#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r91 s GLU 22 N 0.00 3.75 -0.33 0.03 2.02 -0.50 -4.92 118.70 118.75 2r91 s GLU 22 Ca 0.00 0.15 -0.13 0.00 0.02 0.00 0.00 54.97 55.02 2r91 s GLU 22 Cb 0.00 -3.00 -0.02 0.00 0.10 0.00 0.00 34.13 31.21 2r91 s GLU 22 CO 0.00 0.56 0.24 0.42 0.02 0.00 0.00 175.26 176.50 2r91 s ILE 23 N -1.40 5.28 -0.20 -1.63 1.01 -1.26 -1.25 121.20 121.75 2r91 s ILE 23 Ca 0.33 -0.12 -0.04 0.00 0.00 0.00 0.00 60.65 60.82 2r91 s ILE 23 Cb -0.14 -3.68 -0.01 0.00 0.01 0.00 0.00 42.46 38.63 2r91 s ILE 23 CO 0.18 0.04 -0.04 -0.69 0.00 0.00 0.00 174.94 174.43 2r91 s VAL 24 N 1.75 3.52 -0.23 2.92 1.01 0.03 -0.39 120.40 129.00 2r91 s VAL 24 Ca 0.07 -0.46 -0.18 0.00 0.00 0.00 0.00 61.98 61.41 2r91 s VAL 24 Cb -0.17 -2.58 -0.03 0.00 0.00 0.00 0.00 36.38 33.60 2r91 s VAL 24 CO 0.11 0.44 0.52 0.00 0.00 0.00 0.00 175.10 176.17 2r91 s ALA 25 N 1.15 3.57 -0.93 5.51 0.00 -0.56 -3.32 121.76 127.19 2r91 s ALA 25 Ca 0.02 -0.51 -0.21 0.00 0.00 0.00 0.00 51.96 51.26 2r91 s ALA 25 Cb -0.15 -2.86 0.09 0.00 0.00 0.00 0.00 23.12 20.20 2r91 s ALA 25 CO -0.00 -0.61 1.25 -1.25 0.00 0.00 0.00 175.76 175.14 2r91 s PRO 26 N 2.02 3.53 0.37 0.00 0.04 -1.26 -0.03 135.00 139.67 2r91 s PRO 26 Ca 0.23 -1.33 -0.26 0.00 0.04 0.00 0.00 61.00 59.68 2r91 s PRO 26 Cb -0.15 -4.99 -0.09 0.00 0.04 0.00 0.00 34.50 29.31 2r91 s PRO 26 CO 0.09 -1.98 1.11 0.14 0.04 0.00 0.00 177.00 176.40 2r91 s VAL 27 N 3.92 3.44 0.59 -0.36 -7.23 -0.90 -4.43 120.40 115.44 2r91 s VAL 27 Ca 0.37 1.22 -0.18 0.00 -1.81 0.00 0.00 61.98 61.58 2r91 s VAL 27 Cb -0.04 -3.69 -0.03 0.00 0.56 0.00 0.00 36.38 33.17 2r91 s VAL 27 CO -0.06 0.12 1.17 0.27 -0.31 0.00 0.00 175.10 176.29 2r91 s ILE 28 N -1.45 2.84 -0.40 -0.62 -4.36 -1.26 -3.47 121.20 112.48 2r91 s ILE 28 Ca 0.54 0.50 -0.17 0.00 -0.26 0.00 0.00 60.65 61.26 2r91 s ILE 28 Cb -0.28 -3.16 0.01 0.00 1.25 0.00 0.00 42.46 40.28 2r91 s ILE 28 CO 0.35 -0.13 0.42 -0.89 0.24 0.00 0.00 174.94 174.92 2r91 s THR 29 N -1.75 5.11 -0.57 8.37 2.01 -1.26 -4.92 115.64 122.63 2r91 s THR 29 Ca 0.75 -0.24 -0.24 0.00 0.31 0.00 0.00 61.69 62.27 2r91 s THR 29 Cb -0.27 -3.98 0.04 0.00 0.01 0.00 0.00 72.50 68.30 2r91 s THR 29 CO 0.33 -0.33 0.97 0.42 -0.69 0.00 0.00 174.62 175.32 2r91 s THR 30 N 2.11 4.33 0.24 -0.82 -4.23 -1.26 -4.65 115.64 111.36 2r91 s THR 30 Ca 0.12 0.28 -0.05 0.00 -1.18 0.00 0.00 61.69 60.86 2r91 s THR 30 Cb -0.17 -4.58 -0.05 0.00 1.34 0.00 0.00 72.50 69.04 2r91 s THR 30 CO 0.13 -1.18 0.49 -0.36 -0.54 0.00 0.00 174.62 173.16 2r91 s PHE 31 N 4.09 3.47 -0.23 3.99 0.08 -0.39 -0.64 117.98 128.34 2r91 s PHE 31 Ca 0.31 0.61 -0.12 0.00 0.12 0.00 0.00 56.93 57.84 2r91 s PHE 31 Cb -0.12 -2.07 0.07 0.00 -0.57 0.00 0.00 43.02 40.33 2r91 s PHE 31 CO 0.19 0.27 0.55 0.50 -0.10 0.00 0.00 175.22 176.63 2r91 s ARG 32 N -3.24 0.55 4.93 0.44 3.52 -0.44 -0.98 118.95 123.72 2r91 s ARG 32 Ca 0.43 1.02 0.00 0.00 -0.13 0.00 0.00 55.73 57.05 2r91 s ARG 32 Cb -0.11 0.08 0.00 0.00 -1.56 0.00 0.00 34.95 33.36 2r91 s ARG 32 CO 0.27 -0.16 0.00 0.41 -0.81 0.00 0.00 175.30 175.02 2r91 n GLY 33 N 4.34 0.91 0.89 8.12 0.00 -1.26 -3.32 105.19 114.87 2r91 n GLY 33 Ca -0.21 -0.76 0.08 0.00 0.00 0.00 0.00 46.02 45.13 2r91 n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r91 n GLY 34 N 0.00 2.17 3.08 -0.02 0.00 -1.26 -5.01 105.19 104.14 2r91 n GLY 34 Ca 0.00 -0.54 -0.08 0.00 0.00 0.00 0.00 46.02 45.40 2r91 n GLY 34 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2r91 s ARG 35 N -1.08 0.59 0.14 1.61 1.70 -1.21 -5.08 118.95 115.62 2r91 s ARG 35 Ca 0.31 -1.15 -0.33 0.00 -0.47 0.00 0.00 55.73 54.09 2r91 s ARG 35 Cb 0.17 0.16 -0.13 0.00 -0.57 0.00 0.00 34.95 34.59 2r91 s ARG 35 CO 0.23 -0.09 1.68 -0.11 -1.08 0.00 0.00 175.30 175.92 2r91 n LEU 36 N 0.29 3.48 -4.17 -1.89 7.94 -1.26 -1.33 117.00 120.06 2r91 n LEU 36 Ca -0.15 1.05 -0.40 0.00 -1.11 0.00 0.00 56.01 55.41 2r91 n LEU 36 Cb 0.60 -1.47 -0.08 0.00 0.53 0.00 0.00 43.42 43.00 2r91 n LEU 36 CO 0.27 -0.09 0.13 -0.62 -1.11 0.00 0.00 177.39 175.98 2r91 s ASP 37 N 1.56 5.68 0.60 1.96 -1.08 0.18 -4.85 116.67 120.72 2r91 s ASP 37 Ca 0.80 -2.72 0.39 0.00 -0.52 0.00 0.00 52.55 50.50 2r91 s ASP 37 Cb -0.61 -1.96 1.98 0.00 -1.46 0.00 0.00 42.92 40.87 2r91 s ASP 37 CO 0.38 -0.45 2.19 1.55 0.52 0.00 0.00 175.17 179.35 2r91 h PRO 38 N 7.37 0.00 -0.01 4.34 0.13 -1.93 -2.59 132.00 139.32 2r91 h PRO 38 Ca -0.00 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.99 2r91 h PRO 38 Cb 0.99 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.13 2r91 h PRO 38 CO 0.74 0.00 -0.53 0.93 -0.23 0.00 0.00 178.00 178.91 2r91 h GLU 39 N 0.00 0.38 -0.87 0.86 5.08 -1.94 -1.85 114.58 116.24 2r91 h GLU 39 Ca 0.00 -0.39 0.01 0.00 -1.00 0.00 0.00 59.36 57.97 2r91 h GLU 39 Cb 0.17 0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 2r91 h GLU 39 CO 0.00 1.06 0.57 1.25 -1.00 0.00 0.00 179.01 180.89 2r91 h LEU 40 N -0.15 1.01 0.12 1.33 5.85 -1.83 -2.17 115.31 119.47 2r91 h LEU 40 Ca -0.06 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 2r91 h LEU 40 Cb 1.24 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 42.02 2r91 h LEU 40 CO 0.11 0.74 -0.06 0.15 -0.34 0.00 0.00 178.44 179.03 2r91 h PHE 41 N 1.18 -0.15 -0.44 1.25 3.57 -1.47 -1.68 116.94 119.20 2r91 h PHE 41 Ca 0.32 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.88 2r91 h PHE 41 Cb -0.12 0.05 -0.06 0.00 2.79 0.00 0.00 35.95 38.61 2r91 h PHE 41 CO -0.01 -0.03 0.10 0.00 -2.23 0.00 0.00 178.31 176.14 2r91 h ALA 42 N 0.63 0.49 -0.67 2.41 0.00 -1.21 0.10 119.26 121.02 2r91 h ALA 42 Ca -0.02 0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.04 2r91 h ALA 42 Cb 0.19 0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 2r91 h ALA 42 CO 0.03 -0.30 0.37 -0.97 0.00 0.00 0.00 179.25 178.38 2r91 h ASN 43 N 0.24 0.54 -0.27 0.00 -1.24 -1.23 -0.66 115.58 112.98 2r91 h ASN 43 Ca 0.21 0.03 -0.05 0.00 0.71 0.00 0.00 56.30 57.20 2r91 h ASN 43 Cb 0.26 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.22 2r91 h ASN 43 CO -0.27 0.35 -0.03 -0.74 -1.29 0.00 0.00 177.43 175.46 2r91 h HIS 44 N 0.68 0.54 -0.62 0.67 2.76 -0.76 -0.98 115.15 117.44 2r91 h HIS 44 Ca 0.30 -0.10 0.06 0.00 -2.20 0.00 0.00 60.37 58.43 2r91 h HIS 44 Cb 0.19 -0.14 -0.05 0.00 1.55 0.00 0.00 27.41 28.96 2r91 h HIS 44 CO -0.08 0.67 0.33 0.28 -1.30 0.00 0.00 177.93 177.83 2r91 h VAL 45 N 0.26 0.95 -0.45 5.26 2.07 -0.75 -1.95 116.25 121.64 2r91 h VAL 45 Ca 0.07 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 2r91 h VAL 45 Cb 0.47 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.50 2r91 h VAL 45 CO 0.02 0.11 0.20 0.11 0.02 0.00 0.00 177.57 178.03 2r91 h LYS 46 N 0.62 0.65 -0.18 1.57 1.57 -0.94 -1.85 116.57 118.00 2r91 h LYS 46 Ca 0.28 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 2r91 h LYS 46 Cb 0.19 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 2r91 h LYS 46 CO -0.19 0.57 0.07 -0.97 -0.57 0.00 0.00 179.45 178.37 2r91 h ASN 47 N 0.58 0.25 0.40 0.86 -1.24 -0.79 -2.86 115.58 112.77 2r91 h ASN 47 Ca 0.15 -0.16 -0.16 0.00 0.71 0.00 0.00 56.30 56.84 2r91 h ASN 47 Cb 0.15 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.12 2r91 h ASN 47 CO -0.02 0.34 -0.67 0.16 -1.29 0.00 0.00 177.43 175.95 2r91 h ILE 48 N 0.14 1.41 0.00 2.57 3.07 -1.34 -2.20 117.51 121.16 2r91 h ILE 48 Ca 0.06 -2.13 0.00 0.00 1.55 0.00 0.00 64.86 64.34 2r91 h ILE 48 Cb 0.17 2.11 0.00 0.00 -0.27 0.00 0.00 36.82 38.83 2r91 h ILE 48 CO -0.01 0.63 0.00 0.71 -1.05 0.00 0.00 178.15 178.43 2r91 h THR 49 N 0.17 0.00 -0.01 0.16 1.35 -1.36 -1.19 112.91 112.03 2r91 h THR 49 Ca -0.02 -0.23 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 2r91 h THR 49 Cb 1.21 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 2r91 h THR 49 CO 0.11 0.00 -0.30 -1.54 -0.25 0.00 0.00 175.52 173.53 2r91 n SER 50 N -2.80 1.02 -0.25 5.36 3.41 -0.85 -3.86 113.62 115.66 2r91 n SER 50 Ca -0.00 -0.85 0.06 0.00 -0.26 0.00 0.00 58.87 57.81 2r91 n SER 50 Cb 0.18 0.18 0.11 0.00 -0.26 0.00 0.00 64.21 64.42 2r91 n SER 50 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2r91 n LYS 51 N -0.72 2.34 0.00 4.33 5.02 -0.52 -4.97 118.16 123.64 2r91 n LYS 51 Ca 0.11 -2.18 0.00 0.00 -2.02 0.00 0.00 58.31 54.22 2r91 n LYS 51 Cb 0.35 -1.35 0.00 0.00 -0.02 0.00 0.00 35.03 34.01 2r91 n LYS 51 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2r91 n GLY 52 N -0.71 1.45 3.70 0.72 0.00 -1.11 -3.68 105.19 105.55 2r91 n GLY 52 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 2r91 n GLY 52 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2r91 s VAL 53 N -1.74 3.61 -0.13 1.61 1.01 -0.82 -4.59 120.40 119.36 2r91 s VAL 53 Ca 0.00 1.07 -0.03 0.00 0.00 0.00 0.00 61.98 63.02 2r91 s VAL 53 Cb 0.00 -3.69 -0.25 0.00 0.00 0.00 0.00 36.38 32.44 2r91 s VAL 53 CO 0.00 0.03 0.34 0.47 0.00 0.00 0.00 175.10 175.94 2r91 n ASP 54 N 4.80 1.90 -4.02 3.32 8.00 0.47 -4.45 116.55 126.58 2r91 n ASP 54 Ca 0.12 0.20 -0.18 0.00 0.71 0.00 0.00 54.79 55.64 2r91 n ASP 54 Cb 0.43 -0.67 -0.14 0.00 -0.02 0.00 0.00 41.12 40.72 2r91 n ASP 54 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2r91 s VAL 55 N -2.56 0.66 -0.23 2.53 1.01 -1.10 -4.57 120.40 116.14 2r91 s VAL 55 Ca -0.21 -0.42 -0.09 0.00 0.00 0.00 0.00 61.98 61.26 2r91 s VAL 55 Cb 0.07 -0.57 -0.04 0.00 0.00 0.00 0.00 36.38 35.84 2r91 s VAL 55 CO 0.76 0.14 0.11 -0.69 0.00 0.00 0.00 175.10 175.42 2r91 s VAL 56 N -0.29 4.84 -0.40 2.92 1.01 0.09 -1.49 120.40 127.07 2r91 s VAL 56 Ca 0.02 -0.00 -0.10 0.00 0.00 0.00 0.00 61.98 61.91 2r91 s VAL 56 Cb -0.04 -3.25 0.06 0.00 0.00 0.00 0.00 36.38 33.16 2r91 s VAL 56 CO -0.00 0.36 0.24 0.12 0.00 0.00 0.00 175.10 175.81 2r91 s PHE 57 N 1.15 3.30 0.01 5.22 5.36 0.95 -0.43 117.98 133.54 2r91 s PHE 57 Ca 0.06 -1.32 -0.13 0.00 -0.96 0.00 0.00 56.93 54.58 2r91 s PHE 57 Cb -0.14 -2.74 -0.06 0.00 -0.34 0.00 0.00 43.02 39.74 2r91 s PHE 57 CO 0.04 -0.77 0.38 0.54 -1.46 0.00 0.00 175.22 173.95 2r91 s VAL 58 N 1.47 5.09 -1.16 3.12 0.11 0.05 -2.12 120.40 126.96 2r91 s VAL 58 Ca 0.02 0.67 -0.01 0.00 -2.93 0.00 0.00 61.98 59.74 2r91 s VAL 58 Cb -0.22 -3.67 0.00 0.00 -1.53 0.00 0.00 36.38 30.97 2r91 s VAL 58 CO 0.04 0.50 0.09 0.00 -3.33 0.00 0.00 175.10 172.40 2r91 n ALA 59 N 1.56 -0.47 -1.27 1.54 0.00 -1.26 -1.42 120.51 119.19 2r91 n ALA 59 Ca -0.13 0.13 -0.03 0.00 0.00 0.00 0.00 53.44 53.42 2r91 n ALA 59 Cb 0.53 -1.90 0.02 0.00 0.00 0.00 0.00 19.45 18.10 2r91 n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r91 n GLY 60 N -1.07 -0.92 0.36 0.00 0.00 -1.26 -3.74 105.19 98.55 2r91 n GLY 60 Ca -0.15 -1.71 -0.03 0.00 0.00 0.00 0.00 46.02 44.13 2r91 n GLY 60 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2r91 h THR 61 N -1.00 1.25 0.00 2.61 2.02 -1.95 0.51 112.91 116.35 2r91 h THR 61 Ca -0.05 -0.53 -0.02 0.00 0.77 0.00 0.00 66.41 66.58 2r91 h THR 61 Cb 0.15 -0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 66.51 2r91 h THR 61 CO 0.04 0.26 -0.11 0.74 0.37 0.00 0.00 175.52 176.82 2r91 h THR 62 N 1.26 0.86 -0.35 3.16 2.02 -1.90 -0.54 112.91 117.41 2r91 h THR 62 Ca 0.33 -0.39 0.00 0.00 0.77 0.00 0.00 66.41 67.12 2r91 h THR 62 Cb -0.07 1.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.57 2r91 h THR 62 CO -0.06 0.10 0.00 0.61 0.37 0.00 0.00 175.52 176.54 2r91 n GLY 63 N -1.07 1.27 2.39 2.16 0.00 0.05 -4.42 105.19 105.56 2r91 n GLY 63 Ca -0.02 -0.43 -0.19 0.00 0.00 0.00 0.00 46.02 45.37 2r91 n GLY 63 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2r91 n LEU 64 N 0.52 -1.91 -0.22 0.99 4.32 -0.21 -4.25 117.00 116.24 2r91 n LEU 64 Ca 0.13 -0.03 -0.06 0.00 -0.02 0.00 0.00 56.01 56.04 2r91 n LEU 64 Cb 0.46 -2.76 -0.05 0.00 -1.62 0.00 0.00 43.42 39.44 2r91 n LEU 64 CO 0.11 -0.19 0.41 0.61 -1.22 0.00 0.00 177.39 177.12 2r91 n GLY 65 N -1.03 -2.38 0.21 -0.72 0.00 -0.47 -0.85 105.19 99.94 2r91 n GLY 65 Ca -0.23 0.81 0.13 0.00 0.00 0.00 0.00 46.02 46.73 2r91 n GLY 65 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2r91 h PRO 66 N 0.00 0.00 -0.02 1.61 0.11 -1.86 -1.42 132.00 130.42 2r91 h PRO 66 Ca 0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.19 2r91 h PRO 66 Cb 0.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.32 2r91 h PRO 66 CO -0.49 0.00 -0.06 0.00 -0.21 0.00 0.00 178.00 177.24 2r91 n ALA 67 N -1.80 2.68 -2.89 -0.75 0.00 -0.03 -4.95 120.51 112.77 2r91 n ALA 67 Ca -0.02 -0.48 -0.35 0.00 0.00 0.00 0.00 53.44 52.60 2r91 n ALA 67 Cb 0.12 -1.10 -0.05 0.00 0.00 0.00 0.00 19.45 18.42 2r91 n ALA 67 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2r91 s LEU 68 N -2.10 4.37 0.77 0.00 1.43 -0.54 -5.09 118.68 117.52 2r91 s LEU 68 Ca 0.34 0.39 -0.11 0.00 -1.03 0.00 0.00 54.13 53.72 2r91 s LEU 68 Cb 0.20 -2.38 0.05 0.00 0.03 0.00 0.00 46.19 44.10 2r91 s LEU 68 CO 0.37 0.32 1.09 -0.94 0.23 0.00 0.00 176.35 177.42 2r91 s SER 69 N -1.55 4.71 0.28 2.29 1.04 -1.26 -4.87 113.70 114.34 2r91 s SER 69 Ca 0.22 1.37 0.01 0.00 0.48 0.00 0.00 55.95 58.03 2r91 s SER 69 Cb -0.12 -2.13 0.65 0.00 0.10 0.00 0.00 66.02 64.51 2r91 s SER 69 CO 0.12 -1.84 1.71 0.25 0.98 0.00 0.00 173.24 174.47 2r91 h LEU 70 N -1.00 0.35 -0.63 2.42 5.85 -1.97 -1.92 115.31 118.40 2r91 h LEU 70 Ca -0.46 0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.37 2r91 h LEU 70 Cb 1.26 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.36 2r91 h LEU 70 CO 0.59 0.05 0.29 1.56 -0.34 0.00 0.00 178.44 180.59 2r91 h GLN 71 N 0.44 0.92 -0.84 1.25 7.50 -1.99 0.08 115.11 122.48 2r91 h GLN 71 Ca 0.52 -0.14 -0.04 0.00 0.50 0.00 0.00 58.65 59.49 2r91 h GLN 71 Cb 0.91 -0.16 -0.04 0.00 0.05 0.00 0.00 27.48 28.24 2r91 h GLN 71 CO -0.48 0.75 0.38 0.93 -1.50 0.00 0.00 178.83 178.91 2r91 h GLU 72 N 0.88 1.22 -0.33 1.46 5.08 -1.77 -1.15 114.58 119.97 2r91 h GLU 72 Ca 0.22 -0.19 -0.14 0.00 -1.00 0.00 0.00 59.36 58.25 2r91 h GLU 72 Cb 0.14 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 2r91 h GLU 72 CO -0.03 0.95 -0.34 0.87 -1.00 0.00 0.00 179.01 179.47 2r91 h LYS 73 N 1.20 0.75 -0.69 2.33 1.57 -0.88 -0.88 116.57 119.97 2r91 h LYS 73 Ca 0.28 -0.36 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 2r91 h LYS 73 Cb 0.15 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 2r91 h LYS 73 CO -0.03 0.98 0.41 0.52 -0.57 0.00 0.00 179.45 180.75 2r91 h MET 74 N 0.63 0.94 -0.64 3.15 2.86 -0.82 -0.43 114.93 120.62 2r91 h MET 74 Ca 0.06 -0.09 -0.06 0.00 -2.06 0.00 0.00 59.70 57.55 2r91 h MET 74 Cb 0.88 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 32.31 2r91 h MET 74 CO 0.08 0.68 0.16 1.49 1.06 0.00 0.00 176.91 180.38 2r91 h GLU 75 N 0.94 1.00 -0.56 1.72 4.81 -0.96 -1.66 114.58 119.86 2r91 h GLU 75 Ca 0.25 -0.22 -0.08 0.00 -0.13 0.00 0.00 59.36 59.18 2r91 h GLU 75 Cb -0.01 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.20 2r91 h GLU 75 CO -0.04 0.88 0.05 -0.07 -0.73 0.00 0.00 179.01 179.09 2r91 h LEU 76 N 0.95 0.90 -0.38 1.64 3.38 -0.86 -1.63 115.31 119.32 2r91 h LEU 76 Ca 0.21 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2r91 h LEU 76 Cb 0.33 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2r91 h LEU 76 CO -0.00 0.93 0.25 0.74 0.09 0.00 0.00 178.44 180.44 2r91 h THR 77 N 0.87 1.10 0.03 0.22 2.02 -0.37 0.15 112.91 116.94 2r91 h THR 77 Ca 0.17 -0.19 -0.00 0.00 0.77 0.00 0.00 66.41 67.16 2r91 h THR 77 Cb 0.45 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 2r91 h THR 77 CO 0.02 0.10 -0.02 0.44 0.37 0.00 0.00 175.52 176.43 2r91 h ASP 78 N 0.51 -0.04 -0.58 4.18 3.32 -1.26 -1.59 116.42 120.96 2r91 h ASP 78 Ca 0.14 -0.14 -0.07 0.00 0.02 0.00 0.00 57.03 56.98 2r91 h ASP 78 Cb -0.05 0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 2r91 h ASP 78 CO -0.03 0.11 0.09 0.00 -1.72 0.00 0.00 179.24 177.69 2r91 h ALA 79 N 0.77 1.01 -0.10 3.45 0.00 -1.13 -2.20 119.26 121.06 2r91 h ALA 79 Ca -0.00 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.57 2r91 h ALA 79 Cb 0.17 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2r91 h ALA 79 CO 0.01 0.63 -0.25 0.00 0.00 0.00 0.00 179.25 179.64 2r91 h ALA 80 N 1.16 0.17 0.00 0.00 0.00 -0.91 -2.32 119.26 117.35 2r91 h ALA 80 Ca 0.19 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 2r91 h ALA 80 Cb 0.42 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2r91 h ALA 80 CO 0.01 0.15 -0.16 1.79 0.00 0.00 0.00 179.25 181.05 2r91 h THR 81 N -0.10 0.94 0.00 0.00 1.35 -1.28 0.19 112.91 114.01 2r91 h THR 81 Ca -0.00 -0.57 -0.03 0.00 -0.55 0.00 0.00 66.41 65.25 2r91 h THR 81 Cb 0.85 1.32 -0.00 0.00 -1.73 0.00 0.00 68.15 68.59 2r91 h THR 81 CO 0.05 0.15 -0.16 0.28 -0.25 0.00 0.00 175.52 175.60 2r91 h SER 82 N 0.00 0.00 0.00 5.36 0.02 -1.34 -3.33 113.55 114.26 2r91 h SER 82 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2r91 h SER 82 Cb 0.31 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.85 2r91 h SER 82 CO 0.02 0.16 -0.67 0.00 -1.14 0.00 0.00 176.83 175.21 2r91 n ALA 83 N -2.14 3.76 -2.99 3.77 0.00 -0.72 -4.99 120.51 117.20 2r91 n ALA 83 Ca 0.03 -0.39 -0.10 0.00 0.00 0.00 0.00 53.44 52.99 2r91 n ALA 83 Cb 0.58 -0.50 -0.11 0.00 0.00 0.00 0.00 19.45 19.42 2r91 n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2r91 s ALA 84 N -2.30 0.04 0.18 0.00 0.00 0.57 -4.61 121.76 115.64 2r91 s ALA 84 Ca 0.05 -0.45 0.05 0.00 0.00 0.00 0.00 51.96 51.61 2r91 s ALA 84 Cb 0.10 0.12 0.03 0.00 0.00 0.00 0.00 23.12 23.37 2r91 s ALA 84 CO 0.56 -0.15 1.41 0.00 0.00 0.00 0.00 175.76 177.58 2r91 h ARG 85 N 4.78 0.13 -4.62 0.00 3.08 -1.85 -3.41 114.38 112.49 2r91 h ARG 85 Ca -0.31 -0.14 -0.62 0.00 0.07 0.00 0.00 59.98 58.98 2r91 h ARG 85 Cb 1.21 0.04 -0.37 0.00 0.08 0.00 0.00 29.97 30.93 2r91 h ARG 85 CO 0.42 0.90 -0.81 1.03 -1.07 0.00 0.00 179.97 180.43 2r91 s ARG 86 N -3.21 2.11 -0.03 0.04 0.52 -1.26 -4.93 118.95 112.18 2r91 s ARG 86 Ca -0.02 -0.86 0.01 0.00 -0.52 0.00 0.00 55.73 54.34 2r91 s ARG 86 Cb 0.11 -2.43 0.02 0.00 0.52 0.00 0.00 34.95 33.17 2r91 s ARG 86 CO 0.81 -0.41 -0.01 0.08 0.02 0.00 0.00 175.30 175.79 2r91 s VAL 87 N 1.38 0.26 -0.09 3.52 1.01 -1.26 -0.74 120.40 124.48 2r91 s VAL 87 Ca -0.01 0.03 0.02 0.00 0.00 0.00 0.00 61.98 62.02 2r91 s VAL 87 Cb -0.16 -0.33 -0.02 0.00 0.00 0.00 0.00 36.38 35.87 2r91 s VAL 87 CO -0.08 0.16 -0.16 -0.63 0.00 0.00 0.00 175.10 174.39 2r91 s ILE 88 N 0.93 2.88 -0.17 2.22 1.01 0.42 -0.91 121.20 127.59 2r91 s ILE 88 Ca -0.10 -0.75 -0.04 0.00 0.00 0.00 0.00 60.65 59.76 2r91 s ILE 88 Cb -0.13 -2.16 -0.03 0.00 0.01 0.00 0.00 42.46 40.15 2r91 s ILE 88 CO -0.01 0.55 -0.02 -0.69 0.00 0.00 0.00 174.94 174.77 2r91 s VAL 89 N -0.06 3.91 -0.09 2.92 1.01 -0.95 -0.77 120.40 126.37 2r91 s VAL 89 Ca -0.04 -0.34 -0.23 0.00 0.00 0.00 0.00 61.98 61.37 2r91 s VAL 89 Cb -0.14 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.47 2r91 s VAL 89 CO 0.04 0.47 0.68 -1.58 0.00 0.00 0.00 175.10 174.71 2r91 s GLN 90 N 0.58 4.40 0.00 2.72 -0.44 -0.51 -1.10 119.66 125.32 2r91 s GLN 90 Ca -0.02 0.82 0.00 0.00 -2.50 0.00 0.00 55.36 53.66 2r91 s GLN 90 Cb -0.14 -3.46 0.00 0.00 -1.64 0.00 0.00 33.01 27.76 2r91 s GLN 90 CO 0.02 0.03 0.49 1.33 0.50 0.00 0.00 175.29 177.67 2r91 n VAL 91 N 3.89 0.12 -1.60 1.34 0.24 -0.39 -4.76 118.33 117.17 2r91 n VAL 91 Ca -0.02 -0.48 -0.45 0.00 -2.04 0.00 0.00 64.34 61.35 2r91 n VAL 91 Cb 0.51 1.07 -0.02 0.00 -1.47 0.00 0.00 33.84 33.94 2r91 n VAL 91 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2r91 n ALA 92 N -0.06 -0.11 -3.29 2.33 0.00 -1.26 -4.04 120.51 114.08 2r91 n ALA 92 Ca 0.00 0.40 -0.14 0.00 0.00 0.00 0.00 53.44 53.70 2r91 n ALA 92 Cb 0.07 -2.05 -0.08 0.00 0.00 0.00 0.00 19.45 17.39 2r91 n ALA 92 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2r91 s SER 93 N -0.44 -0.28 0.00 0.00 0.15 -1.26 -4.86 113.70 107.01 2r91 s SER 93 Ca 0.60 0.22 0.20 0.00 0.70 0.00 0.00 55.95 57.67 2r91 s SER 93 Cb -0.71 0.37 1.07 0.00 -1.71 0.00 0.00 66.02 65.05 2r91 s SER 93 CO 0.59 -0.47 1.70 0.18 1.20 0.00 0.00 173.24 176.44 2r91 n LEU 94 N 1.26 0.34 -4.19 3.45 4.77 -1.26 -3.93 117.00 117.44 2r91 n LEU 94 Ca -0.21 -0.14 -0.38 0.00 -0.03 0.00 0.00 56.01 55.25 2r91 n LEU 94 Cb 0.56 -0.02 -0.11 0.00 -2.33 0.00 0.00 43.42 41.52 2r91 n LEU 94 CO 0.22 0.07 -0.15 0.21 -1.33 0.00 0.00 177.39 176.41 2r91 s ASN 95 N -1.60 5.40 0.64 -1.43 3.84 -1.26 -5.00 114.94 115.53 2r91 s ASN 95 Ca 0.30 -1.76 0.34 0.00 0.21 0.00 0.00 52.86 51.95 2r91 s ASN 95 Cb 0.14 -1.89 1.86 0.00 -0.55 0.00 0.00 41.25 40.81 2r91 s ASN 95 CO 0.23 -0.53 2.10 0.00 -2.79 0.00 0.00 177.10 176.11 2r91 h ALA 96 N 8.22 1.40 -0.21 1.71 0.00 -2.00 -1.39 119.26 126.99 2r91 h ALA 96 Ca -0.18 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.61 2r91 h ALA 96 Cb 1.06 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 2r91 h ALA 96 CO 0.72 -0.25 -0.37 -0.44 0.00 0.00 0.00 179.25 178.92 2r91 h ASP 97 N 0.00 0.47 -0.15 0.00 3.32 -1.94 -1.64 116.42 116.47 2r91 h ASP 97 Ca 0.03 -0.19 -0.07 0.00 0.02 0.00 0.00 57.03 56.82 2r91 h ASP 97 Cb 0.45 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 2r91 h ASP 97 CO -0.00 0.80 -0.12 -0.33 -1.72 0.00 0.00 179.24 177.86 2r91 h GLU 98 N 0.38 0.52 -0.14 3.56 5.08 -1.63 0.59 114.58 122.94 2r91 h GLU 98 Ca 0.04 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 58.23 2r91 h GLU 98 Cb 0.82 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 2r91 h GLU 98 CO 0.07 0.64 0.02 0.00 -1.00 0.00 0.00 179.01 178.73 2r91 h ALA 99 N 1.39 0.19 -0.26 3.43 0.00 -1.50 -0.01 119.26 122.50 2r91 h ALA 99 Ca 0.09 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2r91 h ALA 99 Cb 0.50 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2r91 h ALA 99 CO 0.03 -0.15 0.15 0.82 0.00 0.00 0.00 179.25 180.10 2r91 h ILE 100 N 0.01 1.11 -0.44 0.00 2.04 -1.20 -0.66 117.51 118.37 2r91 h ILE 100 Ca 0.04 -0.29 0.02 0.00 1.00 0.00 0.00 64.86 65.64 2r91 h ILE 100 Cb 0.31 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 2r91 h ILE 100 CO 0.00 0.11 0.24 0.00 0.00 0.00 0.00 178.15 178.51 2r91 h ALA 101 N 1.03 0.55 -0.34 1.87 0.00 -0.86 -1.81 119.26 119.71 2r91 h ALA 101 Ca 0.09 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.86 2r91 h ALA 101 Cb 0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2r91 h ALA 101 CO -0.02 -0.09 -0.37 1.25 0.00 0.00 0.00 179.25 180.03 2r91 h LEU 102 N 0.49 0.83 -0.12 0.00 5.85 -0.88 -1.73 115.31 119.76 2r91 h LEU 102 Ca 0.18 -0.37 0.04 0.00 0.84 0.00 0.00 57.88 58.57 2r91 h LEU 102 Cb 0.04 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 2r91 h LEU 102 CO -0.10 1.11 -0.12 0.00 -0.34 0.00 0.00 178.44 179.00 2r91 h ALA 103 N 0.93 -0.03 -0.70 1.25 0.00 -0.83 0.22 119.26 120.09 2r91 h ALA 103 Ca 0.06 0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.10 2r91 h ALA 103 Cb 0.92 0.24 -0.07 0.00 0.00 0.00 0.00 17.79 18.89 2r91 h ALA 103 CO 0.08 -0.57 0.36 0.87 0.00 0.00 0.00 179.25 180.00 2r91 h LYS 104 N -0.14 0.62 -0.68 0.00 1.57 -1.30 -1.19 116.57 115.44 2r91 h LYS 104 Ca 0.08 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.81 2r91 h LYS 104 Cb 0.26 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.40 2r91 h LYS 104 CO -0.20 0.41 0.36 -0.92 -0.57 0.00 0.00 179.45 178.53 2r91 h TYR 105 N 0.63 0.95 -0.27 -1.35 3.20 -0.65 -1.79 116.97 117.69 2r91 h TYR 105 Ca 0.34 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.15 2r91 h TYR 105 Cb 0.32 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.28 2r91 h TYR 105 CO -0.10 0.68 0.04 0.00 -1.64 0.00 0.00 178.16 177.15 2r91 h ALA 106 N 1.18 0.36 -0.29 1.82 0.00 -0.09 -2.20 119.26 120.03 2r91 h ALA 106 Ca 0.24 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 55.03 2r91 h ALA 106 Cb 0.06 -0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.68 2r91 h ALA 106 CO -0.04 0.04 -0.18 1.49 0.00 0.00 0.00 179.25 180.57 2r91 h GLU 107 N 0.26 -0.14 -0.08 0.00 4.81 -1.12 -1.15 114.58 117.16 2r91 h GLU 107 Ca 0.08 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.35 2r91 h GLU 107 Cb 0.33 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.74 2r91 h GLU 107 CO 0.01 -0.09 0.18 0.66 -0.73 0.00 0.00 179.01 179.03 2r91 h SER 108 N -0.15 0.00 -0.24 1.04 4.64 -1.09 -0.44 113.55 117.31 2r91 h SER 108 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2r91 h SER 108 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2r91 h SER 108 CO -0.38 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.12 2r91 n ARG 109 N -3.34 2.38 -0.24 4.77 5.12 -0.52 -4.95 116.66 119.88 2r91 n ARG 109 Ca -0.01 -2.06 0.00 0.00 -1.93 0.00 0.00 57.85 53.86 2r91 n ARG 109 Cb 0.27 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 30.08 2r91 n ARG 109 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2r91 n GLY 110 N 1.42 0.86 3.77 -0.13 0.00 -0.17 -4.91 105.19 106.04 2r91 n GLY 110 Ca 0.17 -0.18 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2r91 n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r91 s ALA 111 N -2.00 3.25 -0.40 4.61 0.00 -0.68 -4.81 121.76 121.74 2r91 s ALA 111 Ca 0.00 1.34 0.23 0.00 0.00 0.00 0.00 51.96 53.53 2r91 s ALA 111 Cb 0.00 -3.53 0.26 0.00 0.00 0.00 0.00 23.12 19.85 2r91 s ALA 111 CO 0.00 -0.99 1.45 1.05 0.00 0.00 0.00 175.76 177.27 2r91 h GLU 112 N 2.52 0.00 -2.61 0.00 4.11 -1.36 -3.43 114.58 113.80 2r91 h GLU 112 Ca -0.50 0.00 0.09 0.00 0.07 0.00 0.00 59.36 59.02 2r91 h GLU 112 Cb 1.25 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.40 2r91 h GLU 112 CO 0.62 0.00 0.37 0.00 0.07 0.00 0.00 179.01 180.07 2r91 s ALA 113 N -3.25 -1.59 0.21 1.06 0.00 -1.24 -4.23 121.76 112.72 2r91 s ALA 113 Ca 0.05 0.33 0.11 0.00 0.00 0.00 0.00 51.96 52.46 2r91 s ALA 113 Cb 0.07 0.68 -0.05 0.00 0.00 0.00 0.00 23.12 23.83 2r91 s ALA 113 CO 0.70 -0.89 -0.23 0.14 0.00 0.00 0.00 175.76 175.48 2r91 s VAL 114 N -3.48 2.38 0.13 0.00 -7.23 -0.83 -2.24 120.40 109.11 2r91 s VAL 114 Ca 0.08 -2.09 0.06 0.00 -1.81 0.00 0.00 61.98 58.22 2r91 s VAL 114 Cb -0.02 -2.15 -0.04 0.00 0.56 0.00 0.00 36.38 34.73 2r91 s VAL 114 CO -0.03 -0.16 -0.14 0.00 -0.31 0.00 0.00 175.10 174.47 2r91 s ALA 115 N -1.79 1.49 -0.01 1.32 0.00 -0.26 -0.10 121.76 122.40 2r91 s ALA 115 Ca 0.22 -1.31 -0.00 0.00 0.00 0.00 0.00 51.96 50.86 2r91 s ALA 115 Cb -0.07 -0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.00 2r91 s ALA 115 CO 0.11 0.08 0.03 0.45 0.00 0.00 0.00 175.76 176.42 2r91 s SER 116 N -2.53 0.02 0.49 0.00 0.15 -0.55 -1.26 113.70 110.02 2r91 s SER 116 Ca 0.10 0.04 -0.21 0.00 0.70 0.00 0.00 55.95 56.58 2r91 s SER 116 Cb -0.04 -0.01 -0.09 0.00 -1.71 0.00 0.00 66.02 64.16 2r91 s SER 116 CO 0.03 -0.07 0.79 0.18 1.20 0.00 0.00 173.24 175.37 2r91 n LEU 117 N 3.66 1.85 -4.70 3.45 4.77 -1.24 -1.35 117.00 123.45 2r91 n LEU 117 Ca -0.20 0.90 -0.30 0.00 -0.03 0.00 0.00 56.01 56.37 2r91 n LEU 117 Cb 0.55 -1.27 0.15 0.00 -2.33 0.00 0.00 43.42 40.52 2r91 n LEU 117 CO 0.24 -2.21 0.66 -2.84 -1.33 0.00 0.00 177.39 171.91 2r91 s PRO 118 N -2.08 1.18 -0.06 3.23 0.02 -1.25 -4.79 135.00 131.24 2r91 s PRO 118 Ca 0.67 1.03 -0.38 0.00 0.02 0.00 0.00 61.00 62.34 2r91 s PRO 118 Cb -0.51 -1.78 -0.16 0.00 0.02 0.00 0.00 34.50 32.06 2r91 s PRO 118 CO 0.55 -2.35 1.55 -2.30 -0.33 0.00 0.00 177.00 174.11 2r91 n PRO 119 N -3.99 1.27 -3.31 5.54 -0.02 -1.26 -4.96 135.00 128.28 2r91 n PRO 119 Ca 0.08 0.46 -0.20 0.00 -2.02 0.00 0.00 63.50 61.82 2r91 n PRO 119 Cb 0.54 -2.14 -0.01 0.00 -0.02 0.00 0.00 33.50 31.87 2r91 n PRO 119 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 2r91 n TYR 120 N 3.94 -0.63 0.00 6.00 0.18 -1.26 -4.85 117.16 120.54 2r91 n TYR 120 Ca 0.22 -1.74 0.00 0.00 1.88 0.00 0.00 57.90 58.26 2r91 n TYR 120 Cb 0.18 -0.32 0.00 0.00 -0.38 0.00 0.00 39.34 38.82 2r91 n TYR 120 CO 0.00 0.00 0.00 0.98 -2.08 0.00 0.00 176.86 175.76 2r91 n TYR 121 N -1.39 0.00 -1.95 -3.48 9.36 -1.23 -4.88 117.16 113.58 2r91 n TYR 121 Ca -0.03 0.00 -0.42 0.00 3.32 0.00 0.00 57.90 60.77 2r91 n TYR 121 Cb 0.46 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.15 2r91 n TYR 121 CO 0.00 0.00 0.00 -0.06 0.22 0.00 0.00 176.86 177.02 2r91 s PHE 122 N 0.00 1.89 0.16 2.98 0.08 -1.26 -4.92 117.98 116.91 2r91 s PHE 122 Ca 0.00 0.10 0.02 0.00 0.12 0.00 0.00 56.93 57.17 2r91 s PHE 122 Cb 0.00 -3.97 -0.02 0.00 -0.57 0.00 0.00 43.02 38.47 2r91 s PHE 122 CO 0.00 -4.11 1.37 -1.35 -0.10 0.00 0.00 175.22 171.03 2r91 h PRO 123 N 9.64 0.20 -2.63 0.24 0.11 -1.96 -3.39 132.00 134.21 2r91 h PRO 123 Ca -0.41 -0.22 -0.79 0.00 0.11 0.00 0.00 66.00 64.69 2r91 h PRO 123 Cb 1.19 0.06 -0.29 0.00 0.11 0.00 0.00 31.00 32.07 2r91 h PRO 123 CO 0.95 0.96 0.75 0.54 -0.21 0.00 0.00 178.00 180.98 2r91 n ARG 124 N -3.65 4.66 -4.49 1.05 5.12 -1.26 -4.96 116.66 113.12 2r91 n ARG 124 Ca -0.04 -4.61 -0.31 0.00 -1.93 0.00 0.00 57.85 50.96 2r91 n ARG 124 Cb 0.81 -2.47 -0.11 0.00 -1.16 0.00 0.00 32.46 29.52 2r91 n ARG 124 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2r91 s LEU 125 N -3.33 2.85 0.34 0.55 1.43 -1.26 -5.13 118.68 114.12 2r91 s LEU 125 Ca 0.35 -0.35 -0.02 0.00 -1.03 0.00 0.00 54.13 53.08 2r91 s LEU 125 Cb 0.11 -1.66 -0.04 0.00 0.03 0.00 0.00 46.19 44.63 2r91 s LEU 125 CO 0.01 0.24 0.57 -0.94 0.23 0.00 0.00 176.35 176.46 2r91 s SER 126 N -1.64 6.34 0.35 2.29 1.04 -1.26 -4.99 113.70 115.83 2r91 s SER 126 Ca 0.17 0.57 0.07 0.00 0.48 0.00 0.00 55.95 57.24 2r91 s SER 126 Cb -0.11 -2.09 0.76 0.00 0.10 0.00 0.00 66.02 64.69 2r91 s SER 126 CO 0.08 -0.29 1.90 -0.33 0.98 0.00 0.00 173.24 175.58 2r91 h GLU 127 N 1.01 0.73 -0.76 4.02 5.08 -2.00 -1.91 114.58 120.74 2r91 h GLU 127 Ca -0.49 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 57.78 2r91 h GLU 127 Cb 1.21 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 30.26 2r91 h GLU 127 CO 0.63 0.48 0.27 -0.09 -1.00 0.00 0.00 179.01 179.31 2r91 h ARG 128 N 0.75 1.15 -0.46 2.33 2.43 -1.99 -0.31 114.38 118.27 2r91 h ARG 128 Ca 0.41 -0.23 -0.08 0.00 -0.81 0.00 0.00 59.98 59.27 2r91 h ARG 128 Cb 0.54 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.90 2r91 h ARG 128 CO -0.17 0.96 -0.03 1.96 -1.51 0.00 0.00 179.97 181.18 2r91 h GLN 129 N 1.11 0.84 -0.36 0.20 4.20 -1.75 -1.15 115.11 118.19 2r91 h GLN 129 Ca 0.25 -0.28 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 2r91 h GLN 129 Cb 0.26 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.95 2r91 h GLN 129 CO -0.01 0.90 0.13 0.82 -0.67 0.00 0.00 178.83 180.00 2r91 h ILE 130 N 0.68 1.19 -0.33 2.54 2.04 -1.22 -2.07 117.51 120.35 2r91 h ILE 130 Ca 0.13 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.37 2r91 h ILE 130 Cb 0.54 0.93 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 2r91 h ILE 130 CO 0.03 0.21 0.17 0.00 0.00 0.00 0.00 178.15 178.57 2r91 h ALA 131 N 0.98 0.42 -0.88 1.87 0.00 -1.01 -2.42 119.26 118.22 2r91 h ALA 131 Ca 0.12 -0.08 0.10 0.00 0.00 0.00 0.00 54.91 55.04 2r91 h ALA 131 Cb 0.21 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.79 2r91 h ALA 131 CO -0.01 -0.04 0.52 -0.22 0.00 0.00 0.00 179.25 179.51 2r91 h LYS 132 N 0.40 0.85 -0.30 0.00 3.64 -1.16 0.23 116.57 120.23 2r91 h LYS 132 Ca 0.11 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.44 2r91 h LYS 132 Cb 0.08 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 2r91 h LYS 132 CO -0.02 0.56 0.17 -0.92 -2.27 0.00 0.00 179.45 176.97 2r91 h TYR 133 N 0.87 0.41 -0.22 1.91 3.20 -0.99 -0.83 116.97 121.33 2r91 h TYR 133 Ca 0.42 -0.01 -0.16 0.00 3.14 0.00 0.00 58.73 62.13 2r91 h TYR 133 Cb 0.37 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 2r91 h TYR 133 CO -0.04 0.32 -0.51 0.74 -1.64 0.00 0.00 178.16 177.03 2r91 h PHE 134 N 0.37 0.76 -0.48 -3.82 0.04 -0.98 -2.62 116.94 110.21 2r91 h PHE 134 Ca 0.11 -0.26 -0.13 0.00 2.80 0.00 0.00 57.97 60.49 2r91 h PHE 134 Cb 0.05 -0.15 -0.01 0.00 2.20 0.00 0.00 35.95 38.03 2r91 h PHE 134 CO -0.03 1.00 -0.20 0.00 -0.60 0.00 0.00 178.31 178.48 2r91 h ARG 135 N 0.48 0.96 -0.26 1.51 3.08 -0.84 -1.09 114.38 118.22 2r91 h ARG 135 Ca 0.02 -0.40 -0.03 0.00 0.07 0.00 0.00 59.98 59.64 2r91 h ARG 135 Cb 1.06 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.06 2r91 h ARG 135 CO 0.10 1.07 0.02 -0.44 -1.07 0.00 0.00 179.97 179.64 2r91 h ASP 136 N 0.84 0.34 -0.26 7.04 5.19 -1.15 -0.62 116.42 127.80 2r91 h ASP 136 Ca 0.11 -0.05 -0.05 0.00 -0.62 0.00 0.00 57.03 56.42 2r91 h ASP 136 Cb 0.77 -0.09 -0.01 0.00 0.18 0.00 0.00 39.33 40.18 2r91 h ASP 136 CO 0.06 0.39 -0.05 0.25 -3.12 0.00 0.00 179.24 176.77 2r91 h LEU 137 N 0.37 0.49 -0.76 1.55 5.85 -1.03 -2.81 115.31 118.96 2r91 h LEU 137 Ca 0.09 -0.36 -0.02 0.00 0.84 0.00 0.00 57.88 58.42 2r91 h LEU 137 Cb 0.22 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.08 2r91 h LEU 137 CO 0.00 0.73 0.39 0.00 -0.34 0.00 0.00 178.44 179.23 2r91 h SER 139 N 1.07 0.00 1.67 0.00 0.02 -1.11 -3.19 113.55 112.00 2r91 h SER 139 Ca 0.26 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 61.16 2r91 h SER 139 Cb 0.08 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 2r91 h SER 139 CO -0.04 0.10 -0.26 0.00 -1.14 0.00 0.00 176.83 175.49 2r91 h ALA 140 N 1.90 0.84 -2.26 3.77 0.00 -1.15 -3.46 119.26 118.89 2r91 h ALA 140 Ca -0.00 -0.24 -0.31 0.00 0.00 0.00 0.00 54.91 54.35 2r91 h ALA 140 Cb 0.25 -0.04 -0.15 0.00 0.00 0.00 0.00 17.79 17.85 2r91 h ALA 140 CO 0.01 0.33 -0.66 0.14 0.00 0.00 0.00 179.25 179.07 2r91 s VAL 141 N -3.12 0.79 -0.04 0.00 -7.23 -1.21 -4.71 120.40 104.89 2r91 s VAL 141 Ca 0.05 -2.00 0.17 0.00 -1.81 0.00 0.00 61.98 58.40 2r91 s VAL 141 Cb 0.07 -2.18 -0.27 0.00 0.56 0.00 0.00 36.38 34.56 2r91 s VAL 141 CO 0.70 -0.43 0.39 -1.20 -0.31 0.00 0.00 175.10 174.25 2r91 n SER 142 N -0.29 1.04 -4.76 4.85 7.64 -1.26 -4.88 113.62 115.96 2r91 n SER 142 Ca -0.06 -0.01 -0.31 0.00 1.01 0.00 0.00 58.87 59.50 2r91 n SER 142 Cb 0.63 1.78 0.10 0.00 -1.01 0.00 0.00 64.21 65.71 2r91 n SER 142 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2r91 s ILE 143 N -3.19 3.18 0.46 0.44 -4.36 -1.26 -4.97 121.20 111.49 2r91 s ILE 143 Ca -0.06 0.38 -0.25 0.00 -0.26 0.00 0.00 60.65 60.46 2r91 s ILE 143 Cb 0.11 -2.85 -0.08 0.00 1.25 0.00 0.00 42.46 40.89 2r91 s ILE 143 CO 0.72 -0.50 1.43 -2.65 0.24 0.00 0.00 174.94 174.18 2r91 n PRO 144 N -3.61 2.20 -4.22 0.37 -0.02 -1.26 -4.85 135.00 123.61 2r91 n PRO 144 Ca 0.09 0.79 -0.34 0.00 -2.02 0.00 0.00 63.50 62.01 2r91 n PRO 144 Cb 0.53 -2.64 -0.14 0.00 -0.02 0.00 0.00 33.50 31.24 2r91 n PRO 144 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2r91 s VAL 145 N -1.20 3.41 -0.02 -1.45 1.01 -1.26 -1.97 120.40 118.92 2r91 s VAL 145 Ca 0.62 -0.50 -0.12 0.00 0.00 0.00 0.00 61.98 61.98 2r91 s VAL 145 Cb -0.44 -2.51 -0.05 0.00 0.00 0.00 0.00 36.38 33.37 2r91 s VAL 145 CO 0.56 0.46 0.34 -0.36 0.00 0.00 0.00 175.10 176.10 2r91 s PHE 146 N 0.97 3.68 -0.01 5.22 0.40 0.85 -1.93 117.98 127.16 2r91 s PHE 146 Ca -0.00 0.85 -0.30 0.00 -0.60 0.00 0.00 56.93 56.87 2r91 s PHE 146 Cb -0.15 -2.18 -0.04 0.00 0.51 0.00 0.00 43.02 41.16 2r91 s PHE 146 CO 0.00 0.66 1.17 -1.17 0.70 0.00 0.00 175.22 176.58 2r91 s LEU 147 N -1.17 4.32 -0.44 -0.37 2.96 -0.13 -1.48 118.68 122.36 2r91 s LEU 147 Ca 0.23 1.86 -0.07 0.00 -0.22 0.00 0.00 54.13 55.93 2r91 s LEU 147 Cb -0.15 -3.57 0.11 0.00 0.50 0.00 0.00 46.19 43.08 2r91 s LEU 147 CO 0.12 -0.51 0.28 -0.47 -1.32 0.00 0.00 176.35 174.45 2r91 s TYR 148 N 1.69 3.47 -0.19 5.38 5.04 -0.46 -0.49 117.35 131.80 2r91 s TYR 148 Ca 0.56 -2.02 -0.09 0.00 -2.44 0.00 0.00 57.07 53.08 2r91 s TYR 148 Cb -0.26 -3.31 -0.05 0.00 0.35 0.00 0.00 41.96 38.70 2r91 s TYR 148 CO 0.25 -0.97 0.13 1.21 -1.34 0.00 0.00 175.55 174.83 2r91 s ASN 149 N 2.28 6.22 -0.49 4.32 3.04 0.64 -3.64 114.94 127.31 2r91 s ASN 149 Ca 0.06 0.26 0.06 0.00 0.04 0.00 0.00 52.86 53.29 2r91 s ASN 149 Cb -0.24 -2.08 0.21 0.00 -1.54 0.00 0.00 41.25 37.60 2r91 s ASN 149 CO -0.02 0.22 0.74 0.00 -3.04 0.00 0.00 177.10 175.01 2r91 n TYR 150 N 3.27 -3.18 -0.05 0.43 -0.00 -1.26 -0.79 117.16 115.57 2r91 n TYR 150 Ca -0.17 -1.82 0.03 0.00 -0.00 0.00 0.00 57.90 55.94 2r91 n TYR 150 Cb 0.52 1.29 0.37 0.00 -0.00 0.00 0.00 39.34 41.53 2r91 n TYR 150 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.86 175.51 2r91 h PRO 151 N 4.60 0.65 -0.46 2.98 0.11 -1.75 0.75 132.00 138.88 2r91 h PRO 151 Ca -0.00 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.04 2r91 h PRO 151 Cb 1.05 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.99 2r91 h PRO 151 CO 0.19 0.45 0.18 0.00 -0.21 0.00 0.00 178.00 178.61 2r91 h ALA 152 N 1.67 1.46 0.08 -0.75 0.00 -1.88 -0.28 119.26 119.56 2r91 h ALA 152 Ca 0.18 -0.13 -0.34 0.00 0.00 0.00 0.00 54.91 54.62 2r91 h ALA 152 Cb -0.04 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 2r91 h ALA 152 CO -0.04 0.41 -1.85 0.00 0.00 0.00 0.00 179.25 177.78 2r91 n ALA 153 N -2.47 0.90 0.07 0.00 0.00 -0.83 -4.41 120.51 113.77 2r91 n ALA 153 Ca 0.03 -0.61 -0.05 0.00 0.00 0.00 0.00 53.44 52.82 2r91 n ALA 153 Cb 0.15 -0.59 0.15 0.00 0.00 0.00 0.00 19.45 19.15 2r91 n ALA 153 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2r91 h VAL 154 N -0.24 1.35 0.00 0.00 2.07 -0.87 -3.44 116.25 115.11 2r91 h VAL 154 Ca -0.42 -1.78 0.00 0.00 0.82 0.00 0.00 66.70 65.32 2r91 h VAL 154 Cb 1.83 1.84 0.00 0.00 -1.52 0.00 0.00 31.29 33.44 2r91 h VAL 154 CO -0.01 0.53 0.00 0.61 0.02 0.00 0.00 177.57 178.72 2r91 n GLY 155 N 0.09 0.80 3.27 2.17 0.00 -0.12 -3.52 105.19 107.88 2r91 n GLY 155 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 2r91 n GLY 155 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2r91 s ARG 156 N -0.37 0.97 -0.09 1.61 3.52 -1.25 -5.03 118.95 118.31 2r91 s ARG 156 Ca 0.00 -0.80 0.02 0.00 -0.13 0.00 0.00 55.73 54.82 2r91 s ARG 156 Cb 0.00 0.42 -0.02 0.00 -1.56 0.00 0.00 34.95 33.79 2r91 s ARG 156 CO 0.00 -0.35 -0.15 0.34 -0.81 0.00 0.00 175.30 174.33 2r91 s ASP 157 N -2.80 3.89 -0.66 -2.12 2.15 -1.26 -4.16 116.67 111.70 2r91 s ASP 157 Ca 0.03 -0.30 -0.10 0.00 0.43 0.00 0.00 52.55 52.62 2r91 s ASP 157 Cb 0.03 -1.22 0.17 0.00 -0.30 0.00 0.00 42.92 41.60 2r91 s ASP 157 CO -0.11 0.25 0.55 -0.69 -0.17 0.00 0.00 175.17 174.99 2r91 s VAL 158 N -0.14 4.67 1.03 1.11 1.01 -1.26 -5.09 120.40 121.74 2r91 s VAL 158 Ca -0.02 -2.39 -0.17 0.00 0.00 0.00 0.00 61.98 59.40 2r91 s VAL 158 Cb -0.14 -3.98 0.24 0.00 0.00 0.00 0.00 36.38 32.51 2r91 s VAL 158 CO 0.04 -0.91 1.25 -0.90 0.00 0.00 0.00 175.10 174.58 2r91 n ASP 159 N 4.13 -0.44 -0.26 3.32 5.68 -1.26 -4.63 116.55 123.10 2r91 n ASP 159 Ca 0.05 -1.40 -0.05 0.00 -0.50 0.00 0.00 54.79 52.89 2r91 n ASP 159 Cb 0.42 -1.00 0.05 0.00 -1.14 0.00 0.00 41.12 39.45 2r91 n ASP 159 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2r91 h ALA 160 N -2.03 0.90 -0.60 2.12 0.00 -1.87 0.12 119.26 117.90 2r91 h ALA 160 Ca -0.42 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.32 2r91 h ALA 160 Cb 1.19 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 2r91 h ALA 160 CO 0.29 0.39 0.09 -0.09 0.00 0.00 0.00 179.25 179.92 2r91 h ARG 161 N 0.97 1.01 -0.43 0.00 2.43 -1.92 -1.36 114.38 115.07 2r91 h ARG 161 Ca 0.25 -0.28 -0.11 0.00 -0.81 0.00 0.00 59.98 59.04 2r91 h ARG 161 Cb -0.01 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.41 2r91 h ARG 161 CO -0.05 0.95 -0.17 0.00 -1.51 0.00 0.00 179.97 179.20 2r91 h ALA 162 N 1.01 0.89 -0.60 2.80 0.00 -1.78 -2.02 119.26 119.56 2r91 h ALA 162 Ca 0.18 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 2r91 h ALA 162 Cb 0.44 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2r91 h ALA 162 CO 0.01 0.63 0.04 0.00 0.00 0.00 0.00 179.25 179.93 2r91 h ALA 163 N 1.07 0.81 -0.39 0.00 0.00 -0.41 -2.00 119.26 118.34 2r91 h ALA 163 Ca 0.11 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2r91 h ALA 163 Cb 0.68 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2r91 h ALA 163 CO 0.05 0.62 0.21 -0.22 0.00 0.00 0.00 179.25 179.91 2r91 h LYS 164 N 0.94 0.55 -0.07 0.00 3.64 -1.13 -2.91 116.57 117.59 2r91 h LYS 164 Ca 0.17 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.50 2r91 h LYS 164 Cb 0.51 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 32.22 2r91 h LYS 164 CO 0.02 0.46 0.05 1.49 -2.27 0.00 0.00 179.45 179.20 2r91 h GLU 165 N 0.50 0.03 -0.68 1.90 4.57 -1.09 -0.32 114.58 119.49 2r91 h GLU 165 Ca 0.14 -0.00 0.03 0.00 -1.18 0.00 0.00 59.36 58.35 2r91 h GLU 165 Cb 0.07 -0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.61 2r91 h GLU 165 CO -0.02 0.02 0.45 -0.07 -1.18 0.00 0.00 179.01 178.21 2r91 h LEU 166 N 0.03 0.70 0.07 1.64 3.38 -1.16 -3.47 115.31 116.50 2r91 h LEU 166 Ca 0.03 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2r91 h LEU 166 Cb 0.09 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 2r91 h LEU 166 CO -0.00 0.49 -0.03 0.61 0.09 0.00 0.00 178.44 179.60 2r91 n GLY 167 N -1.44 0.51 0.00 0.83 0.00 -0.13 -4.82 105.19 100.14 2r91 n GLY 167 Ca 0.08 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.39 2r91 n GLY 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r91 s ILE 169 N 0.00 4.46 -1.27 0.00 -1.09 -1.26 -4.63 121.20 117.41 2r91 s ILE 169 Ca 0.00 1.76 0.10 0.00 -2.23 0.00 0.00 60.65 60.29 2r91 s ILE 169 Cb 0.00 -4.13 0.08 0.00 -1.58 0.00 0.00 42.46 36.83 2r91 s ILE 169 CO 0.00 0.00 0.82 0.54 -1.23 0.00 0.00 174.94 175.08 2r91 n ARG 170 N 5.09 0.41 -3.49 2.79 1.74 -0.81 -4.86 116.66 117.53 2r91 n ARG 170 Ca 0.10 -1.10 -0.15 0.00 -0.77 0.00 0.00 57.85 55.93 2r91 n ARG 170 Cb 0.47 -1.19 -0.04 0.00 -1.02 0.00 0.00 32.46 30.67 2r91 n ARG 170 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2r91 s GLY 171 N -0.85 -0.55 -0.01 -0.13 0.00 -1.24 -2.61 107.32 101.93 2r91 s GLY 171 Ca 0.12 1.10 0.02 0.00 0.00 0.00 0.00 44.72 45.95 2r91 s GLY 171 CO 0.13 0.66 -0.05 0.14 0.00 0.00 0.00 173.10 173.98 2r91 s VAL 172 N -2.15 0.45 -0.23 1.40 1.01 -0.14 -0.96 120.40 119.79 2r91 s VAL 172 Ca -0.05 -0.20 0.02 0.00 0.00 0.00 0.00 61.98 61.75 2r91 s VAL 172 Cb -0.00 -0.42 0.04 0.00 0.00 0.00 0.00 36.38 36.00 2r91 s VAL 172 CO 0.00 0.15 -0.14 -0.75 0.00 0.00 0.00 175.10 174.37 2r91 s LYS 173 N 0.17 2.46 -0.40 2.72 2.47 0.36 -0.78 119.74 126.74 2r91 s LYS 173 Ca -0.02 -1.11 -0.05 0.00 -1.56 0.00 0.00 55.97 53.23 2r91 s LYS 173 Cb -0.06 -2.73 0.09 0.00 -1.46 0.00 0.00 37.83 33.68 2r91 s LYS 173 CO -0.00 -0.43 0.19 0.34 0.16 0.00 0.00 175.35 175.61 2r91 s ASP 174 N 1.20 5.34 -0.67 1.43 2.15 -0.21 -0.26 116.67 125.65 2r91 s ASP 174 Ca -0.03 -1.73 -0.22 0.00 0.43 0.00 0.00 52.55 50.99 2r91 s ASP 174 Cb -0.17 -1.87 0.07 0.00 -0.30 0.00 0.00 42.92 40.65 2r91 s ASP 174 CO -0.08 -0.50 0.97 -0.89 -0.17 0.00 0.00 175.17 174.50 2r91 s THR 175 N 1.26 4.35 -0.28 1.71 2.01 0.03 -0.18 115.64 124.53 2r91 s THR 175 Ca 0.04 -0.43 -0.19 0.00 0.31 0.00 0.00 61.69 61.43 2r91 s THR 175 Cb -0.23 -4.69 0.12 0.00 0.01 0.00 0.00 72.50 67.71 2r91 s THR 175 CO -0.02 -1.46 0.89 0.21 -0.69 0.00 0.00 174.62 173.55 2r91 s ASN 176 N 3.69 -0.64 0.22 3.53 3.84 -1.26 -4.30 114.94 120.01 2r91 s ASN 176 Ca 0.22 1.08 0.25 0.00 0.21 0.00 0.00 52.86 54.62 2r91 s ASN 176 Cb -0.16 1.21 0.87 0.00 -0.55 0.00 0.00 41.25 42.61 2r91 s ASN 176 CO 0.09 -0.17 1.76 -0.62 -2.79 0.00 0.00 177.10 175.37 2r91 n GLU 177 N 3.46 0.24 -2.88 0.43 -0.58 -1.26 -4.50 120.64 115.55 2r91 n GLU 177 Ca -0.17 0.27 -0.43 0.00 -0.42 0.00 0.00 57.16 56.40 2r91 n GLU 177 Cb 0.57 -1.81 -0.04 0.00 -0.57 0.00 0.00 31.44 29.59 2r91 n GLU 177 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2r91 s SER 178 N -4.41 6.19 0.39 1.62 0.15 -1.26 -4.88 113.70 111.50 2r91 s SER 178 Ca 0.09 -0.94 0.07 0.00 0.70 0.00 0.00 55.95 55.87 2r91 s SER 178 Cb 0.12 -2.41 0.78 0.00 -1.71 0.00 0.00 66.02 62.80 2r91 s SER 178 CO 0.54 -1.39 1.97 0.25 1.20 0.00 0.00 173.24 175.81 2r91 h LEU 179 N 11.21 0.39 -0.85 3.45 5.85 -2.00 -2.02 115.31 131.34 2r91 h LEU 179 Ca -0.29 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.38 2r91 h LEU 179 Cb 1.07 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.96 2r91 h LEU 179 CO 1.16 0.40 0.51 0.00 -0.34 0.00 0.00 178.44 180.18 2r91 h ALA 180 N 1.66 1.08 -0.57 1.25 0.00 -1.98 0.13 119.26 120.83 2r91 h ALA 180 Ca 0.10 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2r91 h ALA 180 Cb 0.17 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 2r91 h ALA 180 CO -0.00 0.54 0.37 1.25 0.00 0.00 0.00 179.25 181.41 2r91 h HIS 181 N 1.16 0.70 -0.28 0.00 -0.00 -1.78 -1.31 115.15 113.64 2r91 h HIS 181 Ca 0.30 0.02 -0.12 0.00 -0.00 0.00 0.00 60.37 60.58 2r91 h HIS 181 Cb -0.05 -0.23 -0.00 0.00 -0.00 0.00 0.00 27.41 27.13 2r91 h HIS 181 CO -0.00 0.43 -0.28 1.15 -0.00 0.00 0.00 177.93 179.23 2r91 h THR 182 N 0.75 1.30 -0.64 6.26 2.02 -1.15 -2.94 112.91 118.51 2r91 h THR 182 Ca 0.21 -1.44 0.04 0.00 0.77 0.00 0.00 66.41 65.99 2r91 h THR 182 Cb -0.06 1.60 -0.04 0.00 -1.74 0.00 0.00 68.15 67.92 2r91 h THR 182 CO -0.06 0.46 0.42 -0.07 0.37 0.00 0.00 175.52 176.64 2r91 h LEU 183 N 0.41 0.64 -2.01 2.58 3.38 -0.54 -1.99 115.31 117.78 2r91 h LEU 183 Ca 0.04 -0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.10 2r91 h LEU 183 Cb 0.84 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 2r91 h LEU 183 CO 0.07 0.44 0.24 0.00 0.09 0.00 0.00 178.44 179.27 2r91 h ALA 184 N 1.63 2.30 -0.29 1.53 0.00 -1.05 0.66 119.26 124.04 2r91 h ALA 184 Ca 0.26 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.10 2r91 h ALA 184 Cb 0.11 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 2r91 h ALA 184 CO -0.07 -0.41 -0.08 1.88 0.00 0.00 0.00 179.25 180.57 2r91 h TYR 185 N 0.00 0.50 0.00 0.00 0.05 -1.42 -0.48 116.97 115.62 2r91 h TYR 185 Ca 0.16 -0.06 -0.12 0.00 0.05 0.00 0.00 58.73 58.75 2r91 h TYR 185 Cb 0.63 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 38.22 2r91 h TYR 185 CO 0.00 0.55 -0.59 0.87 -1.05 0.00 0.00 178.16 177.94 2r91 h LYS 186 N 0.45 0.00 -0.06 4.88 1.57 -0.96 0.23 116.57 122.68 2r91 h LYS 186 Ca 0.09 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.85 2r91 h LYS 186 Cb 0.42 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.72 2r91 h LYS 186 CO 0.02 0.59 -0.03 -0.09 -0.57 0.00 0.00 179.45 179.38 2r91 h ARG 187 N 0.00 0.12 0.00 3.15 2.43 -1.04 -3.01 114.38 116.03 2r91 h ARG 187 Ca -0.01 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 59.02 2r91 h ARG 187 Cb 1.05 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.59 2r91 h ARG 187 CO 0.08 0.49 -0.49 1.88 -1.51 0.00 0.00 179.97 180.42 2r91 h TYR 188 N -0.25 0.00 -2.11 2.20 -1.99 -1.08 -3.38 116.97 110.35 2r91 h TYR 188 Ca 0.01 0.00 -0.58 0.00 2.00 0.00 0.00 58.73 60.17 2r91 h TYR 188 Cb 0.46 0.00 -0.40 0.00 2.00 0.00 0.00 36.73 38.78 2r91 h TYR 188 CO 0.07 0.44 -0.89 1.28 -0.00 0.00 0.00 178.16 179.06 2r91 n LEU 189 N -3.19 1.66 0.06 3.88 4.77 0.81 -4.89 117.00 120.10 2r91 n LEU 189 Ca 0.02 -5.00 0.19 0.00 -0.03 0.00 0.00 56.01 51.19 2r91 n LEU 189 Cb 0.72 0.08 0.72 0.00 -2.33 0.00 0.00 43.42 42.60 2r91 n LEU 189 CO 0.40 2.05 1.17 -0.65 -1.33 0.00 0.00 177.39 179.03 2r91 h PRO 190 N 4.15 0.00 -0.01 3.23 0.11 -1.72 -1.70 132.00 136.05 2r91 h PRO 190 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 2r91 h PRO 190 Cb 0.79 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.90 2r91 h PRO 190 CO 0.61 0.00 -0.37 1.04 -0.21 0.00 0.00 178.00 179.07 2r91 n GLN 191 N -4.21 1.15 -2.57 1.05 1.13 -1.26 -4.94 117.38 107.72 2r91 n GLN 191 Ca 0.07 -0.87 -0.35 0.00 -1.94 0.00 0.00 57.00 53.91 2r91 n GLN 191 Cb 0.53 -1.48 -0.04 0.00 0.11 0.00 0.00 30.24 29.36 2r91 n GLN 191 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2r91 s ALA 192 N -2.45 3.01 -0.29 -1.58 0.00 -0.64 -4.98 121.76 114.83 2r91 s ALA 192 Ca 0.21 0.64 -0.27 0.00 0.00 0.00 0.00 51.96 52.54 2r91 s ALA 192 Cb 0.19 -3.25 0.01 0.00 0.00 0.00 0.00 23.12 20.06 2r91 s ALA 192 CO 0.54 -0.21 0.98 1.03 0.00 0.00 0.00 175.76 178.09 2r91 s ARG 193 N -2.81 4.10 -0.14 0.00 0.52 -1.07 -4.94 118.95 114.61 2r91 s ARG 193 Ca 0.61 1.01 -0.00 0.00 -0.52 0.00 0.00 55.73 56.83 2r91 s ARG 193 Cb -0.19 -3.70 -0.01 0.00 0.52 0.00 0.00 34.95 31.56 2r91 s ARG 193 CO 0.23 -0.75 -0.13 0.08 0.02 0.00 0.00 175.30 174.75 2r91 s VAL 194 N 3.32 3.05 0.00 3.52 1.01 -1.26 -0.96 120.40 129.08 2r91 s VAL 194 Ca 0.41 -0.66 0.06 0.00 0.00 0.00 0.00 61.98 61.79 2r91 s VAL 194 Cb -0.14 -2.29 -0.02 0.00 0.00 0.00 0.00 36.38 33.94 2r91 s VAL 194 CO 0.12 0.52 -0.18 -0.31 0.00 0.00 0.00 175.10 175.24 2r91 s TYR 195 N 0.43 1.63 -0.09 5.22 2.02 0.04 -1.16 117.35 125.45 2r91 s TYR 195 Ca -0.10 -0.33 -0.08 0.00 -0.37 0.00 0.00 57.07 56.19 2r91 s TYR 195 Cb -0.16 -1.03 -0.04 0.00 -0.40 0.00 0.00 41.96 40.33 2r91 s TYR 195 CO 0.05 0.01 0.19 1.21 -1.57 0.00 0.00 175.55 175.44 2r91 s ASN 196 N -0.67 6.47 -0.04 2.29 3.84 -1.16 -1.05 114.94 124.62 2r91 s ASN 196 Ca 0.07 0.56 0.17 0.00 0.21 0.00 0.00 52.86 53.86 2r91 s ASN 196 Cb -0.07 -2.10 0.54 0.00 -0.55 0.00 0.00 41.25 39.06 2r91 s ASN 196 CO 0.00 0.39 1.45 0.61 -2.79 0.00 0.00 177.10 176.76 2r91 n GLY 197 N 1.91 2.77 3.72 1.21 0.00 0.74 -1.38 105.19 114.17 2r91 n GLY 197 Ca -0.19 -0.68 -0.37 0.00 0.00 0.00 0.00 46.02 44.78 2r91 n GLY 197 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2r91 s SER 198 N -1.05 6.62 0.48 1.61 0.15 -1.26 -4.50 113.70 115.75 2r91 s SER 198 Ca 0.40 0.74 0.17 0.00 0.70 0.00 0.00 55.95 57.96 2r91 s SER 198 Cb 0.23 -2.26 1.14 0.00 -1.71 0.00 0.00 66.02 63.42 2r91 s SER 198 CO 0.23 0.03 2.04 0.44 1.20 0.00 0.00 173.24 177.19 2r91 h ASP 199 N 6.70 0.00 0.69 5.45 3.32 -1.92 -1.91 116.42 128.74 2r91 h ASP 199 Ca -0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.64 2r91 h ASP 199 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2r91 h ASP 199 CO 0.76 0.13 0.00 -1.54 -1.72 0.00 0.00 179.24 176.87 2r91 n SER 200 N -4.28 0.12 -0.48 6.45 3.41 -1.26 -3.32 113.62 114.26 2r91 n SER 200 Ca -0.03 0.52 0.08 0.00 -0.26 0.00 0.00 58.87 59.19 2r91 n SER 200 Cb 0.20 -0.55 0.19 0.00 -0.26 0.00 0.00 64.21 63.80 2r91 n SER 200 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2r91 n LEU 201 N -1.63 3.07 0.19 1.04 4.77 -0.72 -4.75 117.00 118.98 2r91 n LEU 201 Ca 0.04 -3.14 -0.14 0.00 -0.03 0.00 0.00 56.01 52.74 2r91 n LEU 201 Cb 0.23 -0.49 -0.08 0.00 -2.33 0.00 0.00 43.42 40.74 2r91 n LEU 201 CO 0.18 0.76 0.62 0.58 -1.33 0.00 0.00 177.39 178.20 2r91 h VAL 202 N 0.81 0.65 -0.19 4.08 2.07 -1.62 0.74 116.25 122.78 2r91 h VAL 202 Ca 0.01 -0.37 0.05 0.00 0.82 0.00 0.00 66.70 67.22 2r91 h VAL 202 Cb 1.21 0.83 -0.06 0.00 -1.52 0.00 0.00 31.29 31.76 2r91 h VAL 202 CO 0.11 0.07 -0.23 0.15 0.02 0.00 0.00 177.57 177.70 2r91 h PHE 203 N -0.69 -0.60 -0.80 1.57 3.57 -1.87 -2.49 116.94 115.63 2r91 h PHE 203 Ca -0.05 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.53 2r91 h PHE 203 Cb 0.49 0.29 -0.05 0.00 2.79 0.00 0.00 35.95 39.46 2r91 h PHE 203 CO -0.00 -0.30 0.50 0.00 -2.23 0.00 0.00 178.31 176.27 2r91 h ALA 204 N 0.77 1.08 -0.59 2.41 0.00 -1.85 -1.33 119.26 119.76 2r91 h ALA 204 Ca 0.12 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.03 2r91 h ALA 204 Cb 0.44 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2r91 h ALA 204 CO -0.34 0.26 0.37 0.77 0.00 0.00 0.00 179.25 180.31 2r91 h SER 205 N 0.94 0.62 -0.20 0.00 0.02 -0.57 -1.17 113.55 113.20 2r91 h SER 205 Ca 0.34 -0.01 -0.14 0.00 -0.84 0.00 0.00 61.79 61.14 2r91 h SER 205 Cb 0.10 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 2r91 h SER 205 CO -0.15 0.44 -0.38 -0.26 -1.14 0.00 0.00 176.83 175.34 2r91 h PHE 206 N 0.74 0.87 -0.80 3.45 0.04 -1.20 -1.40 116.94 118.64 2r91 h PHE 206 Ca 0.23 -0.25 -0.03 0.00 2.80 0.00 0.00 57.97 60.72 2r91 h PHE 206 Cb -0.03 -0.19 -0.04 0.00 2.20 0.00 0.00 35.95 37.90 2r91 h PHE 206 CO -0.05 1.00 0.39 0.00 -0.60 0.00 0.00 178.31 179.06 2r91 h ALA 207 N 0.97 1.03 -0.13 2.45 0.00 -0.96 -2.23 119.26 120.38 2r91 h ALA 207 Ca 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2r91 h ALA 207 Cb 0.92 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2r91 h ALA 207 CO 0.08 0.58 0.00 1.33 0.00 0.00 0.00 179.25 181.25 2r91 n VAL 208 N -4.37 0.17 -3.65 0.00 0.24 -0.47 -4.96 118.33 105.30 2r91 n VAL 208 Ca 0.07 -0.29 -0.21 0.00 -2.04 0.00 0.00 64.34 61.87 2r91 n VAL 208 Cb 0.13 0.28 0.05 0.00 -1.47 0.00 0.00 33.84 32.82 2r91 n VAL 208 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2r91 n ARG 209 N 0.15 -5.52 -0.42 7.34 1.74 -0.84 -5.02 116.66 114.09 2r91 n ARG 209 Ca 0.16 0.68 -0.28 0.00 -0.77 0.00 0.00 57.85 57.64 2r91 n ARG 209 Cb 0.29 -5.40 0.27 0.00 -1.02 0.00 0.00 32.46 26.60 2r91 n ARG 209 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2r91 n LEU 210 N -4.30 -1.74 0.19 0.55 4.77 -0.58 -4.91 117.00 110.97 2r91 n LEU 210 Ca -0.26 -0.32 0.14 0.00 -0.03 0.00 0.00 56.01 55.55 2r91 n LEU 210 Cb 0.66 -1.21 0.53 0.00 -2.33 0.00 0.00 43.42 41.07 2r91 n LEU 210 CO 0.67 -3.58 0.91 0.44 -1.33 0.00 0.00 177.39 174.49 2r91 h ASP 211 N -2.91 0.00 0.00 -1.43 3.32 -1.46 -3.47 116.42 110.47 2r91 h ASP 211 Ca -0.61 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.44 2r91 h ASP 211 Cb 1.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.89 2r91 h ASP 211 CO 0.47 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.60 2r91 n GLY 212 N 0.26 -1.26 3.24 2.75 0.00 -1.23 -1.41 105.19 107.54 2r91 n GLY 212 Ca 0.02 -1.13 -0.25 0.00 0.00 0.00 0.00 46.02 44.66 2r91 n GLY 212 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2r91 s VAL 213 N -3.00 1.62 -0.61 1.61 -7.23 -0.38 -2.97 120.40 109.44 2r91 s VAL 213 Ca 0.00 -1.19 0.06 0.00 -1.81 0.00 0.00 61.98 59.05 2r91 s VAL 213 Cb 0.00 -1.41 0.25 0.00 0.56 0.00 0.00 36.38 35.78 2r91 s VAL 213 CO 0.00 0.19 0.72 0.52 -0.31 0.00 0.00 175.10 176.21 2r91 n VAL 214 N 1.84 1.94 -3.79 1.32 0.31 -0.48 -0.79 118.33 118.68 2r91 n VAL 214 Ca -0.17 -5.06 -0.36 0.00 -0.01 0.00 0.00 64.34 58.74 2r91 n VAL 214 Cb 0.53 -2.08 -0.07 0.00 -0.91 0.00 0.00 33.84 31.32 2r91 n VAL 214 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2r91 s ALA 215 N -2.30 3.80 0.35 3.52 0.00 -1.21 -4.40 121.76 121.52 2r91 s ALA 215 Ca 0.39 -0.62 0.13 0.00 0.00 0.00 0.00 51.96 51.87 2r91 s ALA 215 Cb 0.15 -2.08 0.99 0.00 0.00 0.00 0.00 23.12 22.18 2r91 s ALA 215 CO -0.03 0.44 1.74 0.66 0.00 0.00 0.00 175.76 178.58 2r91 h SER 216 N 5.57 0.58 0.11 0.00 4.64 -1.88 -1.49 113.55 121.08 2r91 h SER 216 Ca -0.50 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 2r91 h SER 216 Cb 1.20 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2r91 h SER 216 CO 0.65 0.09 0.00 -1.54 -0.87 0.00 0.00 176.83 175.15 2r91 n SER 217 N -4.78 0.14 0.31 4.97 3.41 -1.26 -1.42 113.62 114.98 2r91 n SER 217 Ca 0.27 0.56 0.21 0.00 -0.26 0.00 0.00 58.87 59.64 2r91 n SER 217 Cb 0.82 -0.58 1.03 0.00 -0.26 0.00 0.00 64.21 65.22 2r91 n SER 217 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2r91 h ALA 218 N 2.09 1.00 -0.54 7.33 0.00 -1.55 0.33 119.26 127.92 2r91 h ALA 218 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2r91 h ALA 218 Cb 0.06 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2r91 h ALA 218 CO 0.00 0.00 -0.05 -0.91 0.00 0.00 0.00 179.25 178.29 2r91 h ASN 219 N 0.00 0.97 0.00 0.00 2.35 -1.47 -3.31 115.58 114.12 2r91 h ASN 219 Ca 0.00 -0.33 -0.01 0.00 -0.55 0.00 0.00 56.30 55.41 2r91 h ASN 219 Cb 0.15 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.25 2r91 h ASN 219 CO 0.00 1.07 -1.14 0.00 -1.65 0.00 0.00 177.43 175.70 2r91 n TYR 220 N -4.22 0.00 -2.83 1.19 0.18 -0.83 -4.78 117.16 105.87 2r91 n TYR 220 Ca 0.01 0.00 -0.14 0.00 1.88 0.00 0.00 57.90 59.66 2r91 n TYR 220 Cb 0.36 -0.08 0.01 0.00 -0.38 0.00 0.00 39.34 39.25 2r91 n TYR 220 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 2r91 n LEU 221 N -1.69 1.55 0.10 -3.48 4.77 0.11 -4.42 117.00 113.93 2r91 n LEU 221 Ca -0.01 -4.28 0.06 0.00 -0.03 0.00 0.00 56.01 51.74 2r91 n LEU 221 Cb 0.17 0.44 0.51 0.00 -2.33 0.00 0.00 43.42 42.21 2r91 n LEU 221 CO 0.06 1.86 1.13 1.55 -1.33 0.00 0.00 177.39 180.66 2r91 h PRO 222 N 2.97 0.32 -0.11 3.23 0.13 -1.65 -1.14 132.00 135.75 2r91 h PRO 222 Ca -0.00 -0.02 -0.08 0.00 -0.87 0.00 0.00 66.00 65.03 2r91 h PRO 222 Cb 1.07 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.12 2r91 h PRO 222 CO 0.53 0.21 -0.29 1.05 -0.23 0.00 0.00 178.00 179.27 2r91 h GLU 223 N 0.33 0.21 -0.21 0.86 9.09 -1.92 -0.68 114.58 122.26 2r91 h GLU 223 Ca 0.10 -0.08 -0.03 0.00 0.05 0.00 0.00 59.36 59.40 2r91 h GLU 223 Cb -0.01 -0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 27.07 2r91 h GLU 223 CO -0.02 0.49 -0.00 1.25 0.05 0.00 0.00 179.01 180.78 2r91 h LEU 224 N 0.19 0.37 -0.58 3.06 6.46 -1.59 -0.68 115.31 122.54 2r91 h LEU 224 Ca 0.03 -0.31 0.05 0.00 -0.12 0.00 0.00 57.88 57.53 2r91 h LEU 224 Cb 0.62 -0.10 -0.05 0.00 -0.73 0.00 0.00 40.66 40.40 2r91 h LEU 224 CO 0.04 0.59 0.30 -0.07 -0.62 0.00 0.00 178.44 178.68 2r91 h LEU 225 N 0.13 0.43 -0.88 2.25 3.38 -1.07 -0.74 115.31 118.81 2r91 h LEU 225 Ca 0.06 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 2r91 h LEU 225 Cb 0.40 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 2r91 h LEU 225 CO 0.01 0.28 0.45 0.00 0.09 0.00 0.00 178.44 179.28 2r91 h ALA 226 N 1.32 1.14 -0.93 1.53 0.00 -1.10 -0.91 119.26 120.30 2r91 h ALA 226 Ca 0.26 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.04 2r91 h ALA 226 Cb 0.18 -0.35 -0.05 0.00 0.00 0.00 0.00 17.79 17.57 2r91 h ALA 226 CO -0.18 0.67 0.62 0.78 0.00 0.00 0.00 179.25 181.14 2r91 h GLY 227 N 1.25 1.32 0.90 0.00 0.00 -0.53 0.15 103.07 106.15 2r91 h GLY 227 Ca 0.31 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 47.09 2r91 h GLY 227 CO -0.04 0.46 -0.05 -2.22 0.00 0.00 0.00 176.54 174.68 2r91 h ILE 228 N 1.24 1.27 -0.37 2.60 2.04 -0.80 -0.77 117.51 122.73 2r91 h ILE 228 Ca 0.35 -1.07 -0.00 0.00 1.00 0.00 0.00 64.86 65.14 2r91 h ILE 228 Cb -0.11 1.34 -0.02 0.00 -0.74 0.00 0.00 36.82 37.29 2r91 h ILE 228 CO -0.08 0.34 0.22 -0.09 0.00 0.00 0.00 178.15 178.54 2r91 h ARG 229 N 0.37 0.50 -0.47 2.37 2.43 -0.65 -1.39 114.38 117.53 2r91 h ARG 229 Ca 0.08 -0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.23 2r91 h ARG 229 Cb 0.53 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.94 2r91 h ARG 229 CO 0.03 0.38 0.28 -0.44 -1.51 0.00 0.00 179.97 178.70 2r91 h ASP 230 N 0.48 0.45 -0.76 -3.80 3.32 -0.71 -2.15 116.42 113.25 2r91 h ASP 230 Ca 0.13 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.14 2r91 h ASP 230 Cb 0.01 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 2r91 h ASP 230 CO -0.02 0.32 0.29 0.00 -1.72 0.00 0.00 179.24 178.11 2r91 h ALA 231 N 1.21 0.99 -0.46 3.45 0.00 -0.78 -0.89 119.26 122.78 2r91 h ALA 231 Ca 0.19 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2r91 h ALA 231 Cb 0.02 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2r91 h ALA 231 CO -0.09 0.62 0.08 0.28 0.00 0.00 0.00 179.25 180.14 2r91 h VAL 232 N 1.10 1.25 -0.45 0.00 2.07 -1.15 0.20 116.25 119.27 2r91 h VAL 232 Ca 0.25 -0.90 -0.04 0.00 0.82 0.00 0.00 66.70 66.84 2r91 h VAL 232 Cb 0.23 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 2r91 h VAL 232 CO -0.02 0.32 0.12 0.00 0.02 0.00 0.00 177.57 178.00 2r91 h ALA 233 N 0.96 1.37 0.00 1.67 0.00 -1.16 -1.97 119.26 120.13 2r91 h ALA 233 Ca 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2r91 h ALA 233 Cb 0.38 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.98 2r91 h ALA 233 CO 0.01 0.45 0.00 0.00 0.00 0.00 0.00 179.25 179.71 2r91 n ALA 234 N -2.47 2.31 -1.03 0.00 0.00 -0.36 -4.90 120.51 114.07 2r91 n ALA 234 Ca 0.03 -0.11 -0.01 0.00 0.00 0.00 0.00 53.44 53.35 2r91 n ALA 234 Cb 0.20 -1.45 -0.00 0.00 0.00 0.00 0.00 19.45 18.19 2r91 n ALA 234 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r91 n GLY 235 N 1.31 0.48 2.93 0.00 0.00 -0.74 -4.95 105.19 104.22 2r91 n GLY 235 Ca 0.09 -0.28 -0.43 0.00 0.00 0.00 0.00 46.02 45.40 2r91 n GLY 235 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2r91 n ASP 236 N 0.35 4.74 -0.18 1.61 -0.08 0.64 -4.74 116.55 118.89 2r91 n ASP 236 Ca -0.01 -3.01 -0.02 0.00 -1.51 0.00 0.00 54.79 50.25 2r91 n ASP 236 Cb 0.08 -1.56 0.21 0.00 2.34 0.00 0.00 41.12 42.19 2r91 n ASP 236 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 2r91 h ILE 237 N 4.01 1.21 -0.69 5.18 1.08 -1.91 -2.01 117.51 124.39 2r91 h ILE 237 Ca 0.44 -0.62 -0.05 0.00 -0.39 0.00 0.00 64.86 64.24 2r91 h ILE 237 Cb 0.67 0.41 -0.03 0.00 -3.07 0.00 0.00 36.82 34.80 2r91 h ILE 237 CO 1.66 0.26 0.25 -0.33 -0.69 0.00 0.00 178.15 179.29 2r91 h GLU 238 N 0.91 1.04 -0.21 2.37 3.07 -1.94 -0.44 114.58 119.38 2r91 h GLU 238 Ca 0.22 -0.19 -0.09 0.00 -0.50 0.00 0.00 59.36 58.80 2r91 h GLU 238 Cb 0.12 -0.17 -0.00 0.00 -0.84 0.00 0.00 28.75 27.86 2r91 h GLU 238 CO -0.03 0.86 -0.21 -0.09 -1.40 0.00 0.00 179.01 178.15 2r91 h ARG 239 N 1.01 0.51 -0.54 2.33 2.43 -1.85 -2.15 114.38 116.13 2r91 h ARG 239 Ca 0.23 -0.27 0.10 0.00 -0.81 0.00 0.00 59.98 59.23 2r91 h ARG 239 Cb 0.23 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.72 2r91 h ARG 239 CO -0.02 0.85 0.09 0.00 -1.51 0.00 0.00 179.97 179.39 2r91 h ALA 240 N 0.65 0.59 -0.44 2.80 0.00 -1.20 -0.11 119.26 121.55 2r91 h ALA 240 Ca 0.03 0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.93 2r91 h ALA 240 Cb 0.76 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 2r91 h ALA 240 CO 0.05 -0.32 -0.28 -0.09 0.00 0.00 0.00 179.25 178.61 2r91 h ARG 241 N 0.22 0.97 -0.53 0.00 2.43 -1.12 -0.72 114.38 115.62 2r91 h ARG 241 Ca 0.27 -0.45 -0.01 0.00 -0.81 0.00 0.00 59.98 58.98 2r91 h ARG 241 Cb 0.39 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 2r91 h ARG 241 CO -0.37 1.12 0.30 1.03 -1.51 0.00 0.00 179.97 180.53 2r91 h SER 242 N 0.81 0.66 -0.56 -3.80 0.87 -0.93 -0.36 113.55 110.24 2r91 h SER 242 Ca 0.09 -0.08 -0.04 0.00 -1.23 0.00 0.00 61.79 60.53 2r91 h SER 242 Cb 0.86 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.63 2r91 h SER 242 CO 0.08 0.55 0.20 -0.07 -0.53 0.00 0.00 176.83 177.06 2r91 h LEU 243 N 0.71 0.79 -0.47 2.23 3.38 -0.97 -2.07 115.31 118.92 2r91 h LEU 243 Ca 0.19 -0.19 0.08 0.00 0.09 0.00 0.00 57.88 58.05 2r91 h LEU 243 Cb 0.03 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 40.51 2r91 h LEU 243 CO -0.03 0.77 0.09 -0.61 0.09 0.00 0.00 178.44 178.74 2r91 h GLN 244 N 0.78 0.21 -0.55 1.13 5.75 -0.72 -1.91 115.11 119.80 2r91 h GLN 244 Ca 0.18 -0.01 -0.06 0.00 -0.15 0.00 0.00 58.65 58.61 2r91 h GLN 244 Cb 0.24 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.72 2r91 h GLN 244 CO -0.01 0.14 0.09 0.74 -2.65 0.00 0.00 178.83 177.14 2r91 h PHE 245 N 0.22 0.92 -0.33 3.99 0.04 -0.82 0.79 116.94 121.74 2r91 h PHE 245 Ca 0.24 -0.10 0.01 0.00 2.80 0.00 0.00 57.97 60.91 2r91 h PHE 245 Cb 0.31 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.18 2r91 h PHE 245 CO -0.23 0.79 0.21 -0.07 -0.60 0.00 0.00 178.31 178.41 2r91 h LEU 246 N 0.83 0.36 -0.58 1.54 3.38 -1.12 -1.72 115.31 118.01 2r91 h LEU 246 Ca 0.17 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.20 2r91 h LEU 246 Cb 0.37 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 40.97 2r91 h LEU 246 CO 0.01 0.26 0.27 0.25 0.09 0.00 0.00 178.44 179.32 2r91 h LEU 247 N 0.43 0.36 -0.83 1.67 5.85 -1.00 -2.38 115.31 119.41 2r91 h LEU 247 Ca 0.12 0.05 0.08 0.00 0.84 0.00 0.00 57.88 58.97 2r91 h LEU 247 Cb -0.04 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 40.91 2r91 h LEU 247 CO -0.03 0.23 0.49 0.44 -0.34 0.00 0.00 178.44 179.23 2r91 h ASP 248 N 0.51 0.73 -0.79 1.25 3.32 -0.52 -0.25 116.42 120.65 2r91 h ASP 248 Ca 0.27 0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.31 2r91 h ASP 248 Cb 0.23 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.64 2r91 h ASP 248 CO -0.21 0.44 0.31 -0.33 -1.72 0.00 0.00 179.24 177.73 2r91 h GLU 249 N 0.85 1.19 0.06 3.56 5.08 -0.84 -0.22 114.58 124.26 2r91 h GLU 249 Ca 0.38 -0.22 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2r91 h GLU 249 Cb 0.29 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2r91 h GLU 249 CO -0.22 0.97 -0.03 0.82 -1.00 0.00 0.00 179.01 179.55 2r91 h ILE 250 N 1.16 1.10 -0.46 3.13 2.04 -0.95 -2.20 117.51 121.33 2r91 h ILE 250 Ca 0.27 -0.52 0.07 0.00 1.00 0.00 0.00 64.86 65.67 2r91 h ILE 250 Cb 0.22 1.44 -0.06 0.00 -0.74 0.00 0.00 36.82 37.68 2r91 h ILE 250 CO -0.02 0.13 0.12 0.58 0.00 0.00 0.00 178.15 178.96 2r91 h VAL 251 N -0.31 0.79 -0.61 1.67 2.07 -0.89 -1.74 116.25 117.22 2r91 h VAL 251 Ca -0.01 -0.09 0.08 0.00 0.82 0.00 0.00 66.70 67.50 2r91 h VAL 251 Cb 0.28 0.50 -0.07 0.00 -1.52 0.00 0.00 31.29 30.48 2r91 h VAL 251 CO 0.01 0.05 0.26 -0.33 0.02 0.00 0.00 177.57 177.58 2r91 h GLU 252 N 0.26 0.45 -0.27 1.57 5.08 -0.97 0.68 114.58 121.39 2r91 h GLU 252 Ca 0.22 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 2r91 h GLU 252 Cb 0.27 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2r91 h GLU 252 CO -0.27 0.30 0.15 0.77 -1.00 0.00 0.00 179.01 178.96 2r91 h SER 253 N 0.47 0.34 -0.77 1.42 0.02 -1.07 -2.63 113.55 111.34 2r91 h SER 253 Ca 0.30 -0.09 0.05 0.00 -0.84 0.00 0.00 61.79 61.20 2r91 h SER 253 Cb 0.32 -0.09 -0.05 0.00 0.14 0.00 0.00 62.40 62.73 2r91 h SER 253 CO -0.27 0.34 0.50 0.00 -1.14 0.00 0.00 176.83 176.27 2r91 h ALA 254 N 1.02 1.60 -0.05 3.77 0.00 -0.90 -2.20 119.26 122.49 2r91 h ALA 254 Ca 0.10 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 2r91 h ALA 254 Cb 0.07 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2r91 h ALA 254 CO -0.01 0.31 -0.41 0.00 0.00 0.00 0.00 179.25 179.13 2r91 h ARG 255 N 0.88 0.11 -0.77 0.00 3.08 -0.57 -2.71 114.38 114.41 2r91 h ARG 255 Ca 0.32 -0.05 0.10 0.00 0.07 0.00 0.00 59.98 60.41 2r91 h ARG 255 Cb 0.14 -0.00 -0.07 0.00 0.08 0.00 0.00 29.97 30.11 2r91 h ARG 255 CO -0.10 0.51 0.41 1.25 -1.07 0.00 0.00 179.97 180.97 2r91 h HIS 256 N 0.10 0.74 -0.02 3.04 2.76 -1.04 -3.14 115.15 117.58 2r91 h HIS 256 Ca 0.01 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 2r91 h HIS 256 Cb 0.77 -0.22 0.00 0.00 1.55 0.00 0.00 27.41 29.51 2r91 h HIS 256 CO 0.01 0.28 -0.19 0.44 -1.30 0.00 0.00 177.93 177.17 2r91 n ILE 257 N -4.81 0.00 0.00 6.26 -5.35 -1.09 -4.99 119.36 109.39 2r91 n ILE 257 Ca 0.12 -0.39 0.00 0.00 -0.27 0.00 0.00 62.75 62.22 2r91 n ILE 257 Cb 0.28 1.33 0.00 0.00 -1.74 0.00 0.00 39.64 39.52 2r91 n ILE 257 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2r91 n GLY 258 N 1.37 2.18 0.18 3.28 0.00 -1.04 -4.91 105.19 106.25 2r91 n GLY 258 Ca 0.12 -0.71 -0.10 0.00 0.00 0.00 0.00 46.02 45.33 2r91 n GLY 258 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2r91 h TYR 259 N 0.00 0.58 -0.86 1.61 3.20 -1.73 -1.11 116.97 118.66 2r91 h TYR 259 Ca 0.00 -0.07 0.03 0.00 3.14 0.00 0.00 58.73 61.83 2r91 h TYR 259 Cb 0.00 -0.16 -0.05 0.00 1.54 0.00 0.00 36.73 38.06 2r91 h TYR 259 CO 0.00 0.60 0.55 0.00 -1.64 0.00 0.00 178.16 177.67 2r91 h ALA 260 N 0.92 1.13 -0.02 1.82 0.00 -1.96 -0.60 119.26 120.55 2r91 h ALA 260 Ca 0.11 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.80 2r91 h ALA 260 Cb 0.32 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2r91 h ALA 260 CO 0.00 0.39 -0.80 0.00 0.00 0.00 0.00 179.25 178.84 2r91 h ALA 261 N 1.35 0.60 -0.06 0.00 0.00 -1.83 -3.32 119.26 116.01 2r91 h ALA 261 Ca 0.34 -0.67 -0.09 0.00 0.00 0.00 0.00 54.91 54.49 2r91 h ALA 261 Cb 0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2r91 h ALA 261 CO -0.12 0.86 -0.39 0.00 0.00 0.00 0.00 179.25 179.61 2r91 h ALA 262 N 1.03 1.25 -0.87 0.00 0.00 0.17 -2.97 119.26 117.86 2r91 h ALA 262 Ca -0.03 -0.38 0.10 0.00 0.00 0.00 0.00 54.91 54.61 2r91 h ALA 262 Cb 1.40 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 19.03 2r91 h ALA 262 CO 0.12 0.53 0.51 0.28 0.00 0.00 0.00 179.25 180.69 2r91 h VAL 263 N 0.11 0.90 -0.44 0.00 2.07 -1.29 -0.15 116.25 117.43 2r91 h VAL 263 Ca 0.01 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.26 2r91 h VAL 263 Cb 0.73 -0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 2r91 h VAL 263 CO 0.05 0.15 0.28 1.88 0.02 0.00 0.00 177.57 179.95 2r91 h TYR 264 N 0.83 0.52 -0.34 1.57 0.05 -1.73 -1.19 116.97 116.69 2r91 h TYR 264 Ca 0.43 0.01 -0.10 0.00 0.05 0.00 0.00 58.73 59.12 2r91 h TYR 264 Cb 0.42 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 37.97 2r91 h TYR 264 CO -0.05 0.31 -0.21 1.49 -1.05 0.00 0.00 178.16 178.65 2r91 h GLU 265 N 0.56 0.65 -0.70 4.88 4.57 -1.46 -2.66 114.58 120.42 2r91 h GLU 265 Ca 0.17 -0.24 -0.05 0.00 -1.18 0.00 0.00 59.36 58.06 2r91 h GLU 265 Cb -0.03 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.49 2r91 h GLU 265 CO -0.06 0.81 0.24 -0.07 -1.18 0.00 0.00 179.01 178.75 2r91 h LEU 266 N 0.57 0.98 -0.23 1.64 3.38 -0.62 -0.54 115.31 120.49 2r91 h LEU 266 Ca 0.09 -0.16 0.05 0.00 0.09 0.00 0.00 57.88 57.94 2r91 h LEU 266 Cb 0.67 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.12 2r91 h LEU 266 CO 0.05 0.90 -0.11 0.58 0.09 0.00 0.00 178.44 179.95 2r91 h VAL 267 N 1.02 0.65 -0.61 1.22 2.07 -1.01 -1.07 116.25 118.52 2r91 h VAL 267 Ca 0.23 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.80 2r91 h VAL 267 Cb 0.26 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 2r91 h VAL 267 CO -0.01 0.00 0.33 -0.33 0.02 0.00 0.00 177.57 177.58 2r91 h GLU 268 N -0.08 0.60 -0.17 1.57 5.08 -1.09 0.41 114.58 120.91 2r91 h GLU 268 Ca 0.12 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 2r91 h GLU 268 Cb 0.26 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2r91 h GLU 268 CO -0.28 0.40 0.07 0.82 -1.00 0.00 0.00 179.01 179.01 2r91 h ILE 269 N 0.62 1.16 0.00 3.13 2.04 -0.88 -1.40 117.51 122.18 2r91 h ILE 269 Ca 0.27 -0.47 -0.30 0.00 1.00 0.00 0.00 64.86 65.36 2r91 h ILE 269 Cb 0.17 1.15 -0.05 0.00 -0.74 0.00 0.00 36.82 37.35 2r91 h ILE 269 CO -0.18 0.15 -1.92 0.49 0.00 0.00 0.00 178.15 176.69 2r91 n PHE 270 N -4.85 0.63 -0.02 1.37 3.72 -0.43 -4.40 117.46 113.48 2r91 n PHE 270 Ca -0.04 0.22 0.08 0.00 -0.05 0.00 0.00 57.45 57.66 2r91 n PHE 270 Cb 0.12 -1.09 -0.15 0.00 -0.94 0.00 0.00 39.48 37.41 2r91 n PHE 270 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2r91 n GLN 271 N -2.90 0.64 -1.01 -1.08 1.13 0.14 -5.03 117.38 109.28 2r91 n GLN 271 Ca -0.21 -0.16 0.00 0.00 -1.94 0.00 0.00 57.00 54.68 2r91 n GLN 271 Cb 1.05 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.93 2r91 n GLN 271 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2r91 n GLY 272 N 1.42 0.40 3.28 1.08 0.00 -0.53 -5.01 105.19 105.84 2r91 n GLY 272 Ca -0.07 -1.05 -0.15 0.00 0.00 0.00 0.00 46.02 44.75 2r91 n GLY 272 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2r91 s TYR 273 N -2.00 1.38 0.06 1.61 -0.85 -1.26 -5.05 117.35 111.25 2r91 s TYR 273 Ca 0.00 -0.99 -0.31 0.00 -0.52 0.00 0.00 57.07 55.25 2r91 s TYR 273 Cb 0.00 -0.79 -0.07 0.00 0.38 0.00 0.00 41.96 41.47 2r91 s TYR 273 CO 0.00 -0.15 1.48 -1.21 -1.52 0.00 0.00 175.55 174.15 2r91 s GLU 274 N -3.90 4.26 0.00 -3.49 2.02 -1.26 -3.97 118.70 112.36 2r91 s GLU 274 Ca 0.27 2.13 0.17 0.00 0.02 0.00 0.00 54.97 57.56 2r91 s GLU 274 Cb 0.06 -3.46 0.17 0.00 0.10 0.00 0.00 34.13 30.99 2r91 s GLU 274 CO 0.07 -0.59 1.07 0.00 0.02 0.00 0.00 175.26 175.83 2r91 n ALA 275 N 4.97 2.45 -0.33 5.21 0.00 -1.26 -4.99 120.51 126.55 2r91 n ALA 275 Ca 0.14 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.89 2r91 n ALA 275 Cb 0.42 -0.58 0.00 0.00 0.00 0.00 0.00 19.45 19.29 2r91 n ALA 275 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r91 n GLY 276 N 0.96 -0.29 3.45 0.00 0.00 -1.26 -4.67 105.19 103.37 2r91 n GLY 276 Ca 0.11 -1.04 -0.10 0.00 0.00 0.00 0.00 46.02 44.98 2r91 n GLY 276 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2r91 s GLU 277 N 0.00 1.27 0.07 1.61 -1.05 -0.15 -4.88 118.70 115.57 2r91 s GLU 277 Ca 0.00 -0.80 -0.01 0.00 -0.15 0.00 0.00 54.97 54.00 2r91 s GLU 277 Cb 0.00 0.50 0.02 0.00 -0.44 0.00 0.00 34.13 34.21 2r91 s GLU 277 CO 0.00 -0.53 0.10 -0.35 0.95 0.00 0.00 175.26 175.43 2r91 n PRO 278 N -0.30 -0.05 -4.22 -4.83 -0.04 -1.26 -1.26 135.00 123.03 2r91 n PRO 278 Ca -0.12 -0.16 -0.17 0.00 -0.04 0.00 0.00 63.50 63.01 2r91 n PRO 278 Cb 0.63 -0.10 -0.15 0.00 -0.04 0.00 0.00 33.50 33.85 2r91 n PRO 278 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 2r91 s ARG 279 N -3.17 0.54 0.26 0.54 3.52 -1.00 -4.50 118.95 115.14 2r91 s ARG 279 Ca 0.06 -0.22 -0.31 0.00 -0.13 0.00 0.00 55.73 55.13 2r91 s ARG 279 Cb -0.00 -0.52 -0.12 0.00 -1.56 0.00 0.00 34.95 32.75 2r91 s ARG 279 CO 0.04 0.12 1.65 0.20 -0.81 0.00 0.00 175.30 176.50 2r91 s GLY 280 N -0.07 1.76 0.00 8.12 0.00 -1.26 -1.55 107.32 114.32 2r91 s GLY 280 Ca 0.01 1.59 0.25 0.00 0.00 0.00 0.00 44.72 46.57 2r91 s GLY 280 CO -0.00 2.69 1.35 -1.55 0.00 0.00 0.00 173.10 175.58 2r91 n PRO 281 N 2.87 0.98 -2.02 2.90 -0.04 -1.26 -4.89 135.00 133.53 2r91 n PRO 281 Ca 0.11 -0.71 -0.42 0.00 -0.04 0.00 0.00 63.50 62.44 2r91 n PRO 281 Cb 0.36 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.34 2r91 n PRO 281 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2r91 n VAL 282 N -0.39 3.73 -2.24 0.52 0.31 -0.59 -5.00 118.33 114.66 2r91 n VAL 282 Ca 0.11 -3.51 -0.39 0.00 -0.01 0.00 0.00 64.34 60.54 2r91 n VAL 282 Cb 0.40 -2.52 -0.02 0.00 -0.91 0.00 0.00 33.84 30.79 2r91 n VAL 282 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 2r91 s TYR 283 N 2.77 3.06 0.55 3.52 2.02 -1.26 -2.37 117.35 125.64 2r91 s TYR 283 Ca 0.47 1.52 -0.19 0.00 -0.37 0.00 0.00 57.07 58.49 2r91 s TYR 283 Cb 0.11 -3.47 -0.07 0.00 -0.40 0.00 0.00 41.96 38.13 2r91 s TYR 283 CO -0.04 -1.46 0.84 -2.30 -1.57 0.00 0.00 175.55 171.01 2r91 n PRO 284 N 0.26 0.86 -1.73 -1.71 -0.02 -1.26 -4.77 135.00 126.63 2r91 n PRO 284 Ca 0.03 0.33 -0.40 0.00 -2.02 0.00 0.00 63.50 61.44 2r91 n PRO 284 Cb 0.45 -2.00 0.03 0.00 -0.02 0.00 0.00 33.50 31.96 2r91 n PRO 284 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2r91 n LEU 285 N -0.12 4.83 -4.94 2.45 4.77 -1.26 -5.02 117.00 117.71 2r91 n LEU 285 Ca 0.12 1.05 -0.27 0.00 -0.03 0.00 0.00 56.01 56.89 2r91 n LEU 285 Cb 0.46 -1.55 0.11 0.00 -2.33 0.00 0.00 43.42 40.10 2r91 n LEU 285 CO 0.51 -0.54 0.69 1.51 -1.33 0.00 0.00 177.39 178.24 2r91 s ASP 286 N -0.67 4.24 0.34 -1.43 1.47 -1.26 -4.82 116.67 114.54 2r91 s ASP 286 Ca 0.65 0.30 0.02 0.00 1.18 0.00 0.00 52.55 54.70 2r91 s ASP 286 Cb -0.46 -0.72 0.61 0.00 -0.34 0.00 0.00 42.92 42.01 2r91 s ASP 286 CO 0.54 -1.98 2.00 -0.65 0.68 0.00 0.00 175.17 175.76 2r91 h PRO 287 N -0.92 0.85 -0.39 2.11 0.11 -1.99 -1.40 132.00 130.37 2r91 h PRO 287 Ca -0.43 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.58 2r91 h PRO 287 Cb 1.29 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.19 2r91 h PRO 287 CO 0.51 0.57 0.08 0.93 -0.21 0.00 0.00 178.00 179.89 2r91 h GLU 288 N 0.87 0.63 -0.80 1.05 3.07 -1.99 -1.13 114.58 116.28 2r91 h GLU 288 Ca 0.23 -0.16 -0.01 0.00 -0.50 0.00 0.00 59.36 58.92 2r91 h GLU 288 Cb -0.08 -0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 27.71 2r91 h GLU 288 CO -0.05 0.67 0.46 0.93 -1.40 0.00 0.00 179.01 179.62 2r91 h GLU 289 N 0.48 1.11 -0.44 2.33 5.08 -1.84 -0.69 114.58 120.60 2r91 h GLU 289 Ca 0.12 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2r91 h GLU 289 Cb 0.34 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 2r91 h GLU 289 CO 0.00 0.80 0.21 0.87 -1.00 0.00 0.00 179.01 179.89 2r91 h LYS 290 N 1.11 0.63 -0.73 2.33 1.57 -1.14 -1.15 116.57 119.19 2r91 h LYS 290 Ca 0.29 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.94 2r91 h LYS 290 Cb -0.00 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 2r91 h LYS 290 CO -0.05 0.55 0.33 0.00 -0.57 0.00 0.00 179.45 179.71 2r91 h ALA 291 N 1.05 0.95 -0.39 3.86 0.00 -1.00 -1.24 119.26 122.49 2r91 h ALA 291 Ca 0.15 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2r91 h ALA 291 Cb 0.13 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2r91 h ALA 291 CO -0.02 0.54 0.23 2.35 0.00 0.00 0.00 179.25 182.35 2r91 h TRP 292 N 1.04 0.52 -0.33 0.00 7.01 -0.94 -2.64 115.95 120.60 2r91 h TRP 292 Ca 0.25 -0.00 -0.06 0.00 2.11 0.00 0.00 58.89 61.19 2r91 h TRP 292 Cb 0.16 -0.17 -0.01 0.00 -2.10 0.00 0.00 29.16 27.04 2r91 h TRP 292 CO 0.01 0.37 -0.03 1.25 -2.79 0.00 0.00 178.44 177.26 2r91 h LEU 293 N 0.51 0.60 -0.47 0.65 5.85 -0.93 0.19 115.31 121.71 2r91 h LEU 293 Ca 0.14 -0.33 0.08 0.00 0.84 0.00 0.00 57.88 58.61 2r91 h LEU 293 Cb 0.01 -0.16 -0.07 0.00 0.37 0.00 0.00 40.66 40.80 2r91 h LEU 293 CO -0.03 0.79 0.06 0.03 -0.34 0.00 0.00 178.44 178.95 2r91 h ARG 294 N 0.40 0.18 -0.51 1.25 3.08 -1.21 -1.48 114.38 116.09 2r91 h ARG 294 Ca 0.09 -0.01 -0.09 0.00 0.07 0.00 0.00 59.98 60.04 2r91 h ARG 294 Cb 0.49 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.48 2r91 h ARG 294 CO 0.02 0.12 -0.03 0.00 -1.07 0.00 0.00 179.97 179.01 2r91 h ALA 295 N 1.38 0.98 -0.38 0.04 0.00 -1.16 -2.71 119.26 117.42 2r91 h ALA 295 Ca 0.24 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 2r91 h ALA 295 Cb 0.33 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2r91 h ALA 295 CO -0.34 0.62 0.04 0.00 0.00 0.00 0.00 179.25 179.57 2r91 h ALA 296 N 1.14 1.37 -0.02 0.00 0.00 0.23 -2.94 119.26 119.04 2r91 h ALA 296 Ca 0.15 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2r91 h ALA 296 Cb 0.53 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2r91 h ALA 296 CO 0.03 0.45 -0.13 1.33 0.00 0.00 0.00 179.25 180.92 2r91 n VAL 297 N -4.29 0.00 -0.12 0.00 0.24 -0.64 -4.55 118.33 108.97 2r91 n VAL 297 Ca 0.02 -0.39 -0.05 0.00 -2.04 0.00 0.00 64.34 61.89 2r91 n VAL 297 Cb 0.23 1.24 0.03 0.00 -1.47 0.00 0.00 33.84 33.88 2r91 n VAL 297 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2r91 h ALA 298 N 4.41 0.42 0.38 2.33 0.00 -1.29 0.20 119.26 125.71 2r91 h ALA 298 Ca 0.00 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2r91 h ALA 298 Cb 0.85 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2r91 h ALA 298 CO 0.00 -0.34 -0.18 -0.22 0.00 0.00 0.00 179.25 178.50 2r91 h LYS 299 N 0.18 -0.50 -0.71 0.00 3.64 -1.80 -0.95 116.57 116.43 2r91 h LYS 299 Ca 0.20 0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.70 2r91 h LYS 299 Cb 0.25 0.11 -0.07 0.00 -0.41 0.00 0.00 32.23 32.12 2r91 h LYS 299 CO -0.28 -0.25 0.36 0.00 -2.27 0.00 0.00 179.45 177.01 2r91 h ALA 300 N -0.09 0.97 -0.77 5.00 0.00 -1.81 -1.15 119.26 121.42 2r91 h ALA 300 Ca -0.05 0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.00 2r91 h ALA 300 Cb 0.47 -0.06 -0.07 0.00 0.00 0.00 0.00 17.79 18.13 2r91 h ALA 300 CO 0.09 -0.03 0.41 -0.22 0.00 0.00 0.00 179.25 179.50 2r91 h LYS 301 N 0.62 0.68 -0.03 0.00 3.64 -0.42 -1.89 116.57 119.16 2r91 h LYS 301 Ca 0.34 -0.04 -0.14 0.00 -1.27 0.00 0.00 60.65 59.55 2r91 h LYS 301 Cb 0.35 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 2r91 h LYS 301 CO -0.26 0.45 -0.60 0.66 -2.27 0.00 0.00 179.45 177.43 2r91 h SER 302 N 0.70 0.13 0.80 4.20 4.64 -0.23 -2.67 113.55 121.11 2r91 h SER 302 Ca 0.37 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 2r91 h SER 302 Cb 0.37 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 2r91 h SER 302 CO -0.26 0.70 0.00 0.00 -0.87 0.00 0.00 176.83 176.40 2r91 n GLN 303 N -3.85 0.15 -2.43 4.77 6.02 -0.52 -4.71 117.38 116.81 2r91 n GLN 303 Ca -0.02 0.33 -0.43 0.00 -0.01 0.00 0.00 57.00 56.87 2r91 n GLN 303 Cb 0.61 -1.75 -0.02 0.00 1.02 0.00 0.00 30.24 30.09 2r91 n GLN 303 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2r91 s LEU 304 N -4.05 3.95 -0.41 1.08 1.43 -0.88 -4.99 118.68 114.80 2r91 s LEU 304 Ca 0.06 1.30 -0.01 0.00 -1.03 0.00 0.00 54.13 54.45 2r91 s LEU 304 Cb 0.10 -3.54 0.11 0.00 0.03 0.00 0.00 46.19 42.89 2r91 s LEU 304 CO 0.40 -1.01 0.18 0.00 0.23 0.00 0.00 176.35 176.16 2r91 s ARG 305 N 4.01 1.91 0.00 1.70 1.70 -1.26 -5.04 118.95 121.97 2r91 s ARG 305 Ca 0.55 -1.88 0.00 0.00 -0.47 0.00 0.00 55.73 53.94 2r91 s ARG 305 Cb -0.18 -3.51 0.00 0.00 -0.57 0.00 0.00 34.95 30.70 2r91 s ARG 305 CO 0.21 -1.05 0.00 1.47 -1.08 0.00 0.00 175.30 174.85