#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z84 s SER 22 N 0.00 6.84 0.80 1.69 0.15 -1.26 -4.67 113.70 117.25 1z84 s SER 22 Ca 0.00 1.00 -0.11 0.00 0.70 0.00 0.00 55.95 57.53 1z84 s SER 22 Cb 0.00 -2.30 0.08 0.00 -1.71 0.00 0.00 66.02 62.09 1z84 s SER 22 CO 0.00 0.18 1.12 -2.16 1.20 0.00 0.00 173.24 173.59 1z84 s PRO 23 N -0.42 1.92 -0.16 5.44 0.04 -1.26 -4.91 135.00 135.65 1z84 s PRO 23 Ca 0.26 1.38 -0.27 0.00 0.04 0.00 0.00 61.00 62.41 1z84 s PRO 23 Cb -0.17 -1.84 0.07 0.00 0.04 0.00 0.00 34.50 32.60 1z84 s PRO 23 CO 0.14 -1.93 0.68 -2.00 0.04 0.00 0.00 177.00 173.93 1z84 s GLU 24 N -4.62 0.93 -0.11 4.56 2.12 -0.58 -5.00 118.70 115.99 1z84 s GLU 24 Ca 0.65 0.62 -0.05 0.00 0.36 0.00 0.00 54.97 56.55 1z84 s GLU 24 Cb -0.21 0.44 -0.04 0.00 0.26 0.00 0.00 34.13 34.59 1z84 s GLU 24 CO 0.54 -0.21 0.07 -0.51 -0.54 0.00 0.00 175.26 174.61 1z84 s LEU 25 N -0.39 3.95 0.03 2.70 2.01 -1.26 0.31 118.68 126.03 1z84 s LEU 25 Ca -0.05 0.27 0.02 0.00 0.01 0.00 0.00 54.13 54.38 1z84 s LEU 25 Cb -0.03 -1.94 -0.02 0.00 0.01 0.00 0.00 46.19 44.21 1z84 s LEU 25 CO 0.05 0.37 -0.07 -0.13 1.01 0.00 0.00 176.35 177.58 1z84 s ARG 26 N -0.79 0.49 0.06 1.70 0.52 -0.61 -4.96 118.95 115.36 1z84 s ARG 26 Ca 0.13 -0.63 0.03 0.00 -0.52 0.00 0.00 55.73 54.73 1z84 s ARG 26 Cb -0.12 -0.28 -0.03 0.00 0.52 0.00 0.00 34.95 35.04 1z84 s ARG 26 CO 0.03 0.05 -0.09 0.21 0.02 0.00 0.00 175.30 175.52 1z84 s LYS 27 N -1.28 0.67 0.01 3.54 2.20 -1.26 -1.01 119.74 122.60 1z84 s LYS 27 Ca -0.08 -0.93 0.01 0.00 -0.36 0.00 0.00 55.97 54.61 1z84 s LYS 27 Cb -0.08 -0.40 -0.01 0.00 -1.51 0.00 0.00 37.83 35.83 1z84 s LYS 27 CO 0.00 0.07 -0.05 0.34 -0.36 0.00 0.00 175.35 175.35 1z84 s ASP 28 N -1.95 0.55 0.53 1.43 -1.08 -1.25 -4.71 116.67 110.19 1z84 s ASP 28 Ca -0.03 -0.22 0.19 0.00 -0.52 0.00 0.00 52.55 51.97 1z84 s ASP 28 Cb -0.07 -0.02 1.37 0.00 -1.46 0.00 0.00 42.92 42.74 1z84 s ASP 28 CO -0.00 -0.03 2.16 -0.65 0.52 0.00 0.00 175.17 177.16 1z84 h PRO 29 N 5.58 0.00 -0.25 4.34 0.11 -1.95 0.73 132.00 140.55 1z84 h PRO 29 Ca -0.29 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.77 1z84 h PRO 29 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 1z84 h PRO 29 CO 0.47 0.02 -0.01 0.28 -0.21 0.00 0.00 178.00 178.55 1z84 h VAL 30 N 0.00 1.26 0.00 3.15 2.07 -1.88 -3.09 116.25 117.77 1z84 h VAL 30 Ca -0.00 -0.95 -0.19 0.00 0.82 0.00 0.00 66.70 66.39 1z84 h VAL 30 Cb 0.03 1.38 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 1z84 h VAL 30 CO 0.00 0.30 -1.15 0.71 0.02 0.00 0.00 177.57 177.45 1z84 h THR 31 N 0.22 0.95 -5.24 2.57 1.35 -1.84 -3.33 112.91 107.60 1z84 h THR 31 Ca 0.07 -2.53 -0.39 0.00 -0.55 0.00 0.00 66.41 63.01 1z84 h THR 31 Cb 0.44 2.40 -0.04 0.00 -1.73 0.00 0.00 68.15 69.22 1z84 h THR 31 CO 0.02 0.54 -0.58 -3.20 -0.25 0.00 0.00 175.52 172.05 1z84 n ASN 32 N -3.11 -4.38 -3.85 5.36 5.15 0.25 -4.75 115.26 109.94 1z84 n ASN 32 Ca -0.06 -0.38 -0.11 0.00 -0.60 0.00 0.00 54.58 53.44 1z84 n ASN 32 Cb 0.88 -3.59 -0.09 0.00 -0.53 0.00 0.00 39.78 36.46 1z84 n ASN 32 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1z84 s ARG 33 N -5.96 0.66 0.29 1.20 1.70 -1.26 -4.99 118.95 110.60 1z84 s ARG 33 Ca 0.39 -0.58 -0.29 0.00 -0.47 0.00 0.00 55.73 54.78 1z84 s ARG 33 Cb -0.20 0.28 -0.09 0.00 -0.57 0.00 0.00 34.95 34.37 1z84 s ARG 33 CO 0.48 -0.19 1.07 -1.58 -1.08 0.00 0.00 175.30 174.00 1z84 s TRP 34 N -2.34 3.58 0.12 5.89 0.52 -1.26 -3.96 118.94 121.48 1z84 s TRP 34 Ca -0.07 1.72 0.11 0.00 0.02 0.00 0.00 56.10 57.88 1z84 s TRP 34 Cb -0.02 -3.23 -0.04 0.00 -1.15 0.00 0.00 33.47 29.03 1z84 s TRP 34 CO -0.03 -0.45 -0.27 0.54 0.02 0.00 0.00 176.95 176.77 1z84 s VAL 35 N -1.24 2.26 -0.27 4.03 0.11 -0.18 -4.47 120.40 120.64 1z84 s VAL 35 Ca 0.46 -1.71 -0.11 0.00 -2.93 0.00 0.00 61.98 57.69 1z84 s VAL 35 Cb -0.30 -1.99 -0.05 0.00 -1.53 0.00 0.00 36.38 32.51 1z84 s VAL 35 CO 0.38 0.12 0.18 -0.63 -3.33 0.00 0.00 175.10 171.83 1z84 s ILE 36 N -1.03 5.30 -0.24 7.04 1.01 -0.77 -1.57 121.20 130.94 1z84 s ILE 36 Ca 0.14 0.16 -0.18 0.00 0.00 0.00 0.00 60.65 60.77 1z84 s ILE 36 Cb -0.10 -3.52 -0.03 0.00 0.01 0.00 0.00 42.46 38.83 1z84 s ILE 36 CO 0.06 0.27 0.53 -0.36 0.00 0.00 0.00 174.94 175.43 1z84 s PHE 37 N 1.65 3.30 -0.38 3.97 0.08 0.15 -0.80 117.98 125.95 1z84 s PHE 37 Ca 0.07 0.70 0.03 0.00 0.12 0.00 0.00 56.93 57.84 1z84 s PHE 37 Cb -0.16 -2.71 0.16 0.00 -0.57 0.00 0.00 43.02 39.74 1z84 s PHE 37 CO 0.10 -0.22 0.33 0.45 -0.10 0.00 0.00 175.22 175.78 1z84 s SER 38 N 1.40 1.66 1.12 1.36 0.15 -0.28 -1.53 113.70 117.58 1z84 s SER 38 Ca 0.23 -2.13 -0.16 0.00 0.70 0.00 0.00 55.95 54.59 1z84 s SER 38 Cb -0.16 0.10 0.23 0.00 -1.71 0.00 0.00 66.02 64.49 1z84 s SER 38 CO 0.09 -0.24 1.01 -0.81 1.20 0.00 0.00 173.24 174.49 1z84 n PRO 39 N 3.78 -2.05 0.00 5.44 -0.04 -1.26 -4.30 135.00 136.57 1z84 n PRO 39 Ca 0.16 -1.58 0.00 0.00 -0.04 0.00 0.00 63.50 62.04 1z84 n PRO 39 Cb 0.44 -1.28 0.00 0.00 -0.04 0.00 0.00 33.50 32.62 1z84 n PRO 39 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1z84 n THR 46 N -4.07 0.00 0.83 0.52 5.66 -1.26 -4.82 114.28 111.13 1z84 n THR 46 Ca 0.13 0.00 0.11 0.00 -3.05 0.00 0.00 64.05 61.24 1z84 n THR 46 Cb 0.49 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.27 1z84 n THR 46 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1z84 n ASP 47 N 0.00 0.72 -4.74 1.09 5.68 -1.26 -4.95 116.55 113.09 1z84 n ASP 47 Ca 0.00 -0.56 -0.41 0.00 -0.50 0.00 0.00 54.79 53.32 1z84 n ASP 47 Cb 0.00 0.83 -0.05 0.00 -1.14 0.00 0.00 41.12 40.77 1z84 n ASP 47 CO 0.00 0.00 0.00 -0.36 -1.33 0.00 0.00 177.20 175.51 1z84 s PHE 48 N -3.08 3.71 0.23 2.11 0.40 -1.26 -5.04 117.98 115.03 1z84 s PHE 48 Ca 0.07 1.72 -0.17 0.00 -0.60 0.00 0.00 56.93 57.95 1z84 s PHE 48 Cb 0.16 -3.18 0.02 0.00 0.51 0.00 0.00 43.02 40.52 1z84 s PHE 48 CO 0.81 -0.25 0.54 0.15 0.70 0.00 0.00 175.22 177.17 1z84 s LYS 49 N -0.71 1.50 0.00 0.44 1.02 -1.26 -4.56 119.74 116.17 1z84 s LYS 49 Ca 0.46 -1.01 0.00 0.00 0.02 0.00 0.00 55.97 55.44 1z84 s LYS 49 Cb -0.28 0.52 0.00 0.00 -0.52 0.00 0.00 37.83 37.55 1z84 s LYS 49 CO 0.35 -0.64 0.00 0.45 -0.92 0.00 0.00 175.35 174.59 1z84 n SER 50 N -0.37 0.00 -4.22 2.83 2.88 0.16 -4.94 113.62 109.96 1z84 n SER 50 Ca -0.06 0.00 -0.38 0.00 -1.33 0.00 0.00 58.87 57.10 1z84 n SER 50 Cb 0.62 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 64.10 1z84 n SER 50 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1z84 n SER 62 N 0.00 -3.87 -3.55 -3.46 2.88 -1.26 -5.02 113.62 99.34 1z84 n SER 62 Ca 0.00 0.56 -0.05 0.00 -1.33 0.00 0.00 58.87 58.05 1z84 n SER 62 Cb 0.00 -0.87 -0.00 0.00 -0.75 0.00 0.00 64.21 62.59 1z84 n SER 62 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1z84 n PRO 64 N -0.53 0.04 0.00 0.00 -0.02 -1.26 -1.97 135.00 131.27 1z84 n PRO 64 Ca -0.05 0.40 0.12 0.00 -2.02 0.00 0.00 63.50 61.95 1z84 n PRO 64 Cb 0.60 -1.60 0.17 0.00 -0.02 0.00 0.00 33.50 32.64 1z84 n PRO 64 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1z84 n PHE 65 N -1.69 0.00 -2.50 6.00 3.72 -1.26 -4.60 117.46 117.13 1z84 n PHE 65 Ca 0.02 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.04 1z84 n PHE 65 Cb 0.11 -0.07 -0.04 0.00 -0.94 0.00 0.00 39.48 38.53 1z84 n PHE 65 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1z84 n ILE 67 N 0.22 0.48 0.00 0.00 3.06 -1.14 -1.74 119.36 120.24 1z84 n ILE 67 Ca 0.04 -0.09 0.00 0.00 -2.50 0.00 0.00 62.75 60.20 1z84 n ILE 67 Cb 0.48 -2.15 0.00 0.00 0.54 0.00 0.00 39.64 38.52 1z84 n ILE 67 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 1z84 n GLY 68 N 4.31 1.19 2.42 4.50 0.00 -1.26 -5.03 105.19 111.31 1z84 n GLY 68 Ca 0.19 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.21 1z84 n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1z84 n ARG 69 N -0.80 1.29 0.09 1.61 1.74 -0.71 -4.97 116.66 114.90 1z84 n ARG 69 Ca 0.00 -3.10 -0.05 0.00 -0.77 0.00 0.00 57.85 53.93 1z84 n ARG 69 Cb 0.00 -1.17 0.08 0.00 -1.02 0.00 0.00 32.46 30.35 1z84 n ARG 69 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1z84 h GLU 70 N 2.13 0.18 0.00 5.56 3.07 -1.81 -3.18 114.58 120.52 1z84 h GLU 70 Ca -0.15 -0.14 0.00 0.00 -0.50 0.00 0.00 59.36 58.56 1z84 h GLU 70 Cb 1.45 0.03 0.00 0.00 -0.84 0.00 0.00 28.75 29.39 1z84 h GLU 70 CO 0.17 0.80 0.00 0.37 -1.40 0.00 0.00 179.01 178.95 1z84 h GLN 71 N 0.12 0.00 0.00 2.33 5.75 -1.93 -1.64 115.11 119.74 1z84 h GLN 71 Ca -0.02 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.48 1z84 h GLN 71 Cb 1.24 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.79 1z84 h GLN 71 CO 0.10 0.00 0.00 -1.91 -2.65 0.00 0.00 178.83 174.37 1z84 n GLU 72 N -2.98 0.82 -4.43 1.69 2.13 -1.20 -4.86 120.64 111.82 1z84 n GLU 72 Ca -0.00 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.57 1z84 n GLU 72 Cb 0.25 -1.10 -0.10 0.00 0.27 0.00 0.00 31.44 30.76 1z84 n GLU 72 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1z84 s ALA 74 N -2.23 1.07 0.17 0.00 0.00 -1.26 -4.86 121.76 114.65 1z84 s ALA 74 Ca 0.28 0.30 -0.33 0.00 0.00 0.00 0.00 51.96 52.20 1z84 s ALA 74 Cb -0.06 -3.35 -0.16 0.00 0.00 0.00 0.00 23.12 19.55 1z84 s ALA 74 CO 0.14 -2.88 1.18 -2.30 0.00 0.00 0.00 175.76 171.90 1z84 n PRO 75 N -4.29 1.19 -2.47 0.00 -0.02 -1.26 -4.44 135.00 123.71 1z84 n PRO 75 Ca 0.09 0.42 -0.40 0.00 -2.02 0.00 0.00 63.50 61.59 1z84 n PRO 75 Cb 0.53 -1.94 -0.04 0.00 -0.02 0.00 0.00 33.50 32.03 1z84 n PRO 75 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1z84 s GLU 76 N -0.33 4.63 -0.23 -0.52 2.12 -1.26 -1.30 118.70 121.81 1z84 s GLU 76 Ca 0.74 1.81 -0.10 0.00 0.36 0.00 0.00 54.97 57.78 1z84 s GLU 76 Cb -0.85 -3.19 -0.18 0.00 0.26 0.00 0.00 34.13 30.17 1z84 s GLU 76 CO 0.52 0.19 -0.06 1.28 -0.54 0.00 0.00 175.26 176.65 1z84 n LEU 77 N 1.27 2.33 -3.80 2.70 4.77 0.85 -4.91 117.00 120.21 1z84 n LEU 77 Ca -0.01 0.21 -0.04 0.00 -0.03 0.00 0.00 56.01 56.14 1z84 n LEU 77 Cb 0.45 -0.93 -0.01 0.00 -2.33 0.00 0.00 43.42 40.60 1z84 n LEU 77 CO 0.54 0.66 0.68 0.72 -1.33 0.00 0.00 177.39 178.66 1z84 s PHE 78 N -2.49 -0.08 0.21 -1.77 -0.12 -1.15 -5.04 117.98 107.54 1z84 s PHE 78 Ca -0.32 -0.29 -0.01 0.00 -0.05 0.00 0.00 56.93 56.26 1z84 s PHE 78 Cb 0.10 0.68 -0.04 0.00 -0.63 0.00 0.00 43.02 43.12 1z84 s PHE 78 CO 0.60 -0.97 0.13 -0.98 -0.05 0.00 0.00 175.22 173.94 1z84 s ARG 79 N -3.12 1.24 -0.05 1.99 1.70 -1.26 -1.55 118.95 117.90 1z84 s ARG 79 Ca 0.14 -1.66 0.00 0.00 -0.47 0.00 0.00 55.73 53.75 1z84 s ARG 79 Cb -0.03 0.20 0.02 0.00 -0.57 0.00 0.00 34.95 34.58 1z84 s ARG 79 CO 0.04 -0.38 -0.03 0.08 -1.08 0.00 0.00 175.30 173.93 1z84 s VAL 80 N -4.09 0.50 0.58 4.99 1.01 -0.58 -3.38 120.40 119.44 1z84 s VAL 80 Ca 0.39 -0.06 -0.19 0.00 0.00 0.00 0.00 61.98 62.11 1z84 s VAL 80 Cb 0.07 -0.56 -0.05 0.00 0.00 0.00 0.00 36.38 35.84 1z84 s VAL 80 CO 0.13 0.24 1.04 -2.65 0.00 0.00 0.00 175.10 173.85 1z84 n PRO 81 N 4.34 1.05 -1.68 2.72 -0.02 -1.26 -0.17 135.00 139.98 1z84 n PRO 81 Ca -0.20 0.40 -0.43 0.00 -2.02 0.00 0.00 63.50 61.25 1z84 n PRO 81 Cb 0.51 -2.23 -0.03 0.00 -0.02 0.00 0.00 33.50 31.73 1z84 n PRO 81 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1z84 s ASP 82 N -1.17 5.70 -0.48 2.55 2.15 -1.22 -1.39 116.67 122.82 1z84 s ASP 82 Ca 0.75 1.95 0.00 0.00 0.43 0.00 0.00 52.55 55.67 1z84 s ASP 82 Cb -0.43 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 39.68 1z84 s ASP 82 CO 0.48 -1.76 0.00 1.41 -0.17 0.00 0.00 175.17 175.13 1z84 n HIS 83 N 10.72 0.00 -2.84 -5.34 8.25 -1.26 -5.00 115.22 119.75 1z84 n HIS 83 Ca 0.27 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.31 1z84 n HIS 83 Cb 0.45 -1.33 -0.04 0.00 1.12 0.00 0.00 29.99 30.19 1z84 n HIS 83 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1z84 s ASP 84 N -2.45 6.94 0.45 0.41 3.68 -0.49 -4.93 116.67 120.27 1z84 s ASP 84 Ca 0.00 1.16 0.20 0.00 2.13 0.00 0.00 52.55 56.04 1z84 s ASP 84 Cb 0.00 -2.46 1.16 0.00 -1.45 0.00 0.00 42.92 40.16 1z84 s ASP 84 CO 0.00 -0.50 1.88 -0.65 0.13 0.00 0.00 175.17 176.04 1z84 h PRO 85 N 7.49 0.31 -3.53 4.34 0.11 -1.94 -3.19 132.00 135.59 1z84 h PRO 85 Ca -0.25 -0.02 -0.76 0.00 0.11 0.00 0.00 66.00 65.08 1z84 h PRO 85 Cb 1.10 -0.07 -0.18 0.00 0.11 0.00 0.00 31.00 31.97 1z84 h PRO 85 CO 0.88 0.21 1.74 -1.71 -0.21 0.00 0.00 178.00 178.90 1z84 n ASN 86 N -4.46 5.32 -4.79 -2.05 5.15 -1.26 -5.02 115.26 108.15 1z84 n ASN 86 Ca 0.17 -3.14 -0.35 0.00 -0.60 0.00 0.00 54.58 50.66 1z84 n ASN 86 Cb 0.70 -1.45 -0.03 0.00 -0.53 0.00 0.00 39.78 38.46 1z84 n ASN 86 CO 0.00 0.00 0.00 -1.66 1.40 0.00 0.00 177.26 177.00 1z84 s TRP 87 N -0.03 3.02 -0.15 1.20 1.48 -1.21 -4.66 118.94 118.59 1z84 s TRP 87 Ca 0.38 1.59 0.16 0.00 -1.06 0.00 0.00 56.10 57.17 1z84 s TRP 87 Cb 0.07 -3.15 -0.22 0.00 -1.16 0.00 0.00 33.47 29.01 1z84 s TRP 87 CO 0.02 -0.95 0.11 1.63 -4.06 0.00 0.00 176.95 173.69 1z84 n LYS 88 N -0.68 1.13 -3.75 3.25 5.02 0.76 -4.53 118.16 119.35 1z84 n LYS 88 Ca 0.08 -0.03 -0.10 0.00 -2.02 0.00 0.00 58.31 56.24 1z84 n LYS 88 Cb 0.51 -1.44 -0.07 0.00 -0.02 0.00 0.00 35.03 34.02 1z84 n LYS 88 CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 1z84 s LEU 89 N -5.12 0.90 0.03 -0.35 0.05 -0.96 -3.54 118.68 109.70 1z84 s LEU 89 Ca -0.08 -0.35 0.02 0.00 0.05 0.00 0.00 54.13 53.76 1z84 s LEU 89 Cb 0.06 1.40 -0.02 0.00 -2.05 0.00 0.00 46.19 45.58 1z84 s LEU 89 CO 0.71 -0.71 -0.07 -0.13 -0.55 0.00 0.00 176.35 175.59 1z84 s ARG 90 N -3.26 0.50 -0.23 1.48 0.52 -0.77 -1.52 118.95 115.67 1z84 s ARG 90 Ca -0.00 -0.60 0.00 0.00 -0.52 0.00 0.00 55.73 54.61 1z84 s ARG 90 Cb 0.02 -0.33 0.03 0.00 0.52 0.00 0.00 34.95 35.18 1z84 s ARG 90 CO -0.08 0.07 -0.12 0.08 0.02 0.00 0.00 175.30 175.27 1z84 s VAL 91 N -1.03 2.48 0.30 3.52 1.01 -0.60 -0.60 120.40 125.48 1z84 s VAL 91 Ca -0.07 -1.09 0.08 0.00 0.00 0.00 0.00 61.98 60.91 1z84 s VAL 91 Cb -0.08 -2.22 -0.06 0.00 0.00 0.00 0.00 36.38 34.02 1z84 s VAL 91 CO 0.00 0.28 -0.09 0.27 0.00 0.00 0.00 175.10 175.56 1z84 s ILE 92 N 1.28 1.96 0.46 2.22 -4.36 0.34 -0.10 121.20 122.99 1z84 s ILE 92 Ca 0.00 -2.19 -0.22 0.00 -0.26 0.00 0.00 60.65 57.98 1z84 s ILE 92 Cb -0.16 -2.47 -0.07 0.00 1.25 0.00 0.00 42.46 41.01 1z84 s ILE 92 CO -0.07 -0.30 1.14 -1.61 0.24 0.00 0.00 174.94 174.33 1z84 s GLU 93 N -3.65 3.77 0.13 0.37 2.02 -0.42 -0.02 118.70 120.90 1z84 s GLU 93 Ca 0.30 1.69 -0.30 0.00 0.02 0.00 0.00 54.97 56.68 1z84 s GLU 93 Cb 0.02 -2.36 -0.07 0.00 0.10 0.00 0.00 34.13 31.82 1z84 s GLU 93 CO 0.13 -0.53 1.12 1.21 0.02 0.00 0.00 175.26 177.22 1z84 s ASN 94 N -1.47 7.22 0.35 -0.19 3.84 -0.50 -4.35 114.94 119.84 1z84 s ASN 94 Ca 0.64 2.04 0.12 0.00 0.21 0.00 0.00 52.86 55.87 1z84 s ASN 94 Cb -0.26 -2.59 0.64 0.00 -0.55 0.00 0.00 41.25 38.48 1z84 s ASN 94 CO 0.32 -0.29 1.78 0.25 -2.79 0.00 0.00 177.10 176.37 1z84 h LEU 95 N 5.66 0.03 -6.49 3.21 5.85 -1.95 -3.32 115.31 118.30 1z84 h LEU 95 Ca -0.43 -0.01 -0.60 0.00 0.84 0.00 0.00 57.88 57.68 1z84 h LEU 95 Cb 1.21 -0.01 -0.41 0.00 0.37 0.00 0.00 40.66 41.83 1z84 h LEU 95 CO 0.75 0.44 -0.70 -1.22 -0.34 0.00 0.00 178.44 177.36 1z84 n TYR 96 N -4.04 2.42 -2.63 1.25 4.02 -1.26 -5.05 117.16 111.87 1z84 n TYR 96 Ca -0.02 -4.03 -0.38 0.00 -0.01 0.00 0.00 57.90 53.47 1z84 n TYR 96 Cb 0.45 -0.45 -0.05 0.00 -0.02 0.00 0.00 39.34 39.26 1z84 n TYR 96 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 1z84 s PRO 97 N -1.66 4.44 0.26 -0.72 0.04 -1.25 -4.96 135.00 131.15 1z84 s PRO 97 Ca 0.33 1.50 0.13 0.00 0.04 0.00 0.00 61.00 63.00 1z84 s PRO 97 Cb 0.07 -2.80 0.22 0.00 0.04 0.00 0.00 34.50 32.04 1z84 s PRO 97 CO -0.10 0.11 1.52 0.00 0.04 0.00 0.00 177.00 178.57 1z84 h ALA 98 N 3.08 0.74 -2.75 8.56 0.00 -1.95 -3.45 119.26 123.50 1z84 h ALA 98 Ca -0.47 -0.57 -0.49 0.00 0.00 0.00 0.00 54.91 53.38 1z84 h ALA 98 Cb 1.20 -0.10 -0.17 0.00 0.00 0.00 0.00 17.79 18.72 1z84 h ALA 98 CO 0.64 0.78 -0.77 -0.51 0.00 0.00 0.00 179.25 179.40 1z84 s LEU 99 N -6.94 2.46 -0.25 0.00 1.43 -1.26 -5.05 118.68 109.07 1z84 s LEU 99 Ca 0.01 -0.89 -0.08 0.00 -1.03 0.00 0.00 54.13 52.14 1z84 s LEU 99 Cb 0.10 -0.75 -0.03 0.00 0.03 0.00 0.00 46.19 45.54 1z84 s LEU 99 CO 0.75 -0.08 0.09 -0.55 0.23 0.00 0.00 176.35 176.79 1z84 s SER 100 N -2.79 5.32 0.39 2.29 0.15 0.14 -4.59 113.70 114.61 1z84 s SER 100 Ca 0.16 -0.16 0.28 0.00 0.70 0.00 0.00 55.95 56.93 1z84 s SER 100 Cb -0.04 -1.96 1.27 0.00 -1.71 0.00 0.00 66.02 63.57 1z84 s SER 100 CO 0.06 -0.03 1.84 0.08 1.20 0.00 0.00 173.24 176.39 1z84 h ARG 101 N 8.22 0.00 -0.04 5.44 0.11 -1.72 -2.78 114.38 123.61 1z84 h ARG 101 Ca -0.38 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.70 1z84 h ARG 101 Cb 1.18 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.26 1z84 h ARG 101 CO 0.57 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.73 1z84 n ASN 102 N -2.54 0.67 -1.36 0.08 3.02 -1.26 -3.88 115.26 109.98 1z84 n ASN 102 Ca 0.00 -1.36 0.08 0.00 -0.03 0.00 0.00 54.58 53.27 1z84 n ASN 102 Cb 0.19 -0.02 0.32 0.00 -0.61 0.00 0.00 39.78 39.66 1z84 n ASN 102 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1z84 n LEU 103 N -0.42 4.61 -0.15 3.41 4.77 -1.09 -4.72 117.00 123.42 1z84 n LEU 103 Ca 0.19 -2.75 -0.08 0.00 -0.03 0.00 0.00 56.01 53.34 1z84 n LEU 103 Cb 0.20 -0.57 0.01 0.00 -2.33 0.00 0.00 43.42 40.73 1z84 n LEU 103 CO 0.15 0.70 1.02 -0.08 -1.33 0.00 0.00 177.39 177.85 1z84 h GLU 104 N 3.11 0.60 -0.46 3.23 4.81 -1.80 -1.22 114.58 122.84 1z84 h GLU 104 Ca 0.00 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.12 1z84 h GLU 104 Cb 1.55 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.78 1z84 h GLU 104 CO 0.29 0.45 0.07 1.79 -0.73 0.00 0.00 179.01 180.88 1z84 h THR 105 N 0.58 1.22 0.00 0.32 1.35 -1.92 0.18 112.91 114.63 1z84 h THR 105 Ca 0.16 -0.81 -0.01 0.00 -0.55 0.00 0.00 66.41 65.20 1z84 h THR 105 Cb 0.01 0.79 -0.00 0.00 -1.73 0.00 0.00 68.15 67.22 1z84 h THR 105 CO -0.03 0.29 -0.03 1.56 -0.25 0.00 0.00 175.52 177.07 1z84 h GLN 106 N 0.68 0.00 0.00 4.72 4.20 -1.78 -3.54 115.11 119.39 1z84 h GLN 106 Ca 0.15 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.86 1z84 h GLN 106 Cb 0.32 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.10 1z84 h GLN 106 CO 0.00 0.03 0.00 0.43 -0.67 0.00 0.00 178.83 178.62 1z84 n SER 107 N -3.12 0.00 0.00 1.46 7.64 0.05 -4.77 113.62 114.88 1z84 n SER 107 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1z84 n SER 107 Cb 0.37 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.57 1z84 n SER 107 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 1z84 n ARG 116 N 0.00 0.00 -4.21 1.43 1.85 -1.26 -4.67 116.66 109.80 1z84 n ARG 116 Ca 0.00 0.00 -0.17 0.00 -1.00 0.00 0.00 57.85 56.68 1z84 n ARG 116 Cb 0.00 -0.88 -0.15 0.00 -1.05 0.00 0.00 32.46 30.38 1z84 n ARG 116 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1z84 s THR 117 N -0.41 0.48 0.05 8.89 2.01 -1.26 -5.16 115.64 120.24 1z84 s THR 117 Ca 0.00 -0.25 0.01 0.00 0.31 0.00 0.00 61.69 61.75 1z84 s THR 117 Cb 0.00 -0.41 -0.03 0.00 0.01 0.00 0.00 72.50 72.07 1z84 s THR 117 CO 0.00 0.14 -0.05 0.27 -0.69 0.00 0.00 174.62 174.29 1z84 s ILE 118 N -0.10 0.36 0.56 1.82 -4.36 -1.26 -5.15 121.20 113.08 1z84 s ILE 118 Ca 0.02 -1.46 -0.20 0.00 -0.26 0.00 0.00 60.65 58.76 1z84 s ILE 118 Cb -0.03 -1.04 -0.05 0.00 1.25 0.00 0.00 42.46 42.59 1z84 s ILE 118 CO -0.00 -0.72 1.19 0.68 0.24 0.00 0.00 174.94 176.33 1z84 s VAL 119 N -2.69 2.82 -0.79 8.37 -7.23 -1.26 -4.85 120.40 114.76 1z84 s VAL 119 Ca -0.01 0.53 -0.08 0.00 -1.81 0.00 0.00 61.98 60.61 1z84 s VAL 119 Cb -0.01 -3.22 -0.15 0.00 0.56 0.00 0.00 36.38 33.56 1z84 s VAL 119 CO -0.04 -0.09 3.23 0.61 -0.31 0.00 0.00 175.10 178.49 1z84 n GLY 120 N 0.40 3.74 3.76 2.32 0.00 -1.26 -4.91 105.19 109.24 1z84 n GLY 120 Ca 0.12 -1.42 -0.40 0.00 0.00 0.00 0.00 46.02 44.32 1z84 n GLY 120 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1z84 s PHE 121 N 1.19 3.91 -1.36 1.61 5.36 -1.26 0.27 117.98 127.70 1z84 s PHE 121 Ca 0.67 1.76 0.00 0.00 -0.96 0.00 0.00 56.93 58.40 1z84 s PHE 121 Cb 0.26 -2.90 0.00 0.00 -0.34 0.00 0.00 43.02 40.04 1z84 s PHE 121 CO -0.04 0.43 0.00 0.41 -1.46 0.00 0.00 175.22 174.55 1z84 n GLY 122 N 1.72 -1.55 3.33 13.12 0.00 -1.07 -4.19 105.19 116.55 1z84 n GLY 122 Ca -0.03 -1.07 -0.32 0.00 0.00 0.00 0.00 46.02 44.60 1z84 n GLY 122 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1z84 s PHE 123 N -2.15 2.65 -0.23 1.61 0.08 -0.94 -2.12 117.98 116.88 1z84 s PHE 123 Ca 0.00 -0.68 0.00 0.00 0.12 0.00 0.00 56.93 56.37 1z84 s PHE 123 Cb 0.00 -1.72 0.06 0.00 -0.57 0.00 0.00 43.02 40.79 1z84 s PHE 123 CO 0.00 -0.20 -0.03 -1.58 -0.10 0.00 0.00 175.22 173.31 1z84 s HIS 124 N 0.06 2.12 0.25 0.36 2.46 -1.26 -0.03 115.29 119.25 1z84 s HIS 124 Ca -0.08 -1.59 0.12 0.00 0.47 0.00 0.00 55.06 53.98 1z84 s HIS 124 Cb -0.15 -1.48 -0.05 0.00 -0.13 0.00 0.00 32.58 30.77 1z84 s HIS 124 CO 0.05 -0.75 -0.21 -0.51 -2.47 0.00 0.00 174.74 170.86 1z84 s ASP 125 N 1.49 3.50 -0.10 9.88 1.01 0.07 -1.41 116.67 131.11 1z84 s ASP 125 Ca -0.04 -0.98 0.04 0.00 0.71 0.00 0.00 52.55 52.28 1z84 s ASP 125 Cb -0.18 -0.28 -0.01 0.00 1.01 0.00 0.00 42.92 43.46 1z84 s ASP 125 CO -0.07 0.06 -0.22 -0.69 0.21 0.00 0.00 175.17 174.46 1z84 s VAL 126 N -2.25 2.30 -0.36 -1.27 1.01 0.97 -1.18 120.40 119.63 1z84 s VAL 126 Ca 0.27 -0.94 -0.11 0.00 0.00 0.00 0.00 61.98 61.19 1z84 s VAL 126 Cb -0.06 -1.89 0.02 0.00 0.00 0.00 0.00 36.38 34.45 1z84 s VAL 126 CO 0.13 0.56 0.20 -0.69 0.00 0.00 0.00 175.10 175.30 1z84 s VAL 127 N 0.20 4.64 -0.25 2.92 1.01 0.90 -0.50 120.40 129.32 1z84 s VAL 127 Ca -0.13 -0.72 -0.20 0.00 0.00 0.00 0.00 61.98 60.93 1z84 s VAL 127 Cb -0.16 -3.53 -0.02 0.00 0.00 0.00 0.00 36.38 32.67 1z84 s VAL 127 CO 0.07 -0.16 0.63 -0.63 0.00 0.00 0.00 175.10 175.01 1z84 s ILE 128 N 1.58 4.99 -1.62 2.22 1.01 0.23 -0.65 121.20 128.96 1z84 s ILE 128 Ca 0.03 1.13 0.24 0.00 0.00 0.00 0.00 60.65 62.05 1z84 s ILE 128 Cb -0.19 -3.93 0.06 0.00 0.01 0.00 0.00 42.46 38.42 1z84 s ILE 128 CO 0.07 0.04 1.29 -0.62 0.00 0.00 0.00 174.94 175.72 1z84 n GLU 129 N 5.60 0.71 -3.61 2.79 1.02 -0.72 -1.85 120.64 124.58 1z84 n GLU 129 Ca -0.01 -0.51 -0.14 0.00 -0.02 0.00 0.00 57.16 56.48 1z84 n GLU 129 Cb 0.49 -1.49 -0.07 0.00 -0.02 0.00 0.00 31.44 30.35 1z84 n GLU 129 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1z84 s SER 130 N -2.64 -0.67 0.18 1.62 0.15 -1.23 -4.74 113.70 106.36 1z84 s SER 130 Ca 0.18 1.20 0.22 0.00 0.70 0.00 0.00 55.95 58.25 1z84 s SER 130 Cb 0.18 1.18 0.89 0.00 -1.71 0.00 0.00 66.02 66.57 1z84 s SER 130 CO 0.62 -0.29 1.68 -0.81 1.20 0.00 0.00 173.24 175.63 1z84 n PRO 131 N 2.26 0.15 -3.75 5.44 -0.04 -1.25 -4.82 135.00 132.99 1z84 n PRO 131 Ca -0.14 0.33 -0.36 0.00 -0.04 0.00 0.00 63.50 63.28 1z84 n PRO 131 Cb 0.56 -1.75 -0.10 0.00 -0.04 0.00 0.00 33.50 32.16 1z84 n PRO 131 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1z84 s VAL 132 N -3.19 5.04 0.19 0.52 1.01 -1.26 -2.87 120.40 119.84 1z84 s VAL 132 Ca 0.06 0.07 -0.11 0.00 0.00 0.00 0.00 61.98 62.00 1z84 s VAL 132 Cb 0.10 -3.34 0.12 0.00 0.00 0.00 0.00 36.38 33.27 1z84 s VAL 132 CO 0.40 0.36 1.83 -0.74 0.00 0.00 0.00 175.10 176.95 1z84 h HIS 133 N 7.58 0.90 -0.01 5.22 2.76 -1.96 -3.07 115.15 126.56 1z84 h HIS 133 Ca -0.37 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.79 1z84 h HIS 133 Cb 1.17 -0.29 0.00 0.00 1.55 0.00 0.00 27.41 29.84 1z84 h HIS 133 CO 0.66 0.61 -0.09 -1.13 -1.30 0.00 0.00 177.93 176.68 1z84 n SER 134 N -4.55 1.19 -4.71 3.26 3.41 -1.26 -4.44 113.62 106.51 1z84 n SER 134 Ca 0.06 -1.21 -0.42 0.00 -0.26 0.00 0.00 58.87 57.04 1z84 n SER 134 Cb 0.06 0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 64.01 1z84 n SER 134 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1z84 s ILE 135 N -2.19 3.52 0.14 -1.33 -1.09 -1.16 -5.04 121.20 114.04 1z84 s ILE 135 Ca 0.33 1.09 -0.03 0.00 -2.23 0.00 0.00 60.65 59.81 1z84 s ILE 135 Cb 0.20 -3.70 -0.05 0.00 -1.58 0.00 0.00 42.46 37.34 1z84 s ILE 135 CO 0.41 0.08 0.35 -1.10 -1.23 0.00 0.00 174.94 173.45 1z84 s GLN 136 N 1.12 3.56 0.29 2.79 -0.21 -1.26 -4.21 119.66 121.74 1z84 s GLN 136 Ca 0.63 -0.21 0.04 0.00 0.02 0.00 0.00 55.36 55.84 1z84 s GLN 136 Cb -0.35 -2.88 0.73 0.00 1.00 0.00 0.00 33.01 31.52 1z84 s GLN 136 CO 0.30 0.48 1.70 1.25 -2.12 0.00 0.00 175.29 176.90 1z84 h LEU 137 N 2.67 0.36 -0.37 2.90 5.85 -1.96 0.13 115.31 124.89 1z84 h LEU 137 Ca -0.46 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.41 1z84 h LEU 137 Cb 1.17 0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.32 1z84 h LEU 137 CO 0.72 0.01 0.00 -1.54 -0.34 0.00 0.00 178.44 177.29 1z84 n SER 138 N -5.03 0.54 0.19 1.25 3.41 -1.26 -1.97 113.62 110.76 1z84 n SER 138 Ca 0.22 0.61 0.08 0.00 -0.26 0.00 0.00 58.87 59.52 1z84 n SER 138 Cb 0.65 -0.73 0.14 0.00 -0.26 0.00 0.00 64.21 64.01 1z84 n SER 138 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1z84 h ASP 139 N 0.00 0.00 -4.08 4.04 3.32 -1.12 -3.46 116.42 115.12 1z84 h ASP 139 Ca 0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 1z84 h ASP 139 Cb 0.44 0.00 0.10 0.00 0.22 0.00 0.00 39.33 40.09 1z84 h ASP 139 CO 0.00 0.21 0.48 -0.63 -1.72 0.00 0.00 179.24 177.58 1z84 s ILE 140 N -3.14 2.75 0.58 0.35 1.01 -0.83 -5.00 121.20 116.91 1z84 s ILE 140 Ca 0.05 0.49 -0.16 0.00 0.00 0.00 0.00 60.65 61.03 1z84 s ILE 140 Cb 0.06 -3.21 -0.04 0.00 0.01 0.00 0.00 42.46 39.28 1z84 s ILE 140 CO 0.69 -0.08 1.05 1.51 0.00 0.00 0.00 174.94 178.12 1z84 s ASP 141 N -1.53 5.90 0.37 3.58 1.47 -1.26 -4.79 116.67 120.41 1z84 s ASP 141 Ca 0.74 1.79 0.16 0.00 1.18 0.00 0.00 52.55 56.42 1z84 s ASP 141 Cb -0.30 -2.53 1.04 0.00 -0.34 0.00 0.00 42.92 40.80 1z84 s ASP 141 CO 0.33 -1.09 1.75 -0.65 0.68 0.00 0.00 175.17 176.20 1z84 h PRO 142 N 0.53 0.43 -0.56 2.11 0.11 -1.91 -0.79 132.00 131.91 1z84 h PRO 142 Ca -0.47 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 1z84 h PRO 142 Cb 1.22 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 1z84 h PRO 142 CO 0.58 0.28 0.08 0.28 -0.21 0.00 0.00 178.00 179.02 1z84 h VAL 143 N 0.44 1.26 -0.47 3.15 2.07 -1.92 0.90 116.25 121.68 1z84 h VAL 143 Ca 0.62 -0.98 -0.11 0.00 0.82 0.00 0.00 66.70 67.04 1z84 h VAL 143 Cb 1.46 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 32.01 1z84 h VAL 143 CO -0.36 0.36 -0.15 1.23 0.02 0.00 0.00 177.57 178.66 1z84 h GLY 144 N 0.83 0.98 0.96 2.17 0.00 -1.55 0.28 103.07 106.74 1z84 h GLY 144 Ca 0.17 -0.81 -0.03 0.00 0.00 0.00 0.00 47.33 46.66 1z84 h GLY 144 CO 0.01 0.74 0.16 -2.22 0.00 0.00 0.00 176.54 175.23 1z84 h ILE 145 N 0.80 1.22 -0.77 2.60 2.04 -1.13 -2.33 117.51 119.94 1z84 h ILE 145 Ca 0.12 -0.70 0.17 0.00 1.00 0.00 0.00 64.86 65.45 1z84 h ILE 145 Cb 0.69 0.81 -0.11 0.00 -0.74 0.00 0.00 36.82 37.47 1z84 h ILE 145 CO 0.05 0.26 0.24 1.23 0.00 0.00 0.00 178.15 179.92 1z84 h GLY 146 N 0.60 1.14 0.94 5.37 0.00 -0.31 -0.71 103.07 110.10 1z84 h GLY 146 Ca 0.15 -0.08 0.02 0.00 0.00 0.00 0.00 47.33 47.42 1z84 h GLY 146 CO -0.01 -0.19 0.57 -0.55 0.00 0.00 0.00 176.54 176.36 1z84 h ASP 147 N 0.32 0.97 -0.42 0.19 3.45 -0.51 0.03 116.42 120.46 1z84 h ASP 147 Ca 0.44 -0.02 -0.03 0.00 0.43 0.00 0.00 57.03 57.86 1z84 h ASP 147 Cb 0.76 -0.23 -0.02 0.00 -0.56 0.00 0.00 39.33 39.28 1z84 h ASP 147 CO -0.50 0.68 0.15 0.40 -1.57 0.00 0.00 179.24 178.41 1z84 h ILE 148 N 1.14 1.20 -0.81 0.35 2.04 -0.79 0.14 117.51 120.79 1z84 h ILE 148 Ca 0.34 -0.65 -0.03 0.00 1.00 0.00 0.00 64.86 65.52 1z84 h ILE 148 Cb -0.06 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 36.83 1z84 h ILE 148 CO -0.09 0.23 0.39 -0.07 0.00 0.00 0.00 178.15 178.61 1z84 h LEU 149 N 0.53 1.05 -0.99 1.44 3.38 -0.64 -0.51 115.31 119.56 1z84 h LEU 149 Ca 0.14 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 1z84 h LEU 149 Cb 0.21 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1z84 h LEU 149 CO -0.01 0.88 -0.42 0.40 0.09 0.00 0.00 178.44 179.38 1z84 h ILE 150 N 1.15 1.31 -0.35 1.22 1.08 -0.57 -1.96 117.51 119.39 1z84 h ILE 150 Ca 0.28 -1.53 -0.06 0.00 -0.39 0.00 0.00 64.86 63.16 1z84 h ILE 150 Cb 0.11 1.73 -0.01 0.00 -3.07 0.00 0.00 36.82 35.58 1z84 h ILE 150 CO -0.04 0.45 -0.02 0.00 -0.69 0.00 0.00 178.15 177.85 1z84 h ALA 151 N 1.43 0.48 -0.51 1.87 0.00 -0.14 0.94 119.26 123.33 1z84 h ALA 151 Ca 0.01 -0.26 0.10 0.00 0.00 0.00 0.00 54.91 54.76 1z84 h ALA 151 Cb 0.81 -0.13 -0.09 0.00 0.00 0.00 0.00 17.79 18.39 1z84 h ALA 151 CO 0.06 0.27 -0.01 1.88 0.00 0.00 0.00 179.25 181.45 1z84 h TYR 152 N 0.44 -0.06 -0.28 0.00 0.05 -0.77 -1.20 116.97 115.15 1z84 h TYR 152 Ca 0.10 0.04 0.05 0.00 0.05 0.00 0.00 58.73 58.97 1z84 h TYR 152 Cb 0.50 0.11 -0.05 0.00 1.01 0.00 0.00 36.73 38.30 1z84 h TYR 152 CO 0.04 -0.13 -0.02 -0.22 -1.05 0.00 0.00 178.16 176.78 1z84 h LYS 153 N 0.10 0.06 -0.19 4.88 3.64 -0.99 -0.34 116.57 123.73 1z84 h LYS 153 Ca 0.26 -0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.68 1z84 h LYS 153 Cb 0.39 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.15 1z84 h LYS 153 CO -0.44 0.04 -0.15 -0.22 -2.27 0.00 0.00 179.45 176.41 1z84 h LYS 154 N 0.06 -0.15 -0.65 1.90 3.64 -0.11 -2.28 116.57 118.99 1z84 h LYS 154 Ca 0.13 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.48 1z84 h LYS 154 Cb 0.18 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 1z84 h LYS 154 CO -0.24 -0.10 0.24 -0.09 -2.27 0.00 0.00 179.45 176.99 1z84 h ARG 155 N -0.15 0.98 -0.63 1.90 9.65 -1.08 -1.93 114.38 123.11 1z84 h ARG 155 Ca 0.11 -0.19 0.09 0.00 -1.10 0.00 0.00 59.98 58.90 1z84 h ARG 155 Cb 0.32 -0.15 -0.07 0.00 -1.39 0.00 0.00 29.97 28.68 1z84 h ARG 155 CO -0.28 0.84 0.25 0.82 2.80 0.00 0.00 179.97 184.40 1z84 h ILE 156 N 0.92 0.78 -0.25 1.20 2.04 -0.92 -0.58 117.51 120.71 1z84 h ILE 156 Ca 0.21 -0.15 -0.08 0.00 1.00 0.00 0.00 64.86 65.85 1z84 h ILE 156 Cb 0.23 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 36.60 1z84 h ILE 156 CO -0.01 0.08 -0.17 0.78 0.00 0.00 0.00 178.15 178.83 1z84 h ASN 157 N 0.44 0.42 0.27 1.72 2.35 -0.99 0.34 115.58 120.13 1z84 h ASN 157 Ca 0.32 -0.12 -0.01 0.00 -0.55 0.00 0.00 56.30 55.94 1z84 h ASN 157 Cb 0.38 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.64 1z84 h ASN 157 CO -0.30 0.61 -0.13 1.56 -1.65 0.00 0.00 177.43 177.53 1z84 h GLN 158 N 0.40 -0.34 -0.77 0.81 4.20 -0.99 -3.20 115.11 115.20 1z84 h GLN 158 Ca 0.07 0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.83 1z84 h GLN 158 Cb 0.53 0.08 -0.04 0.00 0.30 0.00 0.00 27.48 28.35 1z84 h GLN 158 CO 0.03 -0.17 0.50 0.82 -0.67 0.00 0.00 178.83 179.34 1z84 h ILE 159 N -0.43 1.15 0.00 2.54 2.04 -0.65 -2.21 117.51 119.94 1z84 h ILE 159 Ca -0.04 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.48 1z84 h ILE 159 Cb 0.33 0.07 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 1z84 h ILE 159 CO 0.06 0.18 0.03 0.00 0.00 0.00 0.00 178.15 178.42 1z84 n ALA 160 N -2.32 0.98 0.54 1.87 0.00 0.11 -0.80 120.51 120.89 1z84 n ALA 160 Ca 0.08 0.12 0.08 0.00 0.00 0.00 0.00 53.44 53.72 1z84 n ALA 160 Cb 0.06 -1.13 0.36 0.00 0.00 0.00 0.00 19.45 18.74 1z84 n ALA 160 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1z84 n GLN 161 N -1.93 0.03 -3.55 0.00 6.02 -0.83 -4.69 117.38 112.43 1z84 n GLN 161 Ca -0.01 0.24 -0.39 0.00 -0.01 0.00 0.00 57.00 56.83 1z84 n GLN 161 Cb 0.05 -1.55 -0.11 0.00 1.02 0.00 0.00 30.24 29.66 1z84 n GLN 161 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1z84 s HIS 162 N -3.04 3.23 0.32 1.08 3.76 0.02 -4.96 115.29 115.70 1z84 s HIS 162 Ca 0.07 -0.08 0.36 0.00 -0.15 0.00 0.00 55.06 55.27 1z84 s HIS 162 Cb 0.10 -2.44 1.70 0.00 1.11 0.00 0.00 32.58 33.05 1z84 s HIS 162 CO 0.31 -0.28 2.11 0.22 -0.85 0.00 0.00 174.74 176.25 1z84 h ASP 163 N 8.44 0.00 1.16 1.40 -0.00 -1.87 -2.68 116.42 122.87 1z84 h ASP 163 Ca -0.33 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.70 1z84 h ASP 163 Cb 1.17 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.50 1z84 h ASP 163 CO 0.60 0.03 0.00 -1.54 -0.00 0.00 0.00 179.24 178.33 1z84 n SER 164 N -3.17 0.45 -4.75 2.28 3.41 -1.26 -4.77 113.62 105.80 1z84 n SER 164 Ca -0.01 0.55 -0.38 0.00 -0.26 0.00 0.00 58.87 58.78 1z84 n SER 164 Cb 0.23 -0.67 -0.06 0.00 -0.26 0.00 0.00 64.21 63.45 1z84 n SER 164 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1z84 s ILE 165 N -3.08 5.18 -0.09 -1.33 -1.09 -1.01 -4.33 121.20 115.45 1z84 s ILE 165 Ca 0.11 0.83 0.07 0.00 -2.23 0.00 0.00 60.65 59.43 1z84 s ILE 165 Cb 0.14 -3.75 -0.10 0.00 -1.58 0.00 0.00 42.46 37.17 1z84 s ILE 165 CO 0.53 0.39 0.19 0.59 -1.23 0.00 0.00 174.94 175.41 1z84 n ASN 166 N 3.26 2.58 -3.61 3.58 3.02 0.52 -4.82 115.26 119.80 1z84 n ASN 166 Ca -0.10 -0.17 -0.16 0.00 -0.03 0.00 0.00 54.58 54.12 1z84 n ASN 166 Cb 0.52 1.24 -0.07 0.00 -0.61 0.00 0.00 39.78 40.86 1z84 n ASN 166 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1z84 s TYR 167 N -2.27 -0.64 -0.14 3.10 6.14 -1.12 -1.64 117.35 120.78 1z84 s TYR 167 Ca -0.01 1.35 0.00 0.00 0.64 0.00 0.00 57.07 59.05 1z84 s TYR 167 Cb 0.05 0.30 0.02 0.00 0.42 0.00 0.00 41.96 42.75 1z84 s TYR 167 CO 0.29 -0.46 -0.13 0.42 0.64 0.00 0.00 175.55 176.31 1z84 s ILE 168 N -0.47 1.46 -0.39 3.14 1.01 -1.26 -0.57 121.20 124.13 1z84 s ILE 168 Ca -0.06 -0.56 -0.15 0.00 0.00 0.00 0.00 60.65 59.88 1z84 s ILE 168 Cb -0.03 -1.39 0.01 0.00 0.01 0.00 0.00 42.46 41.06 1z84 s ILE 168 CO 0.05 0.44 0.33 -1.58 0.00 0.00 0.00 174.94 174.18 1z84 s GLN 169 N 1.53 3.22 -0.15 2.79 2.00 -0.05 -4.90 119.66 124.09 1z84 s GLN 169 Ca 0.05 -0.77 -0.16 0.00 -2.00 0.00 0.00 55.36 52.47 1z84 s GLN 169 Cb -0.13 -3.91 -0.04 0.00 0.80 0.00 0.00 33.01 29.73 1z84 s GLN 169 CO -0.10 -0.67 0.41 0.08 -0.50 0.00 0.00 175.29 174.51 1z84 s VAL 170 N 1.86 5.22 0.06 1.34 1.01 -1.26 -1.04 120.40 127.58 1z84 s VAL 170 Ca 0.08 0.79 -0.14 0.00 0.00 0.00 0.00 61.98 62.71 1z84 s VAL 170 Cb -0.18 -3.75 0.02 0.00 0.00 0.00 0.00 36.38 32.48 1z84 s VAL 170 CO 0.11 0.32 0.31 0.72 0.00 0.00 0.00 175.10 176.57 1z84 s PHE 171 N 0.79 -0.10 -0.02 5.22 -0.12 -0.49 -1.68 117.98 121.59 1z84 s PHE 171 Ca 0.22 -0.09 0.05 0.00 -0.05 0.00 0.00 56.93 57.06 1z84 s PHE 171 Cb -0.14 0.11 -0.01 0.00 -0.63 0.00 0.00 43.02 42.35 1z84 s PHE 171 CO 0.08 -0.55 -0.18 0.21 -0.05 0.00 0.00 175.22 174.74 1z84 s LYS 172 N -2.92 1.48 -0.11 1.99 2.20 0.56 -0.56 119.74 122.38 1z84 s LYS 172 Ca -0.02 -0.63 0.02 0.00 -0.36 0.00 0.00 55.97 54.97 1z84 s LYS 172 Cb 0.00 -1.41 -0.01 0.00 -1.51 0.00 0.00 37.83 34.90 1z84 s LYS 172 CO -0.06 0.36 -0.17 -0.80 -0.36 0.00 0.00 175.35 174.33 1z84 s ASN 173 N -0.35 3.71 -0.13 1.43 0.01 -1.26 -1.84 114.94 116.51 1z84 s ASN 173 Ca 0.05 -0.39 0.00 0.00 -0.71 0.00 0.00 52.86 51.82 1z84 s ASN 173 Cb -0.07 -1.45 0.02 0.00 0.41 0.00 0.00 41.25 40.15 1z84 s ASN 173 CO -0.00 0.18 -0.12 -1.58 -1.51 0.00 0.00 177.10 174.07 1z84 s GLN 174 N 0.23 1.97 0.00 -0.60 0.74 -0.06 -4.72 119.66 117.22 1z84 s GLN 174 Ca -0.11 -0.44 0.00 0.00 0.05 0.00 0.00 55.36 54.86 1z84 s GLN 174 Cb -0.16 -1.85 0.00 0.00 1.10 0.00 0.00 33.01 32.10 1z84 s GLN 174 CO 0.06 -0.21 0.00 0.41 -0.55 0.00 0.00 175.29 175.00 1z84 n GLY 175 N 4.72 2.04 0.34 2.59 0.00 -1.26 -1.44 105.19 112.17 1z84 n GLY 175 Ca -0.16 -1.53 0.04 0.00 0.00 0.00 0.00 46.02 44.37 1z84 n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z84 h ALA 176 N 0.00 1.33 0.00 4.61 0.00 -1.95 -1.32 119.26 121.93 1z84 h ALA 176 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1z84 h ALA 176 Cb 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1z84 h ALA 176 CO 0.00 0.19 0.00 -1.13 0.00 0.00 0.00 179.25 178.31 1z84 n SER 177 N -4.67 0.60 -1.40 0.00 3.41 -1.26 -1.12 113.62 109.19 1z84 n SER 177 Ca 0.16 0.58 0.09 0.00 -0.26 0.00 0.00 58.87 59.44 1z84 n SER 177 Cb 0.29 -0.73 0.31 0.00 -0.26 0.00 0.00 64.21 63.83 1z84 n SER 177 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1z84 n ALA 178 N -1.72 2.88 -0.30 7.33 0.00 -0.54 -4.94 120.51 123.21 1z84 n ALA 178 Ca 0.05 -1.34 0.00 0.00 0.00 0.00 0.00 53.44 52.14 1z84 n ALA 178 Cb 0.35 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.79 1z84 n ALA 178 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1z84 n GLY 179 N 1.18 0.76 3.77 0.00 0.00 -0.27 -4.63 105.19 106.01 1z84 n GLY 179 Ca 0.23 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.87 1z84 n GLY 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z84 s ALA 180 N -2.28 3.16 -0.18 4.61 0.00 -0.91 -4.93 121.76 121.22 1z84 s ALA 180 Ca 0.00 0.84 0.02 0.00 0.00 0.00 0.00 51.96 52.82 1z84 s ALA 180 Cb 0.00 -3.33 -0.00 0.00 0.00 0.00 0.00 23.12 19.79 1z84 s ALA 180 CO 0.00 -0.34 0.30 -1.13 0.00 0.00 0.00 175.76 174.59 1z84 n SER 181 N 0.16 0.58 -3.89 0.00 3.41 -1.26 -4.23 113.62 108.39 1z84 n SER 181 Ca 0.04 -0.79 -0.12 0.00 -0.26 0.00 0.00 58.87 57.74 1z84 n SER 181 Cb 0.48 0.56 -0.14 0.00 -0.26 0.00 0.00 64.21 64.85 1z84 n SER 181 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1z84 s MET 182 N -0.75 0.07 0.17 4.33 1.00 -1.26 -5.06 119.30 117.80 1z84 s MET 182 Ca 0.02 -0.10 0.17 0.00 0.00 0.00 0.00 55.69 55.78 1z84 s MET 182 Cb 0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 34.83 34.81 1z84 s MET 182 CO 0.06 -0.00 1.11 0.66 0.00 0.00 0.00 175.02 176.85 1z84 h SER 183 N 5.93 0.00 -2.88 3.03 4.64 -1.96 -3.45 113.55 118.86 1z84 h SER 183 Ca -0.25 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.51 1z84 h SER 183 Cb 1.21 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 63.38 1z84 h SER 183 CO 0.50 0.47 0.81 1.57 -0.87 0.00 0.00 176.83 179.31 1z84 n HIS 184 N -3.01 2.57 -1.68 4.77 -0.00 -1.26 -4.89 115.22 111.72 1z84 n HIS 184 Ca -0.04 0.28 -0.45 0.00 -0.00 0.00 0.00 57.72 57.51 1z84 n HIS 184 Cb 0.76 -2.56 -0.04 0.00 -0.00 0.00 0.00 29.99 28.15 1z84 n HIS 184 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1z84 n SER 185 N 2.58 3.61 -3.47 0.26 2.88 -1.26 -4.96 113.62 113.26 1z84 n SER 185 Ca 0.12 1.00 -0.10 0.00 -1.33 0.00 0.00 58.87 58.55 1z84 n SER 185 Cb 0.34 -1.45 -0.02 0.00 -0.75 0.00 0.00 64.21 62.33 1z84 n SER 185 CO 0.00 0.00 0.00 -1.38 -1.23 0.00 0.00 175.04 172.43 1z84 s HIS 186 N 2.90 -0.44 0.38 0.66 -3.43 -1.26 -1.76 115.29 112.35 1z84 s HIS 186 Ca 0.86 0.30 0.06 0.00 -0.80 0.00 0.00 55.06 55.47 1z84 s HIS 186 Cb -0.60 0.54 -0.02 0.00 -1.43 0.00 0.00 32.58 31.06 1z84 s HIS 186 CO 0.43 -0.67 0.21 -1.54 -2.00 0.00 0.00 174.74 171.17 1z84 s SER 187 N -2.52 2.27 0.07 7.38 1.04 0.17 -4.49 113.70 117.63 1z84 s SER 187 Ca 0.03 -1.74 -0.01 0.00 0.48 0.00 0.00 55.95 54.70 1z84 s SER 187 Cb -0.01 0.57 -0.04 0.00 0.10 0.00 0.00 66.02 66.64 1z84 s SER 187 CO -0.10 -1.02 -0.00 -1.10 0.98 0.00 0.00 173.24 172.00 1z84 s GLN 188 N -3.56 0.70 -0.02 4.02 -0.21 0.27 -0.07 119.66 120.80 1z84 s GLN 188 Ca 0.32 -1.27 0.01 0.00 0.02 0.00 0.00 55.36 54.44 1z84 s GLN 188 Cb 0.02 0.22 0.01 0.00 1.00 0.00 0.00 33.01 34.26 1z84 s GLN 188 CO 0.21 -0.15 -0.04 -1.64 -2.12 0.00 0.00 175.29 171.55 1z84 s MET 189 N -3.95 0.49 -0.15 2.91 -1.94 -0.32 -1.39 119.30 114.95 1z84 s MET 189 Ca 0.11 -0.11 -0.00 0.00 -1.71 0.00 0.00 55.69 53.98 1z84 s MET 189 Cb 0.08 -0.52 0.03 0.00 2.01 0.00 0.00 34.83 36.43 1z84 s MET 189 CO -0.07 0.01 -0.09 1.41 -0.01 0.00 0.00 175.02 176.28 1z84 s MET 190 N 0.36 1.78 -0.22 2.03 1.75 -0.21 -0.75 119.30 124.04 1z84 s MET 190 Ca -0.04 -0.51 -0.10 0.00 -1.25 0.00 0.00 55.69 53.79 1z84 s MET 190 Cb -0.07 -1.98 -0.05 0.00 2.84 0.00 0.00 34.83 35.56 1z84 s MET 190 CO -0.00 -0.34 0.14 0.00 -0.65 0.00 0.00 175.02 174.17 1z84 s ALA 191 N 1.58 3.63 0.06 4.11 0.00 0.95 -0.87 121.76 131.22 1z84 s ALA 191 Ca 0.03 -0.79 0.08 0.00 0.00 0.00 0.00 51.96 51.28 1z84 s ALA 191 Cb -0.14 -2.22 -0.03 0.00 0.00 0.00 0.00 23.12 20.73 1z84 s ALA 191 CO -0.09 -0.00 -0.21 -0.51 0.00 0.00 0.00 175.76 174.96 1z84 s LEU 192 N 0.68 2.50 0.00 0.00 1.43 0.26 -2.22 118.68 121.35 1z84 s LEU 192 Ca 0.07 -0.51 0.27 0.00 -1.03 0.00 0.00 54.13 52.94 1z84 s LEU 192 Cb -0.12 -1.45 1.62 0.00 0.03 0.00 0.00 46.19 46.27 1z84 s LEU 192 CO 0.01 0.24 2.02 -0.81 0.23 0.00 0.00 176.35 178.04 1z84 n PRO 193 N 1.43 0.95 -4.07 1.29 -0.04 -1.26 -0.35 135.00 132.95 1z84 n PRO 193 Ca -0.16 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.20 1z84 n PRO 193 Cb 0.52 -1.45 -0.11 0.00 -0.04 0.00 0.00 33.50 32.43 1z84 n PRO 193 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1z84 s VAL 194 N -2.00 0.40 -0.27 0.52 -7.23 -1.26 -4.39 120.40 106.17 1z84 s VAL 194 Ca 0.41 -1.41 -0.25 0.00 -1.81 0.00 0.00 61.98 58.91 1z84 s VAL 194 Cb 0.19 -0.99 0.00 0.00 0.56 0.00 0.00 36.38 36.14 1z84 s VAL 194 CO 0.31 -0.67 0.88 -0.69 -0.31 0.00 0.00 175.10 174.62 1z84 s VAL 195 N -2.51 4.76 0.83 1.32 1.01 -1.26 -4.19 120.40 120.35 1z84 s VAL 195 Ca -0.02 1.54 -0.12 0.00 0.00 0.00 0.00 61.98 63.38 1z84 s VAL 195 Cb -0.02 -4.19 0.09 0.00 0.00 0.00 0.00 36.38 32.26 1z84 s VAL 195 CO -0.04 -0.19 1.13 -2.16 0.00 0.00 0.00 175.10 173.85 1z84 s PRO 196 N 3.03 1.84 0.25 2.72 0.04 -1.26 -4.78 135.00 136.83 1z84 s PRO 196 Ca 0.37 0.38 -0.05 0.00 0.04 0.00 0.00 61.00 61.74 1z84 s PRO 196 Cb -0.14 -1.91 0.33 0.00 0.04 0.00 0.00 34.50 32.81 1z84 s PRO 196 CO 0.10 -1.74 1.89 -1.35 0.04 0.00 0.00 177.00 175.94 1z84 h PRO 197 N -1.16 1.12 -0.46 0.56 0.11 -1.99 -2.08 132.00 128.10 1z84 h PRO 197 Ca -0.48 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 65.52 1z84 h PRO 197 Cb 1.30 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 1z84 h PRO 197 CO 0.62 0.74 0.12 1.79 -0.21 0.00 0.00 178.00 181.06 1z84 h THR 198 N 1.16 1.20 -0.12 -1.15 1.35 -1.98 0.76 112.91 114.12 1z84 h THR 198 Ca 0.39 -0.70 -0.06 0.00 -0.55 0.00 0.00 66.41 65.49 1z84 h THR 198 Cb 0.07 0.73 -0.00 0.00 -1.73 0.00 0.00 68.15 67.21 1z84 h THR 198 CO -0.14 0.26 -0.14 0.58 -0.25 0.00 0.00 175.52 175.83 1z84 h VAL 199 N 0.67 1.36 -0.63 6.82 2.07 -1.77 0.29 116.25 125.06 1z84 h VAL 199 Ca 0.15 -1.33 0.02 0.00 0.82 0.00 0.00 66.70 66.36 1z84 h VAL 199 Cb 0.24 1.96 -0.04 0.00 -1.52 0.00 0.00 31.29 31.94 1z84 h VAL 199 CO -0.00 0.39 0.40 0.28 0.02 0.00 0.00 177.57 178.65 1z84 h SER 200 N -0.09 0.68 -0.45 0.57 0.02 -1.20 0.21 113.55 113.29 1z84 h SER 200 Ca 0.02 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1z84 h SER 200 Cb 0.68 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 1z84 h SER 200 CO 0.03 0.48 0.27 0.28 -1.14 0.00 0.00 176.83 176.75 1z84 h SER 201 N 0.81 0.54 -0.71 3.07 0.02 -0.75 -1.33 113.55 115.20 1z84 h SER 201 Ca 0.24 -0.06 -0.05 0.00 -0.84 0.00 0.00 61.79 61.09 1z84 h SER 201 Cb -0.04 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.33 1z84 h SER 201 CO -0.08 0.44 0.27 -0.09 -1.14 0.00 0.00 176.83 176.23 1z84 h ARG 202 N 0.59 1.08 -0.42 3.45 2.43 -0.56 -0.71 114.38 120.23 1z84 h ARG 202 Ca 0.16 -0.21 -0.02 0.00 -0.81 0.00 0.00 59.98 59.10 1z84 h ARG 202 Cb 0.00 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.36 1z84 h ARG 202 CO -0.03 0.90 0.18 -0.07 -1.51 0.00 0.00 179.97 179.44 1z84 h LEU 203 N 1.03 0.58 -0.01 3.80 3.38 -0.68 -1.15 115.31 122.25 1z84 h LEU 203 Ca 0.24 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 58.06 1z84 h LEU 203 Cb 0.24 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1z84 h LEU 203 CO -0.02 0.57 -0.05 0.44 0.09 0.00 0.00 178.44 179.47 1z84 h ASP 204 N 0.54 -0.16 -0.25 -0.43 3.45 -1.09 -1.41 116.42 117.08 1z84 h ASP 204 Ca 0.14 0.03 -0.09 0.00 0.43 0.00 0.00 57.03 57.54 1z84 h ASP 204 Cb 0.17 0.07 -0.00 0.00 -0.56 0.00 0.00 39.33 39.01 1z84 h ASP 204 CO -0.01 -0.08 -0.19 1.23 -1.57 0.00 0.00 179.24 178.61 1z84 h GLY 205 N -0.09 0.62 1.62 2.75 0.00 -1.00 -1.31 103.07 105.66 1z84 h GLY 205 Ca 0.03 -0.61 -0.12 0.00 0.00 0.00 0.00 47.33 46.63 1z84 h GLY 205 CO -0.07 0.55 -0.37 -0.91 0.00 0.00 0.00 176.54 175.74 1z84 h THR 206 N 0.29 1.30 0.23 4.70 1.35 -1.13 -1.98 112.91 117.66 1z84 h THR 206 Ca 0.05 -1.49 0.00 0.00 -0.55 0.00 0.00 66.41 64.42 1z84 h THR 206 Cb 0.73 1.55 -0.01 0.00 -1.73 0.00 0.00 68.15 68.69 1z84 h THR 206 CO 0.05 0.46 -0.20 0.50 -0.25 0.00 0.00 175.52 176.08 1z84 h LYS 207 N 0.36 -0.43 -0.58 4.72 3.64 -1.14 -1.46 116.57 121.68 1z84 h LYS 207 Ca 0.04 0.03 0.12 0.00 -1.27 0.00 0.00 60.65 59.57 1z84 h LYS 207 Cb 0.82 0.10 -0.11 0.00 -0.41 0.00 0.00 32.23 32.63 1z84 h LYS 207 CO 0.07 -0.29 -0.08 -0.44 -2.27 0.00 0.00 179.45 176.44 1z84 h ASP 208 N -0.44 -0.42 -0.50 4.20 3.32 -1.13 -0.14 116.42 121.32 1z84 h ASP 208 Ca -0.01 0.16 -0.05 0.00 0.02 0.00 0.00 57.03 57.15 1z84 h ASP 208 Cb 0.41 0.31 -0.02 0.00 0.22 0.00 0.00 39.33 40.25 1z84 h ASP 208 CO -0.03 -0.16 0.10 0.22 -1.72 0.00 0.00 179.24 177.66 1z84 h TYR 209 N 0.05 0.86 -0.69 4.55 5.03 -1.28 -1.59 116.97 123.90 1z84 h TYR 209 Ca 0.29 -0.11 -0.08 0.00 2.58 0.00 0.00 58.73 61.41 1z84 h TYR 209 Cb 0.46 -0.24 -0.03 0.00 1.55 0.00 0.00 36.73 38.47 1z84 h TYR 209 CO -0.42 0.78 0.14 0.35 -1.32 0.00 0.00 178.16 177.68 1z84 h PHE 210 N 0.70 1.19 -0.16 -3.82 3.04 -0.86 0.23 116.94 117.26 1z84 h PHE 210 Ca 0.15 -0.16 -0.03 0.00 3.98 0.00 0.00 57.97 61.92 1z84 h PHE 210 Cb 0.36 -0.33 -0.01 0.00 2.56 0.00 0.00 35.95 38.53 1z84 h PHE 210 CO 0.02 0.98 -0.06 0.93 -2.02 0.00 0.00 178.31 178.17 1z84 h GLU 211 N 1.06 0.23 0.00 1.11 5.08 -0.72 0.40 114.58 121.74 1z84 h GLU 211 Ca 0.21 -0.04 -0.23 0.00 -1.00 0.00 0.00 59.36 58.30 1z84 h GLU 211 Cb 0.42 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 1z84 h GLU 211 CO 0.01 0.31 -1.63 0.39 -1.00 0.00 0.00 179.01 177.09 1z84 n GLU 212 N -4.34 0.63 -0.00 2.33 -0.58 -0.63 -4.58 120.64 113.47 1z84 n GLU 212 Ca -0.01 0.23 0.02 0.00 -0.42 0.00 0.00 57.16 56.98 1z84 n GLU 212 Cb 0.21 -1.78 -0.02 0.00 -0.57 0.00 0.00 31.44 29.28 1z84 n GLU 212 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1z84 n THR 213 N -2.94 0.00 -1.00 2.62 -2.24 0.77 -4.99 114.28 106.51 1z84 n THR 213 Ca -0.14 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1z84 n THR 213 Cb 0.95 0.69 0.00 0.00 -2.10 0.00 0.00 70.33 69.87 1z84 n THR 213 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1z84 n GLY 214 N 1.73 0.27 3.49 3.38 0.00 0.14 -5.01 105.19 109.19 1z84 n GLY 214 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1z84 n GLY 214 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1z84 s LYS 215 N -0.94 1.79 -0.18 1.61 1.02 -1.26 -5.01 119.74 116.76 1z84 s LYS 215 Ca 0.00 -1.23 -0.23 0.00 0.02 0.00 0.00 55.97 54.53 1z84 s LYS 215 Cb 0.00 -2.09 -0.02 0.00 -0.52 0.00 0.00 37.83 35.20 1z84 s LYS 215 CO 0.00 0.46 0.71 0.00 -0.92 0.00 0.00 175.35 175.60 1z84 h LEU 218 N 0.05 0.00 -1.93 0.00 3.38 -1.94 -2.92 115.31 111.96 1z84 h LEU 218 Ca 0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1z84 h LEU 218 Cb 0.49 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.24 1z84 h LEU 218 CO 0.04 0.35 -0.09 0.00 0.09 0.00 0.00 178.44 178.83 1z84 n GLU 220 N -4.22 3.59 -0.07 0.00 1.02 -1.10 -4.66 120.64 115.21 1z84 n GLU 220 Ca -0.03 -2.12 0.18 0.00 -0.02 0.00 0.00 57.16 55.17 1z84 n GLU 220 Cb 0.17 -2.00 0.61 0.00 -0.02 0.00 0.00 31.44 30.20 1z84 n GLU 220 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1z84 h ALA 221 N 3.38 2.33 0.00 0.62 0.00 -1.50 -0.08 119.26 124.02 1z84 h ALA 221 Ca 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1z84 h ALA 221 Cb 1.48 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 1z84 h ALA 221 CO 0.32 -0.50 -0.19 0.87 0.00 0.00 0.00 179.25 179.75 1z84 h LYS 222 N 0.18 0.00 0.00 0.00 1.57 -1.86 -1.55 116.57 114.91 1z84 h LYS 222 Ca 0.30 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.08 1z84 h LYS 222 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.24 1z84 h LYS 222 CO -0.05 0.19 -1.51 -1.13 -0.57 0.00 0.00 179.45 176.38 1z84 n SER 223 N -3.39 1.19 -0.01 0.86 3.41 -0.20 -4.62 113.62 110.85 1z84 n SER 223 Ca -0.00 -0.20 -0.01 0.00 -0.26 0.00 0.00 58.87 58.41 1z84 n SER 223 Cb 0.40 1.57 -0.12 0.00 -0.26 0.00 0.00 64.21 65.80 1z84 n SER 223 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1z84 n LYS 224 N -1.90 0.65 -4.55 4.33 4.76 -0.27 -5.01 118.16 116.16 1z84 n LYS 224 Ca -0.02 0.08 -0.26 0.00 -2.87 0.00 0.00 58.31 55.25 1z84 n LYS 224 Cb 0.38 -1.68 -0.09 0.00 -1.84 0.00 0.00 35.03 31.80 1z84 n LYS 224 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 1z84 s HIS 225 N -2.92 1.89 -0.37 2.13 3.76 -0.59 -4.47 115.29 114.71 1z84 s HIS 225 Ca -0.06 -1.10 -0.08 0.00 -0.15 0.00 0.00 55.06 53.67 1z84 s HIS 225 Cb 0.09 -1.31 0.05 0.00 1.11 0.00 0.00 32.58 32.52 1z84 s HIS 225 CO 0.83 -0.08 0.18 -0.06 -0.85 0.00 0.00 174.74 174.77 1z84 s PHE 226 N -3.15 3.30 0.19 1.40 0.08 -0.99 -4.76 117.98 114.05 1z84 s PHE 226 Ca 0.25 -1.42 -0.30 0.00 0.12 0.00 0.00 56.93 55.57 1z84 s PHE 226 Cb 0.04 -2.57 -0.08 0.00 -0.57 0.00 0.00 43.02 39.84 1z84 s PHE 226 CO 0.13 -0.77 1.26 0.08 -0.10 0.00 0.00 175.22 175.83 1z84 s VAL 227 N 1.42 3.35 -0.02 -0.44 1.01 -1.26 -0.64 120.40 123.82 1z84 s VAL 227 Ca 0.01 1.12 -0.02 0.00 0.00 0.00 0.00 61.98 63.09 1z84 s VAL 227 Cb -0.21 -3.72 -0.01 0.00 0.00 0.00 0.00 36.38 32.45 1z84 s VAL 227 CO 0.03 0.17 -0.04 -0.38 0.00 0.00 0.00 175.10 174.88 1z84 n ILE 228 N 2.56 0.21 -4.33 2.22 5.41 0.77 -4.90 119.36 121.29 1z84 n ILE 228 Ca 0.05 0.34 -0.18 0.00 1.00 0.00 0.00 62.75 63.97 1z84 n ILE 228 Cb 0.44 -1.48 -0.10 0.00 -0.71 0.00 0.00 39.64 37.79 1z84 n ILE 228 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 1z84 s ASP 229 N -4.52 1.40 -0.12 4.38 1.01 -1.14 -4.77 116.67 112.90 1z84 s ASP 229 Ca -0.03 -1.46 -0.10 0.00 0.71 0.00 0.00 52.55 51.66 1z84 s ASP 229 Cb 0.00 0.26 0.04 0.00 1.01 0.00 0.00 42.92 44.23 1z84 s ASP 229 CO 0.05 -0.80 0.32 -0.70 0.21 0.00 0.00 175.17 174.26 1z84 s GLU 230 N -3.94 0.36 0.00 8.23 2.12 -1.26 -0.61 118.70 123.60 1z84 s GLU 230 Ca 0.36 0.49 0.00 0.00 0.36 0.00 0.00 54.97 56.19 1z84 s GLU 230 Cb 0.07 0.13 0.00 0.00 0.26 0.00 0.00 34.13 34.59 1z84 s GLU 230 CO 0.15 -0.07 0.00 -1.13 -0.54 0.00 0.00 175.26 173.67 1z84 n SER 231 N 3.18 1.58 0.10 -1.70 3.41 0.96 -5.00 113.62 116.14 1z84 n SER 231 Ca -0.15 -0.25 -0.04 0.00 -0.26 0.00 0.00 58.87 58.17 1z84 n SER 231 Cb 0.57 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.64 1z84 n SER 231 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1z84 h SER 232 N 0.00 0.17 0.00 4.04 0.02 -2.00 -3.35 113.55 112.43 1z84 h SER 232 Ca 0.00 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1z84 h SER 232 Cb 0.00 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.49 1z84 h SER 232 CO 0.00 0.76 0.00 1.41 -1.14 0.00 0.00 176.83 177.86 1z84 n HIS 233 N -3.82 0.00 -4.11 3.45 8.25 -1.26 -5.00 115.22 112.74 1z84 n HIS 233 Ca -0.02 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.32 1z84 n HIS 233 Cb 0.64 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.64 1z84 n HIS 233 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1z84 s PHE 234 N -0.25 0.74 0.00 4.41 0.40 -1.26 -0.86 117.98 121.16 1z84 s PHE 234 Ca 0.00 -0.70 0.03 0.00 -0.60 0.00 0.00 56.93 55.66 1z84 s PHE 234 Cb 0.00 -0.44 -0.01 0.00 0.51 0.00 0.00 43.02 43.08 1z84 s PHE 234 CO 0.00 -0.13 -0.10 0.54 0.70 0.00 0.00 175.22 176.24 1z84 s VAL 235 N -2.43 0.75 -0.07 -0.44 0.11 0.35 -0.03 120.40 118.64 1z84 s VAL 235 Ca -0.00 -0.50 0.01 0.00 -2.93 0.00 0.00 61.98 58.55 1z84 s VAL 235 Cb -0.03 -0.65 -0.03 0.00 -1.53 0.00 0.00 36.38 34.14 1z84 s VAL 235 CO -0.02 0.14 -0.08 -0.94 -3.33 0.00 0.00 175.10 170.87 1z84 s SER 236 N -0.41 4.57 0.05 3.54 1.04 0.22 -0.18 113.70 122.54 1z84 s SER 236 Ca 0.02 -0.06 -0.00 0.00 0.48 0.00 0.00 55.95 56.39 1z84 s SER 236 Cb -0.04 -1.20 -0.04 0.00 0.10 0.00 0.00 66.02 64.84 1z84 s SER 236 CO -0.00 0.34 -0.04 0.68 0.98 0.00 0.00 173.24 175.20 1z84 s VAL 237 N -0.68 0.26 -0.36 5.02 -7.23 0.00 -0.17 120.40 117.25 1z84 s VAL 237 Ca 0.10 -1.61 -0.19 0.00 -1.81 0.00 0.00 61.98 58.47 1z84 s VAL 237 Cb -0.11 -1.24 -0.00 0.00 0.56 0.00 0.00 36.38 35.58 1z84 s VAL 237 CO 0.02 -0.86 0.56 0.00 -0.31 0.00 0.00 175.10 174.51 1z84 s ALA 238 N -3.29 3.46 0.38 1.32 0.00 0.18 -1.18 121.76 122.64 1z84 s ALA 238 Ca 0.02 -0.96 -0.27 0.00 0.00 0.00 0.00 51.96 50.75 1z84 s ALA 238 Cb 0.03 -3.08 -0.09 0.00 0.00 0.00 0.00 23.12 19.97 1z84 s ALA 238 CO -0.07 -1.29 1.34 -2.14 0.00 0.00 0.00 175.76 173.60 1z84 s PRO 239 N 2.52 4.09 0.24 0.00 0.02 -1.26 -2.34 135.00 138.26 1z84 s PRO 239 Ca 0.21 2.25 -0.05 0.00 0.02 0.00 0.00 61.00 63.42 1z84 s PRO 239 Cb -0.15 -2.87 0.39 0.00 0.02 0.00 0.00 34.50 31.88 1z84 s PRO 239 CO 0.14 -0.43 1.77 0.35 -0.33 0.00 0.00 177.00 178.51 1z84 h PHE 240 N 2.91 0.66 -1.22 6.54 3.57 -1.94 -2.20 116.94 125.25 1z84 h PHE 240 Ca -0.50 0.03 -0.61 0.00 3.53 0.00 0.00 57.97 60.43 1z84 h PHE 240 Cb 1.24 -0.18 -0.39 0.00 2.79 0.00 0.00 35.95 39.41 1z84 h PHE 240 CO 0.54 0.21 -0.34 0.00 -2.23 0.00 0.00 178.31 176.49 1z84 n ALA 241 N -2.42 5.39 -1.62 2.41 0.00 -1.26 -4.78 120.51 118.23 1z84 n ALA 241 Ca 0.13 -3.99 -0.48 0.00 0.00 0.00 0.00 53.44 49.09 1z84 n ALA 241 Cb 0.32 -0.80 -0.04 0.00 0.00 0.00 0.00 19.45 18.93 1z84 n ALA 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1z84 n ALA 242 N -0.63 0.10 -0.12 0.00 0.00 -0.83 -4.78 120.51 114.25 1z84 n ALA 242 Ca 0.46 0.46 -0.09 0.00 0.00 0.00 0.00 53.44 54.26 1z84 n ALA 242 Cb 0.72 -2.16 0.05 0.00 0.00 0.00 0.00 19.45 18.06 1z84 n ALA 242 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1z84 h THR 243 N 3.07 1.27 -4.04 0.00 2.02 -1.97 -3.46 112.91 109.80 1z84 h THR 243 Ca -0.45 -1.35 -0.55 0.00 0.77 0.00 0.00 66.41 64.83 1z84 h THR 243 Cb 1.31 1.15 -0.24 0.00 -1.74 0.00 0.00 68.15 68.63 1z84 h THR 243 CO 0.76 0.46 -0.83 -0.31 0.37 0.00 0.00 175.52 175.97 1z84 s TYR 244 N -4.66 1.74 0.16 3.16 2.02 -1.26 -4.50 117.35 114.01 1z84 s TYR 244 Ca -0.10 -0.40 -0.32 0.00 -0.37 0.00 0.00 57.07 55.89 1z84 s TYR 244 Cb 0.13 -0.99 -0.10 0.00 -0.40 0.00 0.00 41.96 40.59 1z84 s TYR 244 CO 0.85 0.14 1.61 -1.25 -1.57 0.00 0.00 175.55 175.34 1z84 s PRO 245 N -1.55 4.19 -1.43 -1.71 0.04 -1.26 -1.96 135.00 131.33 1z84 s PRO 245 Ca 0.06 2.41 0.00 0.00 0.04 0.00 0.00 61.00 63.51 1z84 s PRO 245 Cb -0.09 -3.20 0.00 0.00 0.04 0.00 0.00 34.50 31.24 1z84 s PRO 245 CO 0.03 -0.65 0.00 1.19 0.04 0.00 0.00 177.00 177.60 1z84 n PHE 246 N 4.21 -0.06 -1.76 0.56 3.01 -1.26 -4.65 117.46 117.51 1z84 n PHE 246 Ca 0.15 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.20 1z84 n PHE 246 Cb 0.38 -2.50 0.01 0.00 -0.01 0.00 0.00 39.48 37.35 1z84 n PHE 246 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 1z84 n GLU 247 N -2.58 2.42 -4.36 -1.08 2.13 -0.83 -4.49 120.64 111.85 1z84 n GLU 247 Ca -0.14 0.86 -0.21 0.00 0.66 0.00 0.00 57.16 58.33 1z84 n GLU 247 Cb 0.47 -2.62 -0.16 0.00 0.27 0.00 0.00 31.44 29.40 1z84 n GLU 247 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 1z84 s ILE 248 N -1.15 0.77 -0.10 6.31 1.01 -0.56 -4.31 121.20 123.17 1z84 s ILE 248 Ca 0.57 -0.32 -0.02 0.00 0.00 0.00 0.00 60.65 60.88 1z84 s ILE 248 Cb -0.47 -0.70 -0.03 0.00 0.01 0.00 0.00 42.46 41.26 1z84 s ILE 248 CO 0.61 0.25 -0.00 0.26 0.00 0.00 0.00 174.94 176.06 1z84 s TRP 249 N 0.40 3.14 -0.30 3.97 0.51 -0.32 -0.14 118.94 126.19 1z84 s TRP 249 Ca -0.06 0.12 -0.10 0.00 -2.12 0.00 0.00 56.10 53.94 1z84 s TRP 249 Cb -0.11 -1.82 -0.02 0.00 -0.81 0.00 0.00 33.47 30.71 1z84 s TRP 249 CO 0.01 0.39 0.16 0.42 -0.51 0.00 0.00 176.95 177.41 1z84 s ILE 250 N -0.65 4.76 -0.12 2.03 1.01 0.68 -0.82 121.20 128.09 1z84 s ILE 250 Ca 0.11 -0.28 0.03 0.00 0.00 0.00 0.00 60.65 60.50 1z84 s ILE 250 Cb -0.12 -3.38 -0.00 0.00 0.01 0.00 0.00 42.46 38.97 1z84 s ILE 250 CO 0.02 0.12 -0.21 -0.63 0.00 0.00 0.00 174.94 174.24 1z84 s ILE 251 N 1.65 2.28 0.26 2.92 1.01 0.75 -0.85 121.20 129.22 1z84 s ILE 251 Ca 0.05 -0.93 -0.30 0.00 0.00 0.00 0.00 60.65 59.47 1z84 s ILE 251 Cb -0.17 -1.90 -0.11 0.00 0.01 0.00 0.00 42.46 40.29 1z84 s ILE 251 CO 0.07 0.55 1.61 -2.16 0.00 0.00 0.00 174.94 175.01 1z84 s PRO 252 N 0.50 4.14 0.19 2.79 0.04 -1.26 -0.50 135.00 140.90 1z84 s PRO 252 Ca -0.14 2.55 -0.01 0.00 0.04 0.00 0.00 61.00 63.45 1z84 s PRO 252 Cb -0.17 -3.05 0.12 0.00 0.04 0.00 0.00 34.50 31.44 1z84 s PRO 252 CO 0.05 -0.64 1.48 0.87 0.04 0.00 0.00 177.00 178.80 1z84 h LYS 253 N 5.39 0.42 -7.02 4.56 1.57 -1.34 -3.44 116.57 116.71 1z84 h LYS 253 Ca -0.46 -0.30 -0.47 0.00 -1.87 0.00 0.00 60.65 57.55 1z84 h LYS 253 Cb 1.21 0.05 0.01 0.00 0.08 0.00 0.00 32.23 33.59 1z84 h LYS 253 CO 0.83 0.92 0.38 0.34 -0.57 0.00 0.00 179.45 181.36 1z84 s ASP 254 N -6.94 6.64 -0.37 0.86 3.68 -1.26 -4.92 116.67 114.36 1z84 s ASP 254 Ca -0.06 1.91 -0.28 0.00 2.13 0.00 0.00 52.55 56.25 1z84 s ASP 254 Cb 0.11 -2.57 -0.01 0.00 -1.45 0.00 0.00 42.92 39.01 1z84 s ASP 254 CO 0.83 -0.57 1.68 -2.28 0.13 0.00 0.00 175.17 174.96 1z84 s HIS 255 N -1.90 1.99 -0.16 -5.34 5.65 -1.26 -4.93 115.29 109.34 1z84 s HIS 255 Ca 0.62 0.64 -0.01 0.00 0.25 0.00 0.00 55.06 56.56 1z84 s HIS 255 Cb -0.17 -4.19 0.04 0.00 -1.18 0.00 0.00 32.58 27.09 1z84 s HIS 255 CO 0.21 -2.63 -0.03 -1.12 -0.65 0.00 0.00 174.74 170.53 1z84 s SER 256 N 5.48 2.71 0.17 9.88 0.01 -1.26 -5.03 113.70 125.66 1z84 s SER 256 Ca 0.73 -0.63 0.06 0.00 1.31 0.00 0.00 55.95 57.42 1z84 s SER 256 Cb -0.19 -0.78 -0.01 0.00 0.21 0.00 0.00 66.02 65.24 1z84 s SER 256 CO 0.33 -0.21 1.38 0.28 0.41 0.00 0.00 173.24 175.43 1z84 h SER 257 N 8.17 0.11 -3.26 2.44 0.02 -1.90 -0.37 113.55 118.77 1z84 h SER 257 Ca -0.22 -0.10 -0.67 0.00 -0.84 0.00 0.00 61.79 59.96 1z84 h SER 257 Cb 1.11 -0.04 -0.33 0.00 0.14 0.00 0.00 62.40 63.29 1z84 h SER 257 CO 0.37 0.93 -0.85 -1.00 -1.14 0.00 0.00 176.83 175.14 1z84 s HIS 258 N -3.09 2.67 0.24 3.45 3.76 -1.26 -2.96 115.29 118.09 1z84 s HIS 258 Ca -0.01 -1.17 -0.05 0.00 -0.15 0.00 0.00 55.06 53.68 1z84 s HIS 258 Cb 0.11 -1.80 0.43 0.00 1.11 0.00 0.00 32.58 32.42 1z84 s HIS 258 CO 0.81 -0.52 1.74 0.35 -0.85 0.00 0.00 174.74 176.28 1z84 h PHE 259 N 7.13 0.56 0.00 1.40 3.57 -1.89 -2.85 116.94 124.86 1z84 h PHE 259 Ca -0.29 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.25 1z84 h PHE 259 Cb 1.20 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.81 1z84 h PHE 259 CO 0.48 0.11 0.00 -2.39 -2.23 0.00 0.00 178.31 174.28 1z84 n HIS 260 N -4.96 0.00 1.67 0.41 1.44 -1.26 -1.50 115.22 111.02 1z84 n HIS 260 Ca 0.14 0.00 0.15 0.00 -2.01 0.00 0.00 57.72 56.00 1z84 n HIS 260 Cb 0.38 0.00 0.75 0.00 0.12 0.00 0.00 29.99 31.24 1z84 n HIS 260 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 1z84 n HIS 261 N -0.94 0.00 -1.58 -1.40 8.25 -1.08 -4.91 115.22 113.56 1z84 n HIS 261 Ca 0.19 0.00 -0.46 0.00 -0.26 0.00 0.00 57.72 57.19 1z84 n HIS 261 Cb 0.09 -0.08 -0.02 0.00 1.12 0.00 0.00 29.99 31.09 1z84 n HIS 261 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1z84 n LEU 262 N -0.78 1.65 -4.91 2.41 7.94 -0.56 -5.03 117.00 117.71 1z84 n LEU 262 Ca 0.19 1.16 -0.26 0.00 -1.11 0.00 0.00 56.01 56.00 1z84 n LEU 262 Cb 0.22 -1.26 -0.00 0.00 0.53 0.00 0.00 43.42 42.91 1z84 n LEU 262 CO 0.20 -1.39 0.07 1.51 -1.11 0.00 0.00 177.39 176.67 1z84 s ASP 263 N -0.36 4.66 0.17 1.96 3.84 -1.26 -4.95 116.67 120.72 1z84 s ASP 263 Ca 0.64 -1.23 -0.14 0.00 -0.00 0.00 0.00 52.55 51.82 1z84 s ASP 263 Cb -0.76 0.43 0.07 0.00 -1.38 0.00 0.00 42.92 41.28 1z84 s ASP 263 CO 0.57 -1.13 1.83 0.44 -0.00 0.00 0.00 175.17 176.89 1z84 h ASP 264 N 0.71 0.59 -0.12 2.11 5.19 -1.98 -0.30 116.42 122.61 1z84 h ASP 264 Ca -0.36 -0.01 0.01 0.00 -0.62 0.00 0.00 57.03 56.04 1z84 h ASP 264 Cb 1.30 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 40.66 1z84 h ASP 264 CO 0.56 0.42 0.06 0.58 -3.12 0.00 0.00 179.24 177.75 1z84 h VAL 265 N 0.69 1.01 -0.16 -1.35 2.07 -2.00 -2.42 116.25 114.08 1z84 h VAL 265 Ca 0.19 -0.05 -0.09 0.00 0.82 0.00 0.00 66.70 67.58 1z84 h VAL 265 Cb -0.07 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 1z84 h VAL 265 CO -0.05 0.02 -0.29 0.11 0.02 0.00 0.00 177.57 177.38 1z84 h LYS 266 N 0.14 0.31 -0.61 1.57 1.57 -1.90 -1.26 116.57 116.37 1z84 h LYS 266 Ca 0.05 -0.11 0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1z84 h LYS 266 Cb 0.00 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.26 1z84 h LYS 266 CO -0.03 0.58 0.40 0.00 -0.57 0.00 0.00 179.45 179.82 1z84 h ALA 267 N 1.43 0.78 -0.21 3.86 0.00 -0.81 0.41 119.26 124.72 1z84 h ALA 267 Ca 0.04 -0.03 -0.20 0.00 0.00 0.00 0.00 54.91 54.72 1z84 h ALA 267 Cb 0.66 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1z84 h ALA 267 CO 0.05 0.18 -0.65 0.28 0.00 0.00 0.00 179.25 179.10 1z84 h VAL 268 N 0.80 1.29 -0.02 0.00 2.07 -1.19 0.13 116.25 119.32 1z84 h VAL 268 Ca 0.23 -1.86 0.01 0.00 0.82 0.00 0.00 66.70 65.90 1z84 h VAL 268 Cb -0.06 1.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 1z84 h VAL 268 CO -0.07 0.59 -0.05 -0.78 0.02 0.00 0.00 177.57 177.29 1z84 h ASP 269 N 0.57 -0.14 -0.34 0.57 3.58 -1.00 -1.34 116.42 118.32 1z84 h ASP 269 Ca -0.02 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.46 1z84 h ASP 269 Cb 1.26 0.07 -0.02 0.00 1.72 0.00 0.00 39.33 42.36 1z84 h ASP 269 CO 0.14 -0.07 0.22 0.25 -2.88 0.00 0.00 179.24 176.89 1z84 h LEU 270 N -0.07 0.39 -0.50 2.28 5.85 -0.16 -2.65 115.31 120.45 1z84 h LEU 270 Ca 0.03 -0.02 0.10 0.00 0.84 0.00 0.00 57.88 58.83 1z84 h LEU 270 Cb 0.11 -0.10 -0.10 0.00 0.37 0.00 0.00 40.66 40.95 1z84 h LEU 270 CO -0.07 0.29 -0.15 1.23 -0.34 0.00 0.00 178.44 179.40 1z84 h GLY 271 N 0.45 0.30 1.31 3.75 0.00 -0.55 0.36 103.07 108.69 1z84 h GLY 271 Ca 0.12 0.20 -0.04 0.00 0.00 0.00 0.00 47.33 47.62 1z84 h GLY 271 CO -0.03 -0.20 0.23 -1.33 0.00 0.00 0.00 176.54 175.21 1z84 h GLY 272 N -0.03 0.94 1.20 4.60 0.00 -1.07 -0.31 103.07 108.39 1z84 h GLY 272 Ca 0.24 -0.49 -0.26 0.00 0.00 0.00 0.00 47.33 46.82 1z84 h GLY 272 CO -0.53 0.46 -0.99 -2.00 0.00 0.00 0.00 176.54 173.48 1z84 h LEU 273 N 0.86 0.92 -0.10 3.11 5.85 -0.88 -1.15 115.31 123.92 1z84 h LEU 273 Ca 0.20 -0.72 0.02 0.00 0.84 0.00 0.00 57.88 58.22 1z84 h LEU 273 Cb 0.19 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 1z84 h LEU 273 CO -0.02 1.51 -0.02 0.25 -0.34 0.00 0.00 178.44 179.83 1z84 h LEU 274 N 0.42 -0.07 -0.46 2.25 5.85 -0.28 -0.52 115.31 122.50 1z84 h LEU 274 Ca -0.12 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.68 1z84 h LEU 274 Cb 1.64 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 42.68 1z84 h LEU 274 CO 0.20 -0.02 0.20 0.50 -0.34 0.00 0.00 178.44 178.97 1z84 h LYS 275 N 0.01 0.39 -0.86 1.25 3.64 -1.02 -0.43 116.57 119.55 1z84 h LYS 275 Ca 0.05 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1z84 h LYS 275 Cb 0.07 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.76 1z84 h LYS 275 CO -0.10 0.25 0.55 1.25 -2.27 0.00 0.00 179.45 179.14 1z84 h LEU 276 N 0.40 1.00 -0.29 5.20 5.85 -0.90 0.14 115.31 126.71 1z84 h LEU 276 Ca 0.21 -0.04 -0.12 0.00 0.84 0.00 0.00 57.88 58.77 1z84 h LEU 276 Cb 0.16 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 40.93 1z84 h LEU 276 CO -0.18 0.75 -0.27 0.24 -0.34 0.00 0.00 178.44 178.64 1z84 h MET 277 N 1.17 0.70 -0.63 1.25 2.86 -0.37 -0.08 114.93 119.83 1z84 h MET 277 Ca 0.31 -0.36 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 1z84 h MET 277 Cb -0.10 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.54 1z84 h MET 277 CO -0.06 0.97 0.24 -0.07 1.06 0.00 0.00 176.91 179.05 1z84 h LEU 278 N 0.44 0.88 -0.49 1.22 3.38 -0.93 -0.08 115.31 119.73 1z84 h LEU 278 Ca 0.05 -0.18 -0.13 0.00 0.09 0.00 0.00 57.88 57.71 1z84 h LEU 278 Cb 0.84 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1z84 h LEU 278 CO 0.07 0.82 -0.20 1.56 0.09 0.00 0.00 178.44 180.78 1z84 h GLN 279 N 0.89 1.01 -0.79 1.13 4.20 -0.88 -1.31 115.11 119.37 1z84 h GLN 279 Ca 0.21 -0.43 0.00 0.00 0.06 0.00 0.00 58.65 58.49 1z84 h GLN 279 Cb 0.23 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.93 1z84 h GLN 279 CO -0.01 1.11 0.49 0.87 -0.67 0.00 0.00 178.83 180.62 1z84 h LYS 280 N 0.87 1.05 -0.41 1.46 1.57 -0.83 -2.11 116.57 118.18 1z84 h LYS 280 Ca 0.12 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1z84 h LYS 280 Cb 0.78 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.84 1z84 h LYS 280 CO 0.07 0.73 0.25 0.82 -0.57 0.00 0.00 179.45 180.74 1z84 h ILE 281 N 1.07 1.07 -0.51 1.86 2.04 -0.84 -0.19 117.51 122.01 1z84 h ILE 281 Ca 0.28 -0.17 0.03 0.00 1.00 0.00 0.00 64.86 66.00 1z84 h ILE 281 Cb -0.07 0.51 -0.03 0.00 -0.74 0.00 0.00 36.82 36.48 1z84 h ILE 281 CO -0.06 0.09 0.30 0.00 0.00 0.00 0.00 178.15 178.49 1z84 h ALA 282 N 1.17 0.65 -0.07 1.87 0.00 -1.07 -1.16 119.26 120.66 1z84 h ALA 282 Ca 0.16 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 1z84 h ALA 282 Cb -0.02 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1z84 h ALA 282 CO -0.06 -0.00 -0.22 -0.22 0.00 0.00 0.00 179.25 178.75 1z84 h LYS 283 N 0.60 0.26 -0.32 0.00 3.64 -1.13 0.43 116.57 120.05 1z84 h LYS 283 Ca 0.21 -0.20 -0.09 0.00 -1.27 0.00 0.00 60.65 59.30 1z84 h LYS 283 Cb 0.03 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 1z84 h LYS 283 CO -0.10 0.82 -0.20 0.37 -2.27 0.00 0.00 179.45 178.08 1z84 h GLN 284 N -0.24 0.60 -0.13 1.90 5.75 -0.99 -3.32 115.11 118.67 1z84 h GLN 284 Ca -0.01 -0.21 0.00 0.00 -0.15 0.00 0.00 58.65 58.28 1z84 h GLN 284 Cb 0.85 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.36 1z84 h GLN 284 CO 0.05 0.76 0.00 1.28 -2.65 0.00 0.00 178.83 178.26 1z84 n LEU 285 N -4.14 3.00 -3.72 -2.39 4.77 -0.45 -4.81 117.00 109.27 1z84 n LEU 285 Ca 0.00 -2.89 -0.25 0.00 -0.03 0.00 0.00 56.01 52.85 1z84 n LEU 285 Cb 0.39 -0.43 0.03 0.00 -2.33 0.00 0.00 43.42 41.08 1z84 n LEU 285 CO 0.42 0.68 -0.10 0.59 -1.33 0.00 0.00 177.39 177.65 1z84 n ASN 286 N -0.83 -2.49 -3.52 -1.43 4.13 -0.97 0.41 115.26 110.55 1z84 n ASN 286 Ca 0.17 -0.91 -0.24 0.00 1.68 0.00 0.00 54.58 55.28 1z84 n ASN 286 Cb 0.70 -3.74 0.05 0.00 -1.54 0.00 0.00 39.78 35.25 1z84 n ASN 286 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1z84 n ASP 287 N -2.95 -5.19 -4.79 6.41 2.03 0.15 -4.48 116.55 107.74 1z84 n ASP 287 Ca -0.23 -0.87 -0.31 0.00 0.52 0.00 0.00 54.79 53.90 1z84 n ASP 287 Cb 0.65 -4.19 0.08 0.00 -0.72 0.00 0.00 41.12 36.94 1z84 n ASP 287 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1z84 s PRO 288 N -5.38 2.50 1.03 -0.67 0.04 -1.25 -4.96 135.00 126.32 1z84 s PRO 288 Ca 0.40 1.10 -0.12 0.00 0.04 0.00 0.00 61.00 62.42 1z84 s PRO 288 Cb -0.10 -1.93 0.19 0.00 0.04 0.00 0.00 34.50 32.70 1z84 s PRO 288 CO 0.81 -1.45 0.98 -2.30 0.04 0.00 0.00 177.00 175.08 1z84 n PRO 289 N -3.36 -1.27 -3.68 0.56 -0.02 -1.26 -4.82 135.00 121.14 1z84 n PRO 289 Ca 0.09 -0.32 -0.10 0.00 -2.02 0.00 0.00 63.50 61.14 1z84 n PRO 289 Cb 0.53 -2.22 -0.04 0.00 -0.02 0.00 0.00 33.50 31.75 1z84 n PRO 289 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1z84 s TYR 290 N -2.51 -0.18 0.06 6.00 1.13 -0.52 -1.14 117.35 120.19 1z84 s TYR 290 Ca 0.66 -0.15 0.08 0.00 -1.41 0.00 0.00 57.07 56.25 1z84 s TYR 290 Cb -0.23 0.37 -0.03 0.00 -1.10 0.00 0.00 41.96 40.97 1z84 s TYR 290 CO 0.62 -0.85 -0.21 -0.80 -2.51 0.00 0.00 175.55 171.80 1z84 s ASN 291 N -2.84 2.50 0.12 -0.18 -0.87 -0.75 -0.88 114.94 112.04 1z84 s ASN 291 Ca 0.07 -0.56 0.07 0.00 -1.57 0.00 0.00 52.86 50.87 1z84 s ASN 291 Cb -0.00 -0.19 -0.04 0.00 -0.02 0.00 0.00 41.25 41.00 1z84 s ASN 291 CO -0.06 0.14 -0.16 -0.72 -2.57 0.00 0.00 177.10 173.73 1z84 s TYR 292 N -0.87 1.49 -0.06 2.20 -0.85 -0.77 -0.79 117.35 117.70 1z84 s TYR 292 Ca 0.07 -0.50 -0.02 0.00 -0.52 0.00 0.00 57.07 56.09 1z84 s TYR 292 Cb -0.09 -0.79 0.04 0.00 0.38 0.00 0.00 41.96 41.50 1z84 s TYR 292 CO 0.02 0.17 0.13 -1.64 -1.52 0.00 0.00 175.55 172.71 1z84 s MET 293 N -2.41 0.05 -0.18 -3.49 -1.94 -0.37 -0.32 119.30 110.63 1z84 s MET 293 Ca 0.08 0.39 -0.20 0.00 -1.71 0.00 0.00 55.69 54.25 1z84 s MET 293 Cb -0.07 -0.23 -0.03 0.00 2.01 0.00 0.00 34.83 36.51 1z84 s MET 293 CO 0.04 -0.21 0.59 0.42 -0.01 0.00 0.00 175.02 175.85 1z84 s ILE 294 N 1.50 5.06 -0.25 2.53 1.01 -0.68 -0.28 121.20 130.09 1z84 s ILE 294 Ca -0.05 1.13 -0.09 0.00 0.00 0.00 0.00 60.65 61.64 1z84 s ILE 294 Cb -0.12 -3.92 -0.04 0.00 0.01 0.00 0.00 42.46 38.40 1z84 s ILE 294 CO -0.05 0.16 0.11 -1.00 0.00 0.00 0.00 174.94 174.16 1z84 s HIS 295 N 1.64 3.15 0.23 3.97 3.76 0.43 -4.45 115.29 124.01 1z84 s HIS 295 Ca 0.28 -0.18 0.04 0.00 -0.15 0.00 0.00 55.06 55.06 1z84 s HIS 295 Cb -0.16 -2.28 -0.02 0.00 1.11 0.00 0.00 32.58 31.24 1z84 s HIS 295 CO 0.11 -0.24 0.22 -2.37 -0.85 0.00 0.00 174.74 171.60 1z84 n THR 296 N 4.85 0.00 -2.59 1.30 5.66 -1.26 -1.15 114.28 121.09 1z84 n THR 296 Ca -0.15 -1.63 -0.30 0.00 -3.05 0.00 0.00 64.05 58.92 1z84 n THR 296 Cb 0.52 0.83 -0.02 0.00 -1.55 0.00 0.00 70.33 70.11 1z84 n THR 296 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1z84 s SER 297 N -2.60 6.48 0.60 1.09 1.04 -1.16 -4.98 113.70 114.18 1z84 s SER 297 Ca 0.27 1.25 -0.20 0.00 0.48 0.00 0.00 55.95 57.75 1z84 s SER 297 Cb 0.01 -2.38 -0.03 0.00 0.10 0.00 0.00 66.02 63.73 1z84 s SER 297 CO 0.19 -0.53 1.33 -2.84 0.98 0.00 0.00 173.24 172.37 1z84 s PRO 298 N -4.18 2.80 0.36 4.02 0.02 -1.26 -4.83 135.00 131.93 1z84 s PRO 298 Ca 0.53 2.15 0.08 0.00 0.02 0.00 0.00 61.00 63.78 1z84 s PRO 298 Cb -0.10 -2.02 0.70 0.00 0.02 0.00 0.00 34.50 33.10 1z84 s PRO 298 CO 0.36 -1.43 1.88 -0.07 -0.33 0.00 0.00 177.00 177.40 1z84 h LEU 299 N 0.93 0.28 -3.82 -5.54 3.38 -1.63 -2.49 115.31 106.42 1z84 h LEU 299 Ca -0.51 -0.06 -0.52 0.00 0.09 0.00 0.00 57.88 56.88 1z84 h LEU 299 Cb 1.32 -0.07 -0.27 0.00 0.09 0.00 0.00 40.66 41.73 1z84 h LEU 299 CO 0.55 0.45 0.67 0.29 0.09 0.00 0.00 178.44 180.49 1z84 n LYS 300 N -4.24 2.27 -1.77 1.13 5.02 -1.26 -5.00 118.16 114.31 1z84 n LYS 300 Ca -0.00 -2.78 -0.41 0.00 -2.02 0.00 0.00 58.31 53.10 1z84 n LYS 300 Cb 0.30 -2.09 -0.00 0.00 -0.02 0.00 0.00 35.03 33.21 1z84 n LYS 300 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 1z84 n VAL 301 N -0.84 1.80 -2.93 -0.18 3.14 -0.94 -4.97 118.33 113.42 1z84 n VAL 301 Ca 0.54 -0.45 -0.27 0.00 -2.96 0.00 0.00 64.34 61.20 1z84 n VAL 301 Cb 1.18 -1.95 -0.01 0.00 -1.06 0.00 0.00 33.84 32.00 1z84 n VAL 301 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 1z84 s THR 302 N -0.89 4.96 0.26 1.55 -4.23 -1.26 -4.98 115.64 111.04 1z84 s THR 302 Ca 0.55 0.06 -0.02 0.00 -1.18 0.00 0.00 61.69 61.11 1z84 s THR 302 Cb -0.48 -3.83 0.24 0.00 1.34 0.00 0.00 72.50 69.76 1z84 s THR 302 CO 0.61 -0.68 1.74 -0.08 -0.54 0.00 0.00 174.62 175.67 1z84 h GLU 303 N 0.64 0.51 0.00 3.99 4.81 -2.02 -1.66 114.58 120.85 1z84 h GLU 303 Ca -0.48 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 58.70 1z84 h GLU 303 Cb 1.20 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.47 1z84 h GLU 303 CO 0.62 0.34 -0.08 0.66 -0.73 0.00 0.00 179.01 179.82 1z84 h SER 304 N 0.53 0.00 1.39 1.04 4.64 -2.03 -1.82 113.55 117.30 1z84 h SER 304 Ca 0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 1z84 h SER 304 Cb 0.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 1z84 h SER 304 CO -0.39 0.08 -0.03 0.00 -0.87 0.00 0.00 176.83 175.61 1z84 n GLN 305 N -3.43 0.23 -0.08 4.77 6.02 -0.63 -4.38 117.38 119.89 1z84 n GLN 305 Ca -0.01 0.18 -0.05 0.00 -0.01 0.00 0.00 57.00 57.11 1z84 n GLN 305 Cb 0.23 -1.77 0.16 0.00 1.02 0.00 0.00 30.24 29.89 1z84 n GLN 305 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1z84 h LEU 306 N 0.00 0.70 -2.61 1.08 3.38 -1.26 -2.97 115.31 113.64 1z84 h LEU 306 Ca 0.00 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.77 1z84 h LEU 306 Cb 0.71 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 1z84 h LEU 306 CO 0.00 0.83 -0.01 -0.65 0.09 0.00 0.00 178.44 178.69 1z84 h PRO 307 N 0.66 0.00 0.00 1.13 0.11 -1.77 -2.73 132.00 129.40 1z84 h PRO 307 Ca 0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 1z84 h PRO 307 Cb 0.54 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.65 1z84 h PRO 307 CO 0.03 0.01 -0.00 2.48 -0.21 0.00 0.00 178.00 180.31 1z84 n TYR 308 N -3.36 0.00 -3.94 0.65 4.11 -1.18 -4.46 117.16 108.98 1z84 n TYR 308 Ca -0.03 -0.78 -0.35 0.00 -0.00 0.00 0.00 57.90 56.74 1z84 n TYR 308 Cb 0.11 -0.11 -0.12 0.00 -0.00 0.00 0.00 39.34 39.22 1z84 n TYR 308 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.86 177.85 1z84 s THR 309 N -2.05 4.21 -0.24 -3.48 2.01 -1.03 -4.77 115.64 110.29 1z84 s THR 309 Ca 0.18 -0.22 -0.04 0.00 0.31 0.00 0.00 61.69 61.93 1z84 s THR 309 Cb 0.16 -2.93 0.13 0.00 0.01 0.00 0.00 72.50 69.87 1z84 s THR 309 CO 0.02 0.40 0.41 -2.28 -0.69 0.00 0.00 174.62 172.48 1z84 s HIS 310 N 1.15 -0.91 0.71 4.92 5.04 -1.26 -3.71 115.29 121.23 1z84 s HIS 310 Ca 0.04 1.12 -0.11 0.00 -1.54 0.00 0.00 55.06 54.56 1z84 s HIS 310 Cb -0.14 0.16 0.02 0.00 0.04 0.00 0.00 32.58 32.65 1z84 s HIS 310 CO 0.02 -0.68 1.07 1.67 -2.34 0.00 0.00 174.74 174.49 1z84 s TRP 311 N 2.60 2.95 0.23 3.88 1.48 -0.15 -4.93 118.94 125.00 1z84 s TRP 311 Ca 0.10 1.47 -0.22 0.00 -1.06 0.00 0.00 56.10 56.39 1z84 s TRP 311 Cb -0.15 -2.94 0.04 0.00 -1.16 0.00 0.00 33.47 29.26 1z84 s TRP 311 CO -0.16 -1.39 0.68 -0.59 -4.06 0.00 0.00 176.95 171.43 1z84 s PHE 312 N -2.95 -0.32 -0.13 1.66 -0.71 -0.30 -4.32 117.98 110.92 1z84 s PHE 312 Ca 0.59 -0.04 0.00 0.00 -1.04 0.00 0.00 56.93 56.45 1z84 s PHE 312 Cb -0.15 0.65 -0.01 0.00 -1.21 0.00 0.00 43.02 42.30 1z84 s PHE 312 CO 0.54 -1.09 -0.15 -1.17 -1.34 0.00 0.00 175.22 172.01 1z84 s LEU 313 N -2.85 2.61 -0.17 -1.99 0.20 -0.03 -0.43 118.68 116.02 1z84 s LEU 313 Ca 0.07 -0.38 -0.05 0.00 0.69 0.00 0.00 54.13 54.46 1z84 s LEU 313 Cb -0.04 -1.58 -0.03 0.00 -0.43 0.00 0.00 46.19 44.11 1z84 s LEU 313 CO -0.01 0.15 0.00 -1.58 -0.29 0.00 0.00 176.35 174.63 1z84 s GLN 314 N 0.43 3.79 -0.15 1.98 0.74 0.62 -0.23 119.66 126.84 1z84 s GLN 314 Ca -0.11 -0.45 -0.00 0.00 0.05 0.00 0.00 55.36 54.85 1z84 s GLN 314 Cb -0.16 -3.03 -0.01 0.00 1.10 0.00 0.00 33.01 30.91 1z84 s GLN 314 CO 0.05 0.25 -0.14 0.42 -0.55 0.00 0.00 175.29 175.32 1z84 s ILE 315 N 0.38 2.85 -0.33 -2.34 1.01 0.79 -1.24 121.20 122.33 1z84 s ILE 315 Ca -0.01 -0.71 0.03 0.00 0.00 0.00 0.00 60.65 59.95 1z84 s ILE 315 Cb -0.13 -2.21 0.10 0.00 0.01 0.00 0.00 42.46 40.23 1z84 s ILE 315 CO 0.02 0.51 0.06 -0.69 0.00 0.00 0.00 174.94 174.84 1z84 s VAL 316 N 0.67 1.95 0.37 2.92 1.01 0.03 -1.49 120.40 125.86 1z84 s VAL 316 Ca -0.07 -2.12 -0.28 0.00 0.00 0.00 0.00 61.98 59.51 1z84 s VAL 316 Cb -0.16 -2.45 -0.10 0.00 0.00 0.00 0.00 36.38 33.67 1z84 s VAL 316 CO 0.02 -0.61 1.40 -2.84 0.00 0.00 0.00 175.10 173.07 1z84 s PRO 317 N 1.07 4.14 -0.45 2.72 0.02 -1.26 -1.80 135.00 139.43 1z84 s PRO 317 Ca 0.11 2.39 -0.24 0.00 0.02 0.00 0.00 61.00 63.27 1z84 s PRO 317 Cb -0.19 -2.95 0.03 0.00 0.02 0.00 0.00 34.50 31.41 1z84 s PRO 317 CO -0.12 -0.43 0.83 -1.14 -0.33 0.00 0.00 177.00 175.80 1z84 s GLN 318 N -2.04 3.44 0.00 5.54 0.74 -0.30 -4.81 119.66 122.24 1z84 s GLN 318 Ca 0.53 -0.03 0.00 0.00 0.05 0.00 0.00 55.36 55.91 1z84 s GLN 318 Cb -0.43 -3.93 0.00 0.00 1.10 0.00 0.00 33.01 29.75 1z84 s GLN 318 CO 0.57 -1.15 0.00 1.28 -0.55 0.00 0.00 175.29 175.45 1z84 n LEU 319 N 6.85 0.00 -3.94 3.68 4.77 -1.26 -4.47 117.00 122.63 1z84 n LEU 319 Ca 0.03 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.92 1z84 n LEU 319 Cb 0.48 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.55 1z84 n LEU 319 CO 0.60 0.00 0.33 -0.94 -1.33 0.00 0.00 177.39 176.05 1z84 s SER 320 N -1.60 0.12 0.05 -1.43 1.04 -1.26 -5.00 113.70 105.63 1z84 s SER 320 Ca 0.00 -1.05 0.00 0.00 0.48 0.00 0.00 55.95 55.39 1z84 s SER 320 Cb 0.00 0.71 -0.00 0.00 0.10 0.00 0.00 66.02 66.82 1z84 s SER 320 CO 0.00 -1.37 0.02 0.61 0.98 0.00 0.00 173.24 173.47 1z84 n GLY 321 N -0.48 4.02 3.63 7.32 0.00 -1.26 -5.14 105.19 113.28 1z84 n GLY 321 Ca -0.03 -1.97 -0.27 0.00 0.00 0.00 0.00 46.02 43.74 1z84 n GLY 321 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1z84 s VAL 322 N -1.65 2.14 0.00 1.61 -7.23 -1.26 -5.10 120.40 108.90 1z84 s VAL 322 Ca 0.02 -1.98 0.00 0.00 -1.81 0.00 0.00 61.98 58.21 1z84 s VAL 322 Cb 0.00 -2.93 0.00 0.00 0.56 0.00 0.00 36.38 34.02 1z84 s VAL 322 CO 0.02 -0.05 0.00 0.61 -0.31 0.00 0.00 175.10 175.37 1z84 n GLY 323 N -0.98 5.02 0.27 2.32 0.00 -1.26 -5.04 105.19 105.52 1z84 n GLY 323 Ca -0.04 -1.60 0.15 0.00 0.00 0.00 0.00 46.02 44.52 1z84 n GLY 323 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1z84 h GLY 324 N 0.00 0.00 0.87 -0.02 0.00 -2.01 -2.75 103.07 99.16 1z84 h GLY 324 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1z84 h GLY 324 CO 0.00 0.00 0.01 -2.75 0.00 0.00 0.00 176.54 173.80 1z84 h PHE 325 N 0.00 0.02 -0.41 5.60 3.57 -1.96 -0.76 116.94 123.00 1z84 h PHE 325 Ca -0.00 -0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.38 1z84 h PHE 325 Cb 0.34 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 1z84 h PHE 325 CO 0.00 0.15 -0.19 0.93 -2.23 0.00 0.00 178.31 176.97 1z84 h GLU 326 N -0.11 0.86 -0.63 1.11 3.07 -1.68 -1.49 114.58 115.71 1z84 h GLU 326 Ca 0.01 -0.37 -0.03 0.00 -0.50 0.00 0.00 59.36 58.46 1z84 h GLU 326 Cb 0.13 -0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 27.99 1z84 h GLU 326 CO -0.00 1.02 0.29 0.82 -1.40 0.00 0.00 179.01 179.74 1z84 h ILE 327 N 0.68 1.22 -0.20 3.13 2.04 -1.49 0.96 117.51 123.86 1z84 h ILE 327 Ca 0.09 -0.65 -0.21 0.00 1.00 0.00 0.00 64.86 65.09 1z84 h ILE 327 Cb 0.75 0.48 0.01 0.00 -0.74 0.00 0.00 36.82 37.32 1z84 h ILE 327 CO 0.06 0.26 -0.69 1.23 0.00 0.00 0.00 178.15 179.01 1z84 h GLY 328 N 0.88 0.91 0.00 5.37 0.00 -0.97 -3.37 103.07 105.89 1z84 h GLY 328 Ca 0.22 -1.20 -0.20 0.00 0.00 0.00 0.00 47.33 46.14 1z84 h GLY 328 CO -0.02 1.07 -2.12 -1.30 0.00 0.00 0.00 176.54 174.17 1z84 n THR 329 N -3.97 0.76 -1.20 4.70 -2.24 -0.58 -4.98 114.28 106.78 1z84 n THR 329 Ca -0.06 -0.65 -0.07 0.00 -2.27 0.00 0.00 64.05 61.00 1z84 n THR 329 Cb 0.70 -0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 68.61 1z84 n THR 329 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1z84 n GLY 330 N 1.67 0.87 3.55 3.38 0.00 0.33 -5.01 105.19 109.97 1z84 n GLY 330 Ca -0.20 -0.41 -0.34 0.00 0.00 0.00 0.00 46.02 45.07 1z84 n GLY 330 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1z84 s TYR 332 N 0.55 3.32 -0.14 0.00 2.02 -1.26 -4.20 117.35 117.64 1z84 s TYR 332 Ca 0.01 0.32 0.02 0.00 -0.37 0.00 0.00 57.07 57.06 1z84 s TYR 332 Cb -0.13 -2.22 0.01 0.00 -0.40 0.00 0.00 41.96 39.21 1z84 s TYR 332 CO 0.02 -0.25 -0.22 0.42 -1.57 0.00 0.00 175.55 173.95 1z84 s ILE 333 N -2.53 2.11 -0.22 2.71 1.01 -1.26 -1.84 121.20 121.18 1z84 s ILE 333 Ca 0.46 -0.97 -0.02 0.00 0.00 0.00 0.00 60.65 60.13 1z84 s ILE 333 Cb -0.10 -1.84 0.01 0.00 0.01 0.00 0.00 42.46 40.53 1z84 s ILE 333 CO 0.38 0.55 -0.09 0.21 0.00 0.00 0.00 174.94 175.99 1z84 s ASN 334 N 0.80 4.00 0.00 3.58 3.84 0.02 -4.90 114.94 122.28 1z84 s ASN 334 Ca -0.07 -0.55 0.30 0.00 0.21 0.00 0.00 52.86 52.74 1z84 s ASN 334 Cb -0.16 -1.66 1.51 0.00 -0.55 0.00 0.00 41.25 40.40 1z84 s ASN 334 CO -0.01 -0.04 2.05 -0.81 -2.79 0.00 0.00 177.10 175.50 1z84 n PRO 335 N 4.73 0.42 -4.06 0.43 -0.04 -1.26 -1.13 135.00 134.09 1z84 n PRO 335 Ca -0.19 -0.00 -0.24 0.00 -0.04 0.00 0.00 63.50 63.03 1z84 n PRO 335 Cb 0.50 -1.50 -0.17 0.00 -0.04 0.00 0.00 33.50 32.29 1z84 n PRO 335 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1z84 s VAL 336 N -2.58 0.82 0.43 0.52 1.01 -1.26 -4.01 120.40 115.33 1z84 s VAL 336 Ca 0.28 -0.21 -0.25 0.00 0.00 0.00 0.00 61.98 61.81 1z84 s VAL 336 Cb 0.20 -0.85 -0.08 0.00 0.00 0.00 0.00 36.38 35.66 1z84 s VAL 336 CO 0.46 0.32 1.24 -0.36 0.00 0.00 0.00 175.10 176.76 1z84 s PHE 337 N 1.41 2.86 0.45 5.22 0.40 -1.26 -4.76 117.98 122.30 1z84 s PHE 337 Ca -0.02 1.48 0.17 0.00 -0.60 0.00 0.00 56.93 57.95 1z84 s PHE 337 Cb -0.13 -3.54 1.10 0.00 0.51 0.00 0.00 43.02 40.95 1z84 s PHE 337 CO -0.04 -1.81 2.02 -1.00 0.70 0.00 0.00 175.22 175.09 1z84 h PRO 338 N 2.44 0.00 -0.59 0.24 0.13 -1.86 -1.43 132.00 130.93 1z84 h PRO 338 Ca -0.49 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.76 1z84 h PRO 338 Cb 1.25 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.27 1z84 h PRO 338 CO 0.62 0.16 -0.04 0.93 -0.23 0.00 0.00 178.00 179.44 1z84 h GLU 339 N 0.00 0.08 -0.26 0.86 3.07 -1.91 -0.35 114.58 116.07 1z84 h GLU 339 Ca -0.00 -0.00 -0.19 0.00 -0.50 0.00 0.00 59.36 58.67 1z84 h GLU 339 Cb 0.30 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 28.19 1z84 h GLU 339 CO 0.02 0.05 -0.57 -0.44 -1.40 0.00 0.00 179.01 176.67 1z84 h ASP 340 N 0.08 0.95 0.20 1.42 3.32 -1.65 -2.60 116.42 118.14 1z84 h ASP 340 Ca 0.30 -0.55 0.01 0.00 0.02 0.00 0.00 57.03 56.81 1z84 h ASP 340 Cb 0.48 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 1z84 h ASP 340 CO -0.53 1.33 -0.24 0.58 -1.72 0.00 0.00 179.24 178.65 1z84 h VAL 341 N 0.61 0.47 -0.76 -1.35 2.07 -1.15 -1.11 116.25 115.03 1z84 h VAL 341 Ca 0.00 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.59 1z84 h VAL 341 Cb 1.18 0.47 -0.06 0.00 -1.52 0.00 0.00 31.29 31.37 1z84 h VAL 341 CO 0.13 0.00 0.44 0.00 0.02 0.00 0.00 177.57 178.16 1z84 h ALA 342 N 0.21 1.04 -0.10 1.67 0.00 -1.09 0.15 119.26 121.14 1z84 h ALA 342 Ca 0.01 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1z84 h ALA 342 Cb 0.48 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 1z84 h ALA 342 CO -0.08 0.12 0.05 -0.22 0.00 0.00 0.00 179.25 179.12 1z84 h LYS 343 N 0.79 0.14 -0.31 0.00 3.64 -1.12 0.67 116.57 120.38 1z84 h LYS 343 Ca 0.34 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.72 1z84 h LYS 343 Cb 0.23 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 1z84 h LYS 343 CO -0.20 0.19 0.19 0.28 -2.27 0.00 0.00 179.45 177.64 1z84 h VAL 344 N 0.06 1.04 -0.10 2.00 2.07 -0.75 -3.07 116.25 117.50 1z84 h VAL 344 Ca 0.04 -0.13 -0.15 0.00 0.82 0.00 0.00 66.70 67.28 1z84 h VAL 344 Cb 0.09 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 1z84 h VAL 344 CO -0.01 0.07 -0.59 0.24 0.02 0.00 0.00 177.57 177.31 1z84 h MET 345 N 0.38 0.32 0.00 1.57 2.86 -0.50 -2.30 114.93 117.26 1z84 h MET 345 Ca 0.12 -0.21 -0.02 0.00 -2.06 0.00 0.00 59.70 57.53 1z84 h MET 345 Cb -0.01 0.03 -0.00 0.00 0.06 0.00 0.00 31.60 31.68 1z84 h MET 345 CO -0.05 0.81 -0.11 0.00 1.06 0.00 0.00 176.91 178.61 1z84 h ARG 346 N 0.24 0.00 -0.01 1.72 3.08 -0.81 -2.82 114.38 115.79 1z84 h ARG 346 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1z84 h ARG 346 Cb 1.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.15 1z84 h ARG 346 CO 0.10 0.11 -0.22 0.39 -1.07 0.00 0.00 179.97 179.28 1z84 n GLU 347 N -4.03 1.10 -1.96 0.04 -0.58 -0.88 -4.93 120.64 109.41 1z84 n GLU 347 Ca -0.02 -0.69 -0.42 0.00 -0.42 0.00 0.00 57.16 55.60 1z84 n GLU 347 Cb 0.20 -1.49 -0.03 0.00 -0.57 0.00 0.00 31.44 29.56 1z84 n GLU 347 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1z84 s VAL 348 N -2.38 2.96 -0.22 2.62 1.01 -1.07 -4.98 120.40 118.34 1z84 s VAL 348 Ca 0.27 0.54 -0.07 0.00 0.00 0.00 0.00 61.98 62.72 1z84 s VAL 348 Cb 0.20 -3.35 -0.03 0.00 0.00 0.00 0.00 36.38 33.20 1z84 s VAL 348 CO 0.48 0.02 0.06 -0.55 0.00 0.00 0.00 175.10 175.10 1z84 s SER 349 N 1.86 5.19 0.00 3.32 0.15 -1.26 -5.08 113.70 117.88 1z84 s SER 349 Ca 0.71 -0.14 0.25 0.00 0.70 0.00 0.00 55.95 57.47 1z84 s SER 349 Cb -0.40 -1.91 0.37 0.00 -1.71 0.00 0.00 66.02 62.36 1z84 s SER 349 CO 0.31 0.03 1.36 0.18 1.20 0.00 0.00 173.24 176.33