0.23 -0.51 -2.24 115.26 114.42 1z4i n ASN 199 Ca 0.02 -1.17 0.20 0.00 -0.53 0.00 0.00 54.58 53.10 1z4i n ASN 199 Cb 0.36 -0.00 0.93 0.00 -2.08 0.00 0.00 39.78 38.99 1z4i n ASN 199 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 1z4i h GLN 200 N 0.30 0.00 -0.01 -3.83 3.07 -1.03 -1.51 115.11 112.11 1z4i h GLN 200 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1z4i h GLN 200 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.68 1z4i h GLN 200 CO 0.00 0.01 -0.47 0.72 0.09 0.00 0.00 178.83 179.17 1z4i n HIS 201 N -3.12 0.00 -2.49 0.06 8.25 -1.26 -4.96 115.22 111.71 1z4i n HIS 201 Ca -0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.03 1z4i n HIS 201 Cb 0.20 -0.08 -0.03 0.00 1.12 0.00 0.00 29.99 31.20 1z4i n HIS 201 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1z4i s LEU 202 N -2.64 4.31 -0.19 2.41 0.20 -0.57 -5.00 118.68 117.19 1z4i s LEU 202 Ca 0.18 1.83 -0.25 0.00 0.69 0.00 0.00 54.13 56.58 1z4i s LEU 202 Cb 0.18 -3.56 -0.01 0.00 -0.43 0.00 0.00 46.19 42.37 1z4i s LEU 202 CO 0.61 -0.52 0.85 -1.58 -0.29 0.00 0.00 176.35 175.42 1z4i s GLN 203 N 1.82 4.27 0.28 1.98 0.74 -1.26 -5.03 119.66 122.45 1z4i s GLN 203 Ca 0.56 1.02 -0.07 0.00 0.05 0.00 0.00 55.36 56.92 1z4i s GLN 203 Cb -0.25 -3.60 -0.06 0.00 1.10 0.00 0.00 33.01 30.20 1z4i s GLN 203 CO 0.24 -0.40 0.58 -0.51 -0.55 0.00 0.00 175.29 174.65 1z4i s LEU 204 N 2.40 4.06 0.10 3.68 1.43 -1.26 -5.05 118.68 124.04 1z4i s LEU 204 Ca 0.38 0.83 -0.31 0.00 -1.03 0.00 0.00 54.13 54.00 1z4i s LEU 204 Cb -0.16 -3.64 -0.08 0.00 0.03 0.00 0.00 46.19 42.34 1z4i s LEU 204 CO 0.11 -0.18 1.44 0.00 0.23 0.00 0.00 176.35 177.95 1z4i s GLN 205 N -3.35 4.29 0.26 1.70 -2.07 -1.26 -4.89 119.66 114.34 1z4i s GLN 205 Ca 0.46 2.12 -0.05 0.00 -1.82 0.00 0.00 55.36 56.07 1z4i s GLN 205 Cb -0.11 -3.33 0.50 0.00 -1.09 0.00 0.00 33.01 28.99 1z4i s GLN 205 CO 0.27 -0.51 1.42 -2.30 -1.32 0.00 0.00 175.29 172.85 1z4i n PRO 206 N 4.37 -0.08 -0.24 9.60 -0.02 -1.26 -1.13 135.00 146.24 1z4i n PRO 206 Ca 0.12 1.40 0.15 0.00 -2.02 0.00 0.00 63.50 63.16 1z4i n PRO 206 Cb 0.42 -2.14 0.45 0.00 -0.02 0.00 0.00 33.50 32.21 1z4i n PRO 206 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1z4i h PRO 207 N 0.00 0.52 -7.04 0.52 0.13 -2.05 -3.42 132.00 120.66 1z4i h PRO 207 Ca 0.47 -0.03 -0.55 0.00 -0.87 0.00 0.00 66.00 65.02 1z4i h PRO 207 Cb 0.81 -0.12 0.14 0.00 0.13 0.00 0.00 31.00 31.97 1z4i h PRO 207 CO -0.91 0.34 0.59 0.54 -0.23 0.00 0.00 178.00 178.33 1z4i n ARG 208 N -4.54 1.65 -4.08 0.86 1.74 -0.28 -5.04 116.66 106.97 1z4i n ARG 208 Ca 0.18 0.61 -0.13 0.00 -0.77 0.00 0.00 57.85 57.74 1z4i n ARG 208 Cb 0.57 -2.57 -0.11 0.00 -1.02 0.00 0.00 32.46 29.34 1z4i n ARG 208 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1z4i s ARG 209 N -2.91 0.58 0.10 5.56 3.52 -1.26 -4.90 118.95 119.65 1z4i s ARG 209 Ca 0.72 -0.87 0.10 0.00 -0.13 0.00 0.00 55.73 55.56 1z4i s ARG 209 Cb -0.42 -0.27 -0.04 0.00 -1.56 0.00 0.00 34.95 32.67 1z4i s ARG 209 CO 0.49 0.04 -0.27 1.03 -0.81 0.00 0.00 175.30 175.78 1z4i s ARG 210 N -2.01 1.54 -0.24 5.12 0.52 -1.26 -0.86 118.95 121.76 1z4i s ARG 210 Ca -0.06 -1.27 -0.06 0.00 -0.52 0.00 0.00 55.73 53.83 1z4i s ARG 210 Cb -0.07 -1.93 -0.02 0.00 0.52 0.00 0.00 34.95 33.45 1z4i s ARG 210 CO -0.01 0.47 0.02 -1.17 0.02 0.00 0.00 175.30 174.64 1z4i s LEU 211 N -1.78 3.21 0.32 2.53 2.96 0.09 -4.87 118.68 121.14 1z4i s LEU 211 Ca 0.13 -0.28 0.19 0.00 -0.22 0.00 0.00 54.13 53.96 1z4i s LEU 211 Cb -0.10 -1.84 0.16 0.00 0.50 0.00 0.00 46.19 44.90 1z4i s LEU 211 CO 0.05 -0.02 1.42 0.45 -1.32 0.00 0.00 176.35 176.92 1z4i h HIS 212 N 8.15 0.00 0.00 5.38 3.86 -1.95 -1.50 115.15 129.09 1z4i h HIS 212 Ca -0.40 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.81 1z4i h HIS 212 Cb 1.17 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.64 1z4i h HIS 212 CO 0.63 0.23 0.00 -1.13 0.86 0.00 0.00 177.93 178.52 1z4i n SER 213 N -3.08 0.00 0.11 2.45 3.41 -1.26 -4.29 113.62 110.96 1z4i n SER 213 Ca 0.02 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.75 1z4i n SER 213 Cb 0.63 0.00 0.46 0.00 -0.26 0.00 0.00 64.21 65.05 1z4i n SER 213 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1z4i n TRP 214 N -0.00 0.76 0.20 7.33 7.02 -1.26 -1.97 117.44 129.52 1z4i n TRP 214 Ca 0.00 0.28 0.09 0.00 -1.02 0.00 0.00 57.50 56.85 1z4i n TRP 214 Cb 0.00 -0.95 0.29 0.00 -2.42 0.00 0.00 31.31 28.23 1z4i n TRP 214 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1z4i h ALA 215 N 2.36 0.91 -2.26 6.99 0.00 -1.92 -3.45 119.26 121.88 1z4i h ALA 215 Ca 0.00 -0.23 -0.46 0.00 0.00 0.00 0.00 54.91 54.22 1z4i h ALA 215 Cb 0.44 -0.04 0.18 0.00 0.00 0.00 0.00 17.79 18.37 1z4i h ALA 215 CO 0.00 0.31 0.14 0.34 0.00 0.00 0.00 179.25 180.04 1z4i s ASP 216 N -6.24 2.18 -1.21 0.00 2.15 -0.83 -4.91 116.67 107.81 1z4i s ASP 216 Ca 0.03 1.48 -0.12 0.00 0.43 0.00 0.00 52.55 54.37 1z4i s ASP 216 Cb 0.08 -2.17 0.19 0.00 -0.30 0.00 0.00 42.92 40.72 1z4i s ASP 216 CO 0.67 -3.45 1.46 -0.67 -0.17 0.00 0.00 175.17 173.01 1z4i n ASP 217 N -4.41 5.27 0.08 -0.34 -0.08 -1.26 -4.77 116.55 111.04 1z4i n ASP 217 Ca 0.05 -3.01 -0.02 0.00 -1.51 0.00 0.00 54.79 50.31 1z4i n ASP 217 Cb 0.55 -1.53 0.25 0.00 2.34 0.00 0.00 41.12 42.72 1z4i n ASP 217 CO 0.00 0.00 0.00 4.11 0.12 0.00 0.00 177.20 181.43 1z4i h TRP 218 N 6.87 0.32 -0.96 -0.67 5.08 -1.89 -2.78 115.95 121.93 1z4i h TRP 218 Ca 0.31 -0.08 0.05 0.00 1.08 0.00 0.00 58.89 60.26 1z4i h TRP 218 Cb 0.84 -0.08 -0.06 0.00 -3.00 0.00 0.00 29.16 26.86 1z4i h TRP 218 CO 1.08 0.59 0.63 0.87 -1.28 0.00 0.00 178.44 180.33 1z4i h LYS 219 N 0.25 1.12 -0.29 0.12 1.57 -1.99 -1.81 116.57 115.54 1z4i h LYS 219 Ca 0.03 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.67 1z4i h LYS 219 Cb 0.72 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.76 1z4i h LYS 219 CO 0.05 0.74 -0.13 0.00 -0.57 0.00 0.00 179.45 179.55 1z4i h ALA 220 N 1.46 1.24 -0.13 3.86 0.00 -1.90 -0.50 119.26 123.29 1z4i h ALA 220 Ca 0.40 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1z4i h ALA 220 Cb 0.10 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1z4i h ALA 220 CO -0.14 0.50 -0.02 0.82 0.00 0.00 0.00 179.25 180.41 1z4i h ILE 221 N 0.46 1.28 -0.11 0.00 2.04 -1.39 -2.01 117.51 117.78 1z4i h ILE 221 Ca 0.08 -0.93 0.03 0.00 1.00 0.00 0.00 64.86 65.04 1z4i h ILE 221 Cb 0.50 1.65 -0.03 0.00 -0.74 0.00 0.00 36.82 38.20 1z4i h ILE 221 CO 0.03 0.27 -0.05 -0.07 0.00 0.00 0.00 178.15 178.33 1z4i h LEU 222 N -0.06 -0.18 -1.56 1.44 4.07 -1.07 -2.64 115.31 115.31 1z4i h LEU 222 Ca 0.03 0.04 0.07 0.00 0.08 0.00 0.00 57.88 58.11 1z4i h LEU 222 Cb 0.43 0.10 -0.04 0.00 1.08 0.00 0.00 40.66 42.23 1z4i h LEU 222 CO 0.01 -0.07 0.40 0.44 -1.08 0.00 0.00 178.44 178.14 1z4i h ASP 223 N -0.04 0.47 0.22 -0.43 3.32 -1.07 -1.11 116.42 117.78 1z4i h ASP 223 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1z4i h ASP 223 Cb 0.14 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1z4i h ASP 223 CO -0.14 0.30 0.00 0.77 -1.72 0.00 0.00 179.24 178.45 1z4i h SER 224 N 0.53 0.00 -0.01 6.45 4.64 -0.97 -2.31 113.55 121.87 1z4i h SER 224 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 1z4i h SER 224 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1z4i h SER 224 CO -0.08 0.00 -0.41 0.29 -0.87 0.00 0.00 176.83 175.76 1z4i n LYS 225 N -2.60 1.49 -3.14 4.77 4.76 -0.42 -4.96 118.16 118.06 1z4i n LYS 225 Ca -0.01 -0.84 -0.35 0.00 -2.87 0.00 0.00 58.31 54.24 1z4i n LYS 225 Cb 0.10 -1.35 -0.06 0.00 -1.84 0.00 0.00 35.03 31.88 1z4i n LYS 225 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1z4i s ARG 226 N -2.15 4.17 0.00 1.97 0.52 -0.87 -5.06 118.95 117.53 1z4i s ARG 226 Ca 0.15 0.78 0.09 0.00 -0.52 0.00 0.00 55.73 56.24 1z4i s ARG 226 Cb 0.15 -2.79 0.56 0.00 0.52 0.00 0.00 34.95 33.39 1z4i s ARG 226 CO 0.48 0.35 1.01 -0.35 0.02 0.00 0.00 175.30 176.82