#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r94 s GLU 22 N 0.00 3.45 -0.41 0.03 2.02 0.03 -4.91 118.70 118.90 2r94 s GLU 22 Ca 0.00 -0.32 -0.17 0.00 0.02 0.00 0.00 54.97 54.50 2r94 s GLU 22 Cb 0.00 -3.09 0.02 0.00 0.10 0.00 0.00 34.13 31.16 2r94 s GLU 22 CO 0.00 0.67 0.41 0.42 0.02 0.00 0.00 175.26 176.78 2r94 s ILE 23 N -1.35 5.12 -0.17 -1.63 1.01 -1.26 -0.71 121.20 122.21 2r94 s ILE 23 Ca 0.28 -0.36 -0.06 0.00 0.00 0.00 0.00 60.65 60.51 2r94 s ILE 23 Cb -0.13 -4.01 -0.03 0.00 0.01 0.00 0.00 42.46 38.30 2r94 s ILE 23 CO 0.20 -0.38 0.01 -0.69 0.00 0.00 0.00 174.94 174.08 2r94 s VAL 24 N 2.06 4.36 -0.24 2.92 1.01 0.06 -0.31 120.40 130.26 2r94 s VAL 24 Ca 0.11 -0.19 -0.10 0.00 0.00 0.00 0.00 61.98 61.80 2r94 s VAL 24 Cb -0.17 -2.94 -0.05 0.00 0.00 0.00 0.00 36.38 33.22 2r94 s VAL 24 CO 0.13 0.48 0.14 0.00 0.00 0.00 0.00 175.10 175.84 2r94 s ALA 25 N 0.37 3.52 -0.71 5.51 0.00 -0.06 -2.26 121.76 128.14 2r94 s ALA 25 Ca -0.00 -0.92 -0.23 0.00 0.00 0.00 0.00 51.96 50.81 2r94 s ALA 25 Cb -0.13 -2.25 0.07 0.00 0.00 0.00 0.00 23.12 20.81 2r94 s ALA 25 CO 0.01 -0.21 1.03 -1.25 0.00 0.00 0.00 175.76 175.35 2r94 s PRO 26 N 1.09 3.18 0.22 0.00 0.04 -1.26 0.32 135.00 138.59 2r94 s PRO 26 Ca 0.07 -0.88 -0.25 0.00 0.04 0.00 0.00 61.00 59.98 2r94 s PRO 26 Cb -0.14 -4.33 -0.09 0.00 0.04 0.00 0.00 34.50 29.99 2r94 s PRO 26 CO 0.04 -1.86 0.82 0.54 0.04 0.00 0.00 177.00 176.59 2r94 s VAL 27 N 4.12 4.35 0.59 -0.36 0.11 -0.39 -4.44 120.40 124.38 2r94 s VAL 27 Ca 0.25 1.67 -0.19 0.00 -2.93 0.00 0.00 61.98 60.78 2r94 s VAL 27 Cb -0.14 -4.06 -0.03 0.00 -1.53 0.00 0.00 36.38 30.61 2r94 s VAL 27 CO 0.08 0.36 1.24 0.27 -3.33 0.00 0.00 175.10 173.72 2r94 s ILE 28 N -1.35 2.47 -0.20 7.04 -4.36 -1.26 -3.31 121.20 120.23 2r94 s ILE 28 Ca 0.41 0.30 -0.16 0.00 -0.26 0.00 0.00 60.65 60.95 2r94 s ILE 28 Cb -0.21 -3.13 -0.04 0.00 1.25 0.00 0.00 42.46 40.33 2r94 s ILE 28 CO 0.25 -0.05 0.38 -0.89 0.24 0.00 0.00 174.94 174.87 2r94 s THR 29 N -1.51 5.21 -0.38 8.37 2.01 -1.26 -4.92 115.64 123.16 2r94 s THR 29 Ca 0.77 0.68 -0.11 0.00 0.31 0.00 0.00 61.69 63.34 2r94 s THR 29 Cb -0.33 -3.71 0.03 0.00 0.01 0.00 0.00 72.50 68.50 2r94 s THR 29 CO 0.36 0.27 0.21 0.42 -0.69 0.00 0.00 174.62 175.19 2r94 s THR 30 N 1.23 4.54 0.19 -0.82 -4.23 -1.26 -4.65 115.64 110.64 2r94 s THR 30 Ca 0.19 -0.91 0.05 0.00 -1.18 0.00 0.00 61.69 59.83 2r94 s THR 30 Cb -0.15 -3.56 -0.04 0.00 1.34 0.00 0.00 72.50 70.10 2r94 s THR 30 CO 0.08 -0.26 0.23 -0.36 -0.54 0.00 0.00 174.62 173.76 2r94 s PHE 31 N 1.54 3.29 -0.15 3.99 0.08 -0.33 -0.96 117.98 125.45 2r94 s PHE 31 Ca 0.02 0.00 -0.03 0.00 0.12 0.00 0.00 56.93 57.04 2r94 s PHE 31 Cb -0.20 -1.55 0.05 0.00 -0.57 0.00 0.00 43.02 40.76 2r94 s PHE 31 CO 0.06 0.51 0.06 1.03 -0.10 0.00 0.00 175.22 176.78 2r94 s ARG 32 N -3.43 0.30 -1.17 0.44 0.52 -0.01 -0.67 118.95 114.93 2r94 s ARG 32 Ca 0.33 -0.11 -0.06 0.00 -0.52 0.00 0.00 55.73 55.38 2r94 s ARG 32 Cb -0.10 -1.64 0.01 0.00 0.52 0.00 0.00 34.95 33.74 2r94 s ARG 32 CO 0.26 -0.57 0.75 0.41 0.02 0.00 0.00 175.30 176.17 2r94 n GLY 33 N 5.19 -0.27 3.04 -3.53 0.00 -1.26 -2.27 105.19 106.09 2r94 n GLY 33 Ca -0.07 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2r94 n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r94 n GLY 34 N -1.57 0.47 3.65 -0.02 0.00 -1.26 -4.99 105.19 101.47 2r94 n GLY 34 Ca -0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 2r94 n GLY 34 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2r94 s ARG 35 N -0.57 2.66 0.32 1.61 0.52 -0.96 -5.06 118.95 117.45 2r94 s ARG 35 Ca 0.00 -0.68 -0.29 0.00 -0.52 0.00 0.00 55.73 54.23 2r94 s ARG 35 Cb 0.00 -2.59 -0.11 0.00 0.52 0.00 0.00 34.95 32.77 2r94 s ARG 35 CO 0.00 0.61 1.57 -1.17 0.02 0.00 0.00 175.30 176.33 2r94 s LEU 36 N -1.58 4.34 -0.43 2.53 2.96 -1.26 -0.83 118.68 124.39 2r94 s LEU 36 Ca 0.19 2.98 0.04 0.00 -0.22 0.00 0.00 54.13 57.12 2r94 s LEU 36 Cb -0.11 -3.64 0.12 0.00 0.50 0.00 0.00 46.19 43.05 2r94 s LEU 36 CO 0.10 -0.91 0.16 -0.62 -1.32 0.00 0.00 176.35 173.76 2r94 s ASP 37 N 0.33 4.47 0.50 3.68 -1.08 -0.13 -4.81 116.67 119.63 2r94 s ASP 37 Ca 0.61 -2.59 0.15 0.00 -0.52 0.00 0.00 52.55 50.20 2r94 s ASP 37 Cb -0.48 -1.59 1.18 0.00 -1.46 0.00 0.00 42.92 40.58 2r94 s ASP 37 CO 0.52 -0.30 2.11 -0.65 0.52 0.00 0.00 175.17 177.36 2r94 h PRO 38 N 7.03 0.03 -0.27 4.34 0.11 -1.94 -2.63 132.00 138.66 2r94 h PRO 38 Ca -0.06 -0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.89 2r94 h PRO 38 Cb 0.95 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.05 2r94 h PRO 38 CO 0.60 0.06 -0.42 0.93 -0.21 0.00 0.00 178.00 178.96 2r94 h GLU 39 N 0.03 0.76 -0.61 1.05 4.39 -1.95 0.12 114.58 118.38 2r94 h GLU 39 Ca 0.01 -0.46 -0.01 0.00 0.34 0.00 0.00 59.36 59.24 2r94 h GLU 39 Cb 0.08 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.74 2r94 h GLU 39 CO 0.00 1.09 0.34 -0.07 -1.16 0.00 0.00 179.01 179.21 2r94 h LEU 40 N 0.51 0.75 0.40 1.33 3.38 -1.90 -1.64 115.31 118.15 2r94 h LEU 40 Ca 0.02 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2r94 h LEU 40 Cb 1.02 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 2r94 h LEU 40 CO 0.10 0.62 -0.24 0.15 0.09 0.00 0.00 178.44 179.16 2r94 h PHE 41 N 0.82 -0.62 -0.95 1.13 3.57 -1.17 -2.06 116.94 117.67 2r94 h PHE 41 Ca 0.22 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.76 2r94 h PHE 41 Cb 0.03 0.22 -0.06 0.00 2.79 0.00 0.00 35.95 38.93 2r94 h PHE 41 CO -0.01 -0.37 0.62 0.00 -2.23 0.00 0.00 178.31 176.32 2r94 h ALA 42 N -0.04 1.42 -0.39 2.41 0.00 -0.69 0.12 119.26 122.10 2r94 h ALA 42 Ca -0.05 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 2r94 h ALA 42 Cb 0.49 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2r94 h ALA 42 CO 0.05 0.46 -0.09 -0.97 0.00 0.00 0.00 179.25 178.71 2r94 h ASN 43 N 1.15 0.65 -0.07 0.00 -0.73 -0.99 0.07 115.58 115.66 2r94 h ASN 43 Ca 0.39 -0.18 -0.09 0.00 1.87 0.00 0.00 56.30 58.30 2r94 h ASN 43 Cb 0.09 -0.17 0.00 0.00 0.27 0.00 0.00 38.32 38.51 2r94 h ASN 43 CO -0.13 0.78 -0.31 -0.74 -0.37 0.00 0.00 177.43 176.65 2r94 h HIS 44 N 0.61 0.44 -0.28 0.67 2.76 -0.58 -1.67 115.15 117.11 2r94 h HIS 44 Ca 0.11 -0.19 0.01 0.00 -2.20 0.00 0.00 60.37 58.10 2r94 h HIS 44 Cb 0.52 -0.07 -0.02 0.00 1.55 0.00 0.00 27.41 29.39 2r94 h HIS 44 CO 0.02 0.93 0.16 0.28 -1.30 0.00 0.00 177.93 178.03 2r94 h VAL 45 N -0.17 1.03 -0.80 5.26 2.07 -0.62 0.08 116.25 123.10 2r94 h VAL 45 Ca -0.02 -0.12 -0.03 0.00 0.82 0.00 0.00 66.70 67.35 2r94 h VAL 45 Cb 0.96 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 2r94 h VAL 45 CO 0.06 0.06 0.37 0.11 0.02 0.00 0.00 177.57 178.19 2r94 h LYS 46 N 0.34 1.17 0.21 1.57 1.79 -0.97 -0.73 116.57 119.94 2r94 h LYS 46 Ca 0.11 -0.18 -0.01 0.00 -2.18 0.00 0.00 60.65 58.38 2r94 h LYS 46 Cb -0.01 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 30.44 2r94 h LYS 46 CO -0.05 0.92 -0.10 -0.97 -1.08 0.00 0.00 179.45 178.17 2r94 h ASN 47 N 1.15 -0.24 -0.10 0.86 -1.24 -0.91 -2.27 115.58 112.82 2r94 h ASN 47 Ca 0.27 -0.21 -0.07 0.00 0.71 0.00 0.00 56.30 57.00 2r94 h ASN 47 Cb 0.15 0.06 -0.02 0.00 0.73 0.00 0.00 38.32 39.25 2r94 h ASN 47 CO -0.03 0.09 -0.15 0.16 -1.29 0.00 0.00 177.43 176.21 2r94 h ILE 48 N -0.60 1.23 0.00 2.57 3.07 -0.90 -1.63 117.51 121.25 2r94 h ILE 48 Ca -0.03 -1.06 -0.03 0.00 1.55 0.00 0.00 64.86 65.30 2r94 h ILE 48 Cb 0.44 1.20 -0.00 0.00 -0.27 0.00 0.00 36.82 38.18 2r94 h ILE 48 CO 0.05 0.34 -0.12 0.71 -1.05 0.00 0.00 178.15 178.08 2r94 h THR 49 N 0.43 0.44 -0.01 0.16 1.35 -1.14 -1.78 112.91 112.37 2r94 h THR 49 Ca 0.08 -0.63 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 2r94 h THR 49 Cb 0.52 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 68.38 2r94 h THR 49 CO 0.03 0.12 -0.05 -1.54 -0.25 0.00 0.00 175.52 173.83 2r94 n SER 50 N -3.46 0.57 -0.34 5.36 3.41 -0.64 -3.59 113.62 114.93 2r94 n SER 50 Ca -0.01 -0.93 0.05 0.00 -0.26 0.00 0.00 58.87 57.72 2r94 n SER 50 Cb 0.28 -0.04 0.11 0.00 -0.26 0.00 0.00 64.21 64.30 2r94 n SER 50 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2r94 n LYS 51 N -0.69 2.64 0.00 4.33 5.02 -0.73 -4.95 118.16 123.78 2r94 n LYS 51 Ca 0.19 -2.06 0.00 0.00 -2.02 0.00 0.00 58.31 54.41 2r94 n LYS 51 Cb 0.24 -1.30 0.00 0.00 -0.02 0.00 0.00 35.03 33.96 2r94 n LYS 51 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2r94 n GLY 52 N -0.37 1.26 3.69 0.72 0.00 -1.14 -3.75 105.19 105.59 2r94 n GLY 52 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 2r94 n GLY 52 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2r94 s VAL 53 N -0.37 4.12 -0.07 1.61 1.01 -0.84 -4.63 120.40 121.22 2r94 s VAL 53 Ca 0.00 1.46 -0.09 0.00 0.00 0.00 0.00 61.98 63.35 2r94 s VAL 53 Cb 0.00 -3.94 -0.29 0.00 0.00 0.00 0.00 36.38 32.15 2r94 s VAL 53 CO 0.00 -0.00 0.57 0.44 0.00 0.00 0.00 175.10 176.11 2r94 h ASP 54 N 7.55 0.54 -4.37 3.32 3.32 -0.98 -3.40 116.42 122.40 2r94 h ASP 54 Ca -0.35 -0.93 -0.44 0.00 0.02 0.00 0.00 57.03 55.34 2r94 h ASP 54 Cb 1.16 -0.18 -0.24 0.00 0.22 0.00 0.00 39.33 40.30 2r94 h ASP 54 CO 0.89 1.80 -0.79 -0.69 -1.72 0.00 0.00 179.24 178.73 2r94 s VAL 55 N -2.57 1.11 -0.19 -1.35 1.01 -1.02 -4.53 120.40 112.86 2r94 s VAL 55 Ca -0.18 -1.09 -0.04 0.00 0.00 0.00 0.00 61.98 60.67 2r94 s VAL 55 Cb 0.06 -1.03 -0.02 0.00 0.00 0.00 0.00 36.38 35.39 2r94 s VAL 55 CO 0.83 -0.06 -0.03 -0.69 0.00 0.00 0.00 175.10 175.14 2r94 s VAL 56 N -0.97 3.67 -0.34 2.92 1.01 -0.05 -0.88 120.40 125.76 2r94 s VAL 56 Ca 0.01 -0.41 -0.09 0.00 0.00 0.00 0.00 61.98 61.49 2r94 s VAL 56 Cb -0.08 -2.65 0.02 0.00 0.00 0.00 0.00 36.38 33.67 2r94 s VAL 56 CO 0.02 0.44 0.15 0.12 0.00 0.00 0.00 175.10 175.82 2r94 s PHE 57 N 1.00 3.22 -0.11 5.22 5.36 0.15 -0.34 117.98 132.48 2r94 s PHE 57 Ca 0.01 -1.02 -0.04 0.00 -0.96 0.00 0.00 56.93 54.92 2r94 s PHE 57 Cb -0.15 -2.35 -0.04 0.00 -0.34 0.00 0.00 43.02 40.15 2r94 s PHE 57 CO 0.01 -0.62 0.04 0.54 -1.46 0.00 0.00 175.22 173.72 2r94 s VAL 58 N 1.51 4.59 -1.06 3.12 0.11 -0.26 -1.26 120.40 127.15 2r94 s VAL 58 Ca 0.02 -0.13 0.00 0.00 -2.93 0.00 0.00 61.98 58.93 2r94 s VAL 58 Cb -0.18 -2.97 0.00 0.00 -1.53 0.00 0.00 36.38 31.69 2r94 s VAL 58 CO 0.05 0.58 0.00 0.00 -3.33 0.00 0.00 175.10 172.40 2r94 n ALA 59 N 2.39 -0.30 -1.00 1.54 0.00 -1.26 -1.42 120.51 120.46 2r94 n ALA 59 Ca -0.19 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.37 2r94 n ALA 59 Cb 0.54 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2r94 n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r94 n GLY 60 N -1.16 -1.15 0.05 0.00 0.00 -1.26 -3.82 105.19 97.85 2r94 n GLY 60 Ca -0.13 -1.56 -0.13 0.00 0.00 0.00 0.00 46.02 44.21 2r94 n GLY 60 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2r94 h THR 61 N -0.16 1.20 -0.54 2.61 2.02 -1.95 0.19 112.91 116.28 2r94 h THR 61 Ca 0.00 -0.64 0.13 0.00 0.77 0.00 0.00 66.41 66.67 2r94 h THR 61 Cb 0.00 1.63 -0.03 0.00 -1.74 0.00 0.00 68.15 68.01 2r94 h THR 61 CO 0.00 0.16 0.38 0.74 0.37 0.00 0.00 175.52 177.17 2r94 h THR 62 N -0.29 0.80 -0.23 3.16 2.02 -1.89 -0.27 112.91 116.20 2r94 h THR 62 Ca -0.00 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.13 2r94 h THR 62 Cb 0.28 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.33 2r94 h THR 62 CO 0.00 0.03 0.00 0.61 0.37 0.00 0.00 175.52 176.53 2r94 n GLY 63 N -1.59 0.22 2.40 2.16 0.00 -0.87 -4.44 105.19 103.06 2r94 n GLY 63 Ca 0.10 -0.26 -0.16 0.00 0.00 0.00 0.00 46.02 45.70 2r94 n GLY 63 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2r94 n LEU 64 N 0.19 -1.36 -0.20 0.99 4.32 -0.11 -4.16 117.00 116.67 2r94 n LEU 64 Ca 0.08 0.24 -0.04 0.00 -0.02 0.00 0.00 56.01 56.28 2r94 n LEU 64 Cb 0.22 -2.32 0.03 0.00 -1.62 0.00 0.00 43.42 39.73 2r94 n LEU 64 CO 0.06 -0.59 0.66 1.23 -1.22 0.00 0.00 177.39 177.53 2r94 h GLY 65 N 0.00 0.07 2.00 -0.72 0.00 -1.08 0.44 103.07 103.78 2r94 h GLY 65 Ca -0.34 0.37 0.00 0.00 0.00 0.00 0.00 47.33 47.35 2r94 h GLY 65 CO 0.46 -0.22 0.00 -2.55 0.00 0.00 0.00 176.54 174.23 2r94 h PRO 66 N -0.12 0.00 -0.01 4.80 0.11 -1.83 -1.86 132.00 133.10 2r94 h PRO 66 Ca 0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.37 2r94 h PRO 66 Cb 0.53 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.64 2r94 h PRO 66 CO -0.67 0.00 -0.20 0.00 -0.21 0.00 0.00 178.00 176.91 2r94 n ALA 67 N -1.82 2.97 -2.86 -0.75 0.00 0.15 -4.95 120.51 113.26 2r94 n ALA 67 Ca -0.01 -0.39 -0.37 0.00 0.00 0.00 0.00 53.44 52.67 2r94 n ALA 67 Cb 0.07 -1.16 -0.06 0.00 0.00 0.00 0.00 19.45 18.29 2r94 n ALA 67 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2r94 s LEU 68 N -2.43 4.30 0.91 0.00 1.43 -0.70 -5.10 118.68 117.09 2r94 s LEU 68 Ca 0.27 0.43 -0.11 0.00 -1.03 0.00 0.00 54.13 53.69 2r94 s LEU 68 Cb 0.20 -2.04 0.14 0.00 0.03 0.00 0.00 46.19 44.51 2r94 s LEU 68 CO 0.49 0.40 1.09 -0.94 0.23 0.00 0.00 176.35 177.62 2r94 s SER 69 N -1.00 3.29 0.15 2.29 1.04 -1.26 -4.83 113.70 113.38 2r94 s SER 69 Ca 0.15 1.58 -0.21 0.00 0.48 0.00 0.00 55.95 57.95 2r94 s SER 69 Cb -0.12 -2.25 0.04 0.00 0.10 0.00 0.00 66.02 63.79 2r94 s SER 69 CO 0.04 -2.77 1.65 0.25 0.98 0.00 0.00 173.24 173.38 2r94 h LEU 70 N -1.64 -0.61 -0.54 2.42 5.85 -1.98 0.34 115.31 119.15 2r94 h LEU 70 Ca -0.49 0.12 0.11 0.00 0.84 0.00 0.00 57.88 58.46 2r94 h LEU 70 Cb 1.28 0.31 -0.10 0.00 0.37 0.00 0.00 40.66 42.52 2r94 h LEU 70 CO 0.53 -0.23 -0.06 -0.61 -0.34 0.00 0.00 178.44 177.73 2r94 h GLN 71 N -0.18 0.06 -0.08 1.25 4.15 -1.99 0.07 115.11 118.40 2r94 h GLN 71 Ca 0.14 -0.00 -0.09 0.00 0.77 0.00 0.00 58.65 59.47 2r94 h GLN 71 Cb 0.39 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.06 2r94 h GLN 71 CO -0.36 0.04 -0.38 0.93 -1.93 0.00 0.00 178.83 177.13 2r94 h GLU 72 N 0.06 0.16 -0.08 1.69 5.08 -1.72 -1.53 114.58 118.24 2r94 h GLU 72 Ca 0.27 -0.07 -0.16 0.00 -1.00 0.00 0.00 59.36 58.41 2r94 h GLU 72 Cb 0.42 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 2r94 h GLU 72 CO -0.51 0.52 -0.64 0.87 -1.00 0.00 0.00 179.01 178.25 2r94 h LYS 73 N 0.14 0.31 -0.61 2.33 1.57 0.40 -1.00 116.57 119.70 2r94 h LYS 73 Ca 0.01 -0.22 -0.09 0.00 -1.87 0.00 0.00 60.65 58.48 2r94 h LYS 73 Cb 0.73 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.06 2r94 h LYS 73 CO 0.06 0.84 0.02 0.52 -0.57 0.00 0.00 179.45 180.32 2r94 h MET 74 N 0.22 1.06 -0.20 3.15 2.86 -0.70 0.13 114.93 121.45 2r94 h MET 74 Ca -0.01 -0.32 -0.10 0.00 -2.06 0.00 0.00 59.70 57.21 2r94 h MET 74 Cb 1.17 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.71 2r94 h MET 74 CO 0.10 1.02 -0.29 0.93 1.06 0.00 0.00 176.91 179.73 2r94 h GLU 75 N 0.97 0.39 -0.08 1.72 5.08 -0.99 -1.05 114.58 120.62 2r94 h GLU 75 Ca 0.18 -0.15 -0.20 0.00 -1.00 0.00 0.00 59.36 58.19 2r94 h GLU 75 Cb 0.52 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.77 2r94 h GLU 75 CO 0.03 0.65 -0.72 1.25 -1.00 0.00 0.00 179.01 179.22 2r94 h LEU 76 N 0.34 0.77 -0.48 1.33 5.85 -1.03 0.13 115.31 122.22 2r94 h LEU 76 Ca 0.05 -0.68 0.06 0.00 0.84 0.00 0.00 57.88 58.16 2r94 h LEU 76 Cb 0.69 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 2r94 h LEU 76 CO 0.05 1.33 0.17 0.74 -0.34 0.00 0.00 178.44 180.40 2r94 h THR 77 N 0.27 0.84 0.14 1.05 2.02 -0.35 0.21 112.91 117.10 2r94 h THR 77 Ca -0.07 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.00 2r94 h THR 77 Cb 1.37 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 68.22 2r94 h THR 77 CO 0.15 0.06 -0.15 0.44 0.37 0.00 0.00 175.52 176.39 2r94 h ASP 78 N 0.35 -0.39 -0.24 4.18 3.32 -1.06 0.93 116.42 123.52 2r94 h ASP 78 Ca 0.23 0.04 -0.11 0.00 0.02 0.00 0.00 57.03 57.21 2r94 h ASP 78 Cb 0.24 0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 2r94 h ASP 78 CO -0.23 -0.22 -0.21 0.00 -1.72 0.00 0.00 179.24 176.85 2r94 h ALA 79 N 0.50 0.96 -0.27 3.45 0.00 -0.22 -1.40 119.26 122.28 2r94 h ALA 79 Ca 0.00 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 54.43 2r94 h ALA 79 Cb 0.31 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2r94 h ALA 79 CO -0.04 0.61 -0.35 0.00 0.00 0.00 0.00 179.25 179.47 2r94 h ALA 80 N 1.16 0.41 0.00 0.00 0.00 -0.32 -1.91 119.26 118.59 2r94 h ALA 80 Ca 0.09 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.52 2r94 h ALA 80 Cb 0.69 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2r94 h ALA 80 CO 0.05 0.47 -0.24 1.79 0.00 0.00 0.00 179.25 181.32 2r94 h THR 81 N 0.45 0.63 0.00 0.00 1.35 -0.66 -0.85 112.91 113.82 2r94 h THR 81 Ca 0.03 -1.12 -0.10 0.00 -0.55 0.00 0.00 66.41 64.67 2r94 h THR 81 Cb 0.93 1.74 -0.01 0.00 -1.73 0.00 0.00 68.15 69.08 2r94 h THR 81 CO 0.08 0.24 -0.47 -1.28 -0.25 0.00 0.00 175.52 173.84 2r94 h SER 82 N 0.00 0.00 -0.00 5.36 0.87 -1.18 -3.34 113.55 115.26 2r94 h SER 82 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2r94 h SER 82 Cb 0.72 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.68 2r94 h SER 82 CO 0.03 0.47 -0.78 0.00 -0.53 0.00 0.00 176.83 176.02 2r94 n ALA 83 N -2.23 4.24 -3.11 6.23 0.00 -0.72 -4.99 120.51 119.92 2r94 n ALA 83 Ca 0.02 -0.56 -0.12 0.00 0.00 0.00 0.00 53.44 52.78 2r94 n ALA 83 Cb 0.70 -0.70 -0.09 0.00 0.00 0.00 0.00 19.45 19.35 2r94 n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2r94 s ALA 84 N -2.68 -0.50 0.03 0.00 0.00 -0.38 -4.51 121.76 113.72 2r94 s ALA 84 Ca 0.10 0.01 -0.08 0.00 0.00 0.00 0.00 51.96 51.98 2r94 s ALA 84 Cb 0.15 0.13 -0.31 0.00 0.00 0.00 0.00 23.12 23.09 2r94 s ALA 84 CO 0.72 -0.26 0.98 -0.09 0.00 0.00 0.00 175.76 177.11 2r94 h ARG 85 N 3.97 0.36 -4.95 0.00 9.65 -1.85 -3.42 114.38 118.14 2r94 h ARG 85 Ca -0.31 -0.62 -0.65 0.00 -1.10 0.00 0.00 59.98 57.30 2r94 h ARG 85 Cb 1.19 0.23 -0.35 0.00 -1.39 0.00 0.00 29.97 29.65 2r94 h ARG 85 CO 0.42 1.27 -0.85 1.03 2.80 0.00 0.00 179.97 184.64 2r94 s ARG 86 N -2.62 2.79 -0.01 0.20 0.52 -1.26 -4.90 118.95 113.67 2r94 s ARG 86 Ca -0.08 -0.75 0.00 0.00 -0.52 0.00 0.00 55.73 54.38 2r94 s ARG 86 Cb 0.06 -2.43 0.01 0.00 0.52 0.00 0.00 34.95 33.11 2r94 s ARG 86 CO 0.89 -0.21 0.01 0.08 0.02 0.00 0.00 175.30 176.09 2r94 s VAL 87 N 1.32 0.03 -0.11 3.52 1.01 -1.26 -0.88 120.40 124.04 2r94 s VAL 87 Ca 0.04 0.07 0.02 0.00 0.00 0.00 0.00 61.98 62.12 2r94 s VAL 87 Cb -0.13 -0.10 -0.01 0.00 0.00 0.00 0.00 36.38 36.15 2r94 s VAL 87 CO -0.12 0.06 -0.20 -0.63 0.00 0.00 0.00 175.10 174.21 2r94 s ILE 88 N 0.50 2.45 -0.12 2.22 1.01 0.54 -0.78 121.20 127.03 2r94 s ILE 88 Ca -0.04 -0.88 -0.01 0.00 0.00 0.00 0.00 60.65 59.71 2r94 s ILE 88 Cb -0.07 -1.98 -0.03 0.00 0.01 0.00 0.00 42.46 40.40 2r94 s ILE 88 CO -0.01 0.55 -0.07 -0.69 0.00 0.00 0.00 174.94 174.71 2r94 s VAL 89 N 0.32 3.61 -0.18 2.92 1.01 -0.83 -1.11 120.40 126.14 2r94 s VAL 89 Ca -0.15 -0.48 -0.20 0.00 0.00 0.00 0.00 61.98 61.15 2r94 s VAL 89 Cb -0.17 -2.53 -0.03 0.00 0.00 0.00 0.00 36.38 33.65 2r94 s VAL 89 CO 0.08 0.54 0.58 -1.58 0.00 0.00 0.00 175.10 174.71 2r94 s GLN 90 N -0.05 4.23 0.00 2.72 -0.44 -0.51 -0.74 119.66 124.87 2r94 s GLN 90 Ca -0.00 0.54 0.07 0.00 -2.50 0.00 0.00 55.36 53.47 2r94 s GLN 90 Cb -0.13 -3.55 0.06 0.00 -1.64 0.00 0.00 33.01 27.75 2r94 s GLN 90 CO 0.03 -0.15 0.75 1.33 0.50 0.00 0.00 175.29 177.75 2r94 n VAL 91 N 4.49 0.08 -1.68 1.34 0.24 -0.16 -4.77 118.33 117.88 2r94 n VAL 91 Ca -0.03 -0.54 -0.42 0.00 -2.04 0.00 0.00 64.34 61.31 2r94 n VAL 91 Cb 0.50 1.09 0.00 0.00 -1.47 0.00 0.00 33.84 33.97 2r94 n VAL 91 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2r94 n ALA 92 N 0.37 1.02 -3.30 2.33 0.00 -1.26 -4.15 120.51 115.51 2r94 n ALA 92 Ca 0.04 0.31 -0.14 0.00 0.00 0.00 0.00 53.44 53.65 2r94 n ALA 92 Cb 0.19 -2.22 -0.07 0.00 0.00 0.00 0.00 19.45 17.36 2r94 n ALA 92 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2r94 s SER 93 N -0.47 -0.39 0.00 0.00 0.15 -1.26 -4.83 113.70 106.90 2r94 s SER 93 Ca 0.59 0.24 0.26 0.00 0.70 0.00 0.00 55.95 57.74 2r94 s SER 93 Cb -0.56 0.44 1.30 0.00 -1.71 0.00 0.00 66.02 65.49 2r94 s SER 93 CO 0.60 -0.61 1.87 0.18 1.20 0.00 0.00 173.24 176.47 2r94 n LEU 94 N 0.76 0.73 -4.27 3.45 4.77 -1.26 -4.07 117.00 117.12 2r94 n LEU 94 Ca -0.19 -0.27 -0.36 0.00 -0.03 0.00 0.00 56.01 55.15 2r94 n LEU 94 Cb 0.58 -0.02 -0.13 0.00 -2.33 0.00 0.00 43.42 41.52 2r94 n LEU 94 CO 0.21 0.13 -0.31 0.21 -1.33 0.00 0.00 177.39 176.31 2r94 s ASN 95 N -1.84 5.00 0.38 -1.43 3.84 -1.26 -5.00 114.94 114.62 2r94 s ASN 95 Ca 0.38 -0.97 0.13 0.00 0.21 0.00 0.00 52.86 52.61 2r94 s ASN 95 Cb 0.19 -1.81 0.75 0.00 -0.55 0.00 0.00 41.25 39.84 2r94 s ASN 95 CO 0.31 -0.23 1.85 0.00 -2.79 0.00 0.00 177.10 176.23 2r94 h ALA 96 N 8.15 1.42 -0.48 1.71 0.00 -2.00 -1.86 119.26 126.20 2r94 h ALA 96 Ca -0.27 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.32 2r94 h ALA 96 Cb 1.10 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2r94 h ALA 96 CO 0.59 0.44 0.31 -0.44 0.00 0.00 0.00 179.25 180.14 2r94 h ASP 97 N 0.00 0.56 0.04 0.00 3.32 -1.94 -1.42 116.42 116.98 2r94 h ASP 97 Ca -0.00 -0.02 -0.15 0.00 0.02 0.00 0.00 57.03 56.88 2r94 h ASP 97 Cb 0.62 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 2r94 h ASP 97 CO 0.05 0.41 -0.51 -0.33 -1.72 0.00 0.00 179.24 177.13 2r94 h GLU 98 N 0.66 0.53 -0.32 3.56 5.08 -1.72 -0.09 114.58 122.27 2r94 h GLU 98 Ca 0.18 -0.32 -0.05 0.00 -1.00 0.00 0.00 59.36 58.17 2r94 h GLU 98 Cb -0.06 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2r94 h GLU 98 CO -0.04 0.92 -0.00 0.00 -1.00 0.00 0.00 179.01 178.88 2r94 h ALA 99 N 1.03 0.43 -0.04 3.43 0.00 -1.26 -0.57 119.26 122.27 2r94 h ALA 99 Ca 0.02 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.69 2r94 h ALA 99 Cb 1.04 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 2r94 h ALA 99 CO 0.10 0.19 -0.00 0.82 0.00 0.00 0.00 179.25 180.35 2r94 h ILE 100 N 0.37 0.97 -0.17 0.00 2.04 -1.19 0.51 117.51 120.03 2r94 h ILE 100 Ca 0.09 -0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.96 2r94 h ILE 100 Cb 0.45 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 37.47 2r94 h ILE 100 CO 0.02 0.00 0.07 0.00 0.00 0.00 0.00 178.15 178.24 2r94 h ALA 101 N 1.04 0.20 -0.53 1.87 0.00 -0.94 -1.75 119.26 119.14 2r94 h ALA 101 Ca 0.02 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2r94 h ALA 101 Cb 0.03 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2r94 h ALA 101 CO -0.04 -0.35 0.23 1.25 0.00 0.00 0.00 179.25 180.34 2r94 h LEU 102 N 0.17 0.69 -0.91 0.00 5.85 -1.00 -1.33 115.31 118.78 2r94 h LEU 102 Ca 0.07 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.71 2r94 h LEU 102 Cb 0.03 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 40.84 2r94 h LEU 102 CO -0.06 0.61 0.56 0.00 -0.34 0.00 0.00 178.44 179.20 2r94 h ALA 103 N 1.50 1.16 -0.40 1.25 0.00 -0.19 0.57 119.26 123.15 2r94 h ALA 103 Ca 0.18 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 2r94 h ALA 103 Cb 0.13 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2r94 h ALA 103 CO -0.02 0.61 -0.27 0.87 0.00 0.00 0.00 179.25 180.44 2r94 h LYS 104 N 1.25 0.84 -0.37 0.00 1.57 -0.73 -1.33 116.57 117.81 2r94 h LYS 104 Ca 0.33 -0.37 -0.12 0.00 -1.87 0.00 0.00 60.65 58.61 2r94 h LYS 104 Cb -0.06 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 2r94 h LYS 104 CO -0.06 1.01 -0.26 -0.92 -0.57 0.00 0.00 179.45 178.65 2r94 h TYR 105 N 0.72 0.97 -0.58 -1.35 3.20 -1.01 -0.70 116.97 118.22 2r94 h TYR 105 Ca 0.09 -0.26 -0.07 0.00 3.14 0.00 0.00 58.73 61.62 2r94 h TYR 105 Cb 0.81 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.84 2r94 h TYR 105 CO 0.05 1.04 0.09 0.00 -1.64 0.00 0.00 178.16 177.69 2r94 h ALA 106 N 0.78 0.78 -0.11 1.82 0.00 -0.71 -0.08 119.26 121.73 2r94 h ALA 106 Ca 0.07 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2r94 h ALA 106 Cb 0.83 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2r94 h ALA 106 CO 0.07 0.53 0.07 1.49 0.00 0.00 0.00 179.25 181.41 2r94 h GLU 107 N 0.87 0.14 -0.62 0.00 4.81 -1.01 -1.21 114.58 117.56 2r94 h GLU 107 Ca 0.18 -0.01 0.12 0.00 -0.13 0.00 0.00 59.36 59.52 2r94 h GLU 107 Cb 0.43 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.74 2r94 h GLU 107 CO 0.01 0.10 0.42 0.66 -0.73 0.00 0.00 179.01 179.47 2r94 h SER 108 N 0.14 0.31 -0.13 1.04 4.64 -0.79 0.13 113.55 118.88 2r94 h SER 108 Ca 0.04 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2r94 h SER 108 Cb -0.01 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 2r94 h SER 108 CO -0.01 0.18 0.00 0.54 -0.87 0.00 0.00 176.83 176.67 2r94 n ARG 109 N -4.46 1.37 -0.66 4.77 5.12 -0.07 -4.92 116.66 117.81 2r94 n ARG 109 Ca 0.11 -0.57 0.00 0.00 -1.93 0.00 0.00 57.85 55.46 2r94 n ARG 109 Cb 0.45 -1.21 0.00 0.00 -1.16 0.00 0.00 32.46 30.54 2r94 n ARG 109 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2r94 n GLY 110 N 0.84 0.64 3.68 -0.13 0.00 0.44 -4.88 105.19 105.78 2r94 n GLY 110 Ca 0.09 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 2r94 n GLY 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r94 n ALA 111 N -0.02 1.11 0.57 4.61 0.00 -0.50 -4.82 120.51 121.48 2r94 n ALA 111 Ca 0.00 0.32 0.13 0.00 0.00 0.00 0.00 53.44 53.89 2r94 n ALA 111 Cb 0.00 -2.23 0.38 0.00 0.00 0.00 0.00 19.45 17.60 2r94 n ALA 111 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2r94 h GLU 112 N 2.30 0.00 -2.24 0.00 4.11 -1.30 -3.44 114.58 114.01 2r94 h GLU 112 Ca -0.46 0.00 0.14 0.00 0.07 0.00 0.00 59.36 59.11 2r94 h GLU 112 Cb 1.29 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.41 2r94 h GLU 112 CO 0.61 0.00 0.51 0.00 0.07 0.00 0.00 179.01 180.21 2r94 s ALA 113 N -3.12 -1.80 0.05 1.06 0.00 -1.25 -4.17 121.76 112.53 2r94 s ALA 113 Ca 0.10 0.80 0.07 0.00 0.00 0.00 0.00 51.96 52.93 2r94 s ALA 113 Cb 0.11 0.45 -0.03 0.00 0.00 0.00 0.00 23.12 23.65 2r94 s ALA 113 CO 0.60 -0.79 -0.17 0.14 0.00 0.00 0.00 175.76 175.54 2r94 s VAL 114 N -3.11 2.88 0.26 0.00 -7.23 -0.69 -1.97 120.40 110.54 2r94 s VAL 114 Ca 0.07 -1.18 0.11 0.00 -1.81 0.00 0.00 61.98 59.17 2r94 s VAL 114 Cb -0.01 -2.23 -0.05 0.00 0.56 0.00 0.00 36.38 34.65 2r94 s VAL 114 CO -0.06 0.31 -0.15 0.00 -0.31 0.00 0.00 175.10 174.90 2r94 s ALA 115 N -0.96 2.84 -0.10 1.32 0.00 0.08 0.12 121.76 125.06 2r94 s ALA 115 Ca 0.15 -1.76 -0.09 0.00 0.00 0.00 0.00 51.96 50.26 2r94 s ALA 115 Cb -0.11 -0.43 0.03 0.00 0.00 0.00 0.00 23.12 22.61 2r94 s ALA 115 CO 0.06 0.31 0.27 0.45 0.00 0.00 0.00 175.76 176.85 2r94 s SER 116 N -3.39 -0.29 0.63 0.00 0.15 -0.48 -0.98 113.70 109.35 2r94 s SER 116 Ca 0.29 0.55 -0.17 0.00 0.70 0.00 0.00 55.95 57.31 2r94 s SER 116 Cb -0.06 0.54 -0.01 0.00 -1.71 0.00 0.00 66.02 64.78 2r94 s SER 116 CO 0.16 -0.10 1.19 -0.76 1.20 0.00 0.00 173.24 174.92 2r94 s LEU 117 N 0.27 3.55 0.95 3.45 1.43 -1.25 -0.54 118.68 126.53 2r94 s LEU 117 Ca -0.01 2.32 -0.12 0.00 -1.03 0.00 0.00 54.13 55.29 2r94 s LEU 117 Cb -0.03 -4.59 0.16 0.00 0.03 0.00 0.00 46.19 41.76 2r94 s LEU 117 CO -0.01 -1.74 1.09 -2.84 0.23 0.00 0.00 176.35 173.08 2r94 s PRO 118 N -3.58 0.81 0.14 1.29 0.02 -1.25 -4.81 135.00 127.62 2r94 s PRO 118 Ca 0.75 0.92 -0.34 0.00 0.02 0.00 0.00 61.00 62.35 2r94 s PRO 118 Cb -0.28 -1.75 -0.16 0.00 0.02 0.00 0.00 34.50 32.33 2r94 s PRO 118 CO 0.37 -2.58 1.27 -2.30 -0.33 0.00 0.00 177.00 173.43 2r94 n PRO 119 N -4.13 1.26 -3.82 5.54 -0.02 -1.26 -4.95 135.00 127.62 2r94 n PRO 119 Ca 0.07 0.45 -0.22 0.00 -2.02 0.00 0.00 63.50 61.78 2r94 n PRO 119 Cb 0.55 -2.03 -0.04 0.00 -0.02 0.00 0.00 33.50 31.95 2r94 n PRO 119 CO 0.00 0.00 0.00 2.48 1.98 0.00 0.00 175.50 179.96 2r94 n TYR 120 N 2.02 0.72 0.00 6.00 0.18 -1.26 -4.84 117.16 119.98 2r94 n TYR 120 Ca 0.16 -1.74 0.00 0.00 1.88 0.00 0.00 57.90 58.20 2r94 n TYR 120 Cb 0.23 -0.24 0.00 0.00 -0.38 0.00 0.00 39.34 38.95 2r94 n TYR 120 CO 0.00 0.00 0.00 0.98 -2.08 0.00 0.00 176.86 175.76 2r94 n TYR 121 N -0.92 0.00 -2.08 -3.48 9.36 -1.23 -4.86 117.16 113.96 2r94 n TYR 121 Ca -0.14 0.00 -0.43 0.00 3.32 0.00 0.00 57.90 60.65 2r94 n TYR 121 Cb 0.45 0.00 -0.03 0.00 -0.63 0.00 0.00 39.34 39.13 2r94 n TYR 121 CO 0.00 0.00 0.00 -0.06 0.22 0.00 0.00 176.86 177.02 2r94 s PHE 122 N 0.00 2.00 0.57 2.98 0.08 -1.26 -4.95 117.98 117.40 2r94 s PHE 122 Ca 0.00 0.56 -0.18 0.00 0.12 0.00 0.00 56.93 57.43 2r94 s PHE 122 Cb 0.00 -4.05 -0.04 0.00 -0.57 0.00 0.00 43.02 38.36 2r94 s PHE 122 CO 0.00 -2.95 1.11 -2.14 -0.10 0.00 0.00 175.22 171.13 2r94 s PRO 123 N 5.01 3.24 -1.26 0.24 0.02 -1.26 -4.16 135.00 136.84 2r94 s PRO 123 Ca 0.74 1.48 -0.10 0.00 0.02 0.00 0.00 61.00 63.14 2r94 s PRO 123 Cb -0.24 -2.00 -0.01 0.00 0.02 0.00 0.00 34.50 32.27 2r94 s PRO 123 CO 0.31 -0.91 0.65 0.54 -0.33 0.00 0.00 177.00 177.26 2r94 n ARG 124 N -1.65 -2.63 -1.65 5.54 1.74 -1.26 -4.99 116.66 111.75 2r94 n ARG 124 Ca 0.11 0.48 -0.31 0.00 -0.77 0.00 0.00 57.85 57.35 2r94 n ARG 124 Cb 0.52 -4.49 0.04 0.00 -1.02 0.00 0.00 32.46 27.51 2r94 n ARG 124 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2r94 s LEU 125 N -6.66 3.16 0.53 0.55 1.43 -1.26 -5.05 118.68 111.39 2r94 s LEU 125 Ca 0.23 1.57 -0.15 0.00 -1.03 0.00 0.00 54.13 54.75 2r94 s LEU 125 Cb -0.08 -4.49 -0.07 0.00 0.03 0.00 0.00 46.19 41.58 2r94 s LEU 125 CO 0.86 -1.29 0.98 -0.94 0.23 0.00 0.00 176.35 176.19 2r94 s SER 126 N -3.88 6.52 0.28 2.29 1.04 -1.26 -4.92 113.70 113.78 2r94 s SER 126 Ca 0.57 1.51 0.01 0.00 0.48 0.00 0.00 55.95 58.52 2r94 s SER 126 Cb -0.13 -2.49 0.53 0.00 0.10 0.00 0.00 66.02 64.03 2r94 s SER 126 CO 0.54 -0.65 1.85 -0.33 0.98 0.00 0.00 173.24 175.64 2r94 h GLU 127 N 0.62 1.00 -0.78 4.02 4.39 -1.99 -1.01 114.58 120.83 2r94 h GLU 127 Ca -0.46 -0.06 0.05 0.00 0.34 0.00 0.00 59.36 59.23 2r94 h GLU 127 Cb 1.19 -0.23 -0.05 0.00 -0.10 0.00 0.00 28.75 29.56 2r94 h GLU 127 CO 0.62 0.66 0.48 -0.09 -1.16 0.00 0.00 179.01 179.52 2r94 h ARG 128 N 1.03 0.88 -0.29 2.33 2.43 -1.99 -0.36 114.38 118.42 2r94 h ARG 128 Ca 0.48 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.57 2r94 h ARG 128 Cb 0.41 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 2r94 h ARG 128 CO -0.24 0.58 0.08 1.96 -1.51 0.00 0.00 179.97 180.84 2r94 h GLN 129 N 0.91 0.46 -0.78 0.20 4.20 -1.60 -0.28 115.11 118.21 2r94 h GLN 129 Ca 0.33 -0.11 -0.00 0.00 0.06 0.00 0.00 58.65 58.93 2r94 h GLN 129 Cb 0.10 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.78 2r94 h GLN 129 CO -0.15 0.53 0.48 0.82 -0.67 0.00 0.00 178.83 179.84 2r94 h ILE 130 N 0.31 1.22 -0.11 2.54 2.04 -1.07 -1.61 117.51 120.83 2r94 h ILE 130 Ca 0.09 -0.46 -0.02 0.00 1.00 0.00 0.00 64.86 65.47 2r94 h ILE 130 Cb 0.27 0.12 -0.00 0.00 -0.74 0.00 0.00 36.82 36.47 2r94 h ILE 130 CO -0.00 0.22 0.00 0.00 0.00 0.00 0.00 178.15 178.37 2r94 h ALA 131 N 1.26 0.14 -0.46 1.87 0.00 -0.98 -2.66 119.26 118.43 2r94 h ALA 131 Ca 0.28 -0.18 0.09 0.00 0.00 0.00 0.00 54.91 55.10 2r94 h ALA 131 Cb -0.05 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 17.62 2r94 h ALA 131 CO -0.05 -0.17 -0.01 -0.22 0.00 0.00 0.00 179.25 178.79 2r94 h LYS 132 N -0.08 0.10 -0.39 0.00 3.64 -0.95 -1.64 116.57 117.25 2r94 h LYS 132 Ca 0.03 -0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.49 2r94 h LYS 132 Cb 0.35 -0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 32.06 2r94 h LYS 132 CO 0.01 0.07 -0.26 -0.92 -2.27 0.00 0.00 179.45 176.07 2r94 h TYR 133 N 0.10 -0.70 -0.17 1.91 3.20 -1.01 0.12 116.97 120.42 2r94 h TYR 133 Ca 0.23 0.05 -0.16 0.00 3.14 0.00 0.00 58.73 61.99 2r94 h TYR 133 Cb 0.34 0.37 -0.01 0.00 1.54 0.00 0.00 36.73 38.97 2r94 h TYR 133 CO -0.30 -0.34 -0.55 0.74 -1.64 0.00 0.00 178.16 176.07 2r94 h PHE 134 N -0.20 0.62 -0.09 -3.82 0.04 -1.15 -2.62 116.94 109.72 2r94 h PHE 134 Ca 0.18 -0.22 -0.19 0.00 2.80 0.00 0.00 57.97 60.55 2r94 h PHE 134 Cb 0.49 -0.12 -0.00 0.00 2.20 0.00 0.00 35.95 38.52 2r94 h PHE 134 CO -0.48 0.93 -0.72 0.00 -0.60 0.00 0.00 178.31 177.44 2r94 h ARG 135 N 0.38 0.45 -0.74 1.51 3.08 -0.92 -1.04 114.38 117.10 2r94 h ARG 135 Ca 0.01 -0.36 -0.03 0.00 0.07 0.00 0.00 59.98 59.66 2r94 h ARG 135 Cb 1.08 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 31.17 2r94 h ARG 135 CO 0.10 0.99 0.33 -0.44 -1.07 0.00 0.00 179.97 179.89 2r94 h ASP 136 N 0.31 0.98 -0.28 7.04 5.19 -0.91 -0.56 116.42 128.19 2r94 h ASP 136 Ca -0.03 -0.12 -0.02 0.00 -0.62 0.00 0.00 57.03 56.24 2r94 h ASP 136 Cb 1.30 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 40.54 2r94 h ASP 136 CO 0.13 0.84 0.12 -0.07 -3.12 0.00 0.00 179.24 177.13 2r94 h LEU 137 N 1.06 0.39 -0.72 1.55 3.38 -1.06 -2.59 115.31 117.32 2r94 h LEU 137 Ca 0.25 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2r94 h LEU 137 Cb 0.14 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 2r94 h LEU 137 CO -0.03 0.44 0.45 0.00 0.09 0.00 0.00 178.44 179.40 2r94 h SER 139 N 0.98 0.00 1.38 0.00 0.02 -1.07 -3.17 113.55 111.68 2r94 h SER 139 Ca 0.26 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.19 2r94 h SER 139 Cb -0.07 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.47 2r94 h SER 139 CO -0.05 0.02 -0.63 0.00 -1.14 0.00 0.00 176.83 175.03 2r94 h ALA 140 N 1.98 0.71 -2.43 3.77 0.00 -0.84 -3.47 119.26 118.98 2r94 h ALA 140 Ca -0.00 -0.10 -0.18 0.00 0.00 0.00 0.00 54.91 54.63 2r94 h ALA 140 Cb 0.18 0.02 -0.15 0.00 0.00 0.00 0.00 17.79 17.84 2r94 h ALA 140 CO 0.00 0.12 -0.64 0.14 0.00 0.00 0.00 179.25 178.87 2r94 s VAL 141 N -3.24 0.11 -0.13 0.00 -7.23 -1.20 -4.76 120.40 103.94 2r94 s VAL 141 Ca 0.02 -1.89 0.19 0.00 -1.81 0.00 0.00 61.98 58.49 2r94 s VAL 141 Cb 0.08 -2.01 -0.28 0.00 0.56 0.00 0.00 36.38 34.72 2r94 s VAL 141 CO 0.74 -0.48 0.46 -1.20 -0.31 0.00 0.00 175.10 174.31 2r94 n SER 142 N -0.09 0.75 -4.81 4.85 7.64 -1.26 -4.88 113.62 115.82 2r94 n SER 142 Ca -0.06 -0.12 -0.32 0.00 1.01 0.00 0.00 58.87 59.38 2r94 n SER 142 Cb 0.64 1.74 0.03 0.00 -1.01 0.00 0.00 64.21 65.61 2r94 n SER 142 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2r94 s ILE 143 N -3.22 3.90 0.43 0.44 -4.36 -1.26 -4.98 121.20 112.16 2r94 s ILE 143 Ca -0.05 0.74 -0.24 0.00 -0.26 0.00 0.00 60.65 60.85 2r94 s ILE 143 Cb 0.12 -3.37 -0.10 0.00 1.25 0.00 0.00 42.46 40.36 2r94 s ILE 143 CO 0.77 -0.68 0.98 -2.65 0.24 0.00 0.00 174.94 173.60 2r94 n PRO 144 N -2.64 1.28 -4.08 0.37 -0.02 -1.26 -4.81 135.00 123.85 2r94 n PRO 144 Ca 0.08 0.46 -0.35 0.00 -2.02 0.00 0.00 63.50 61.68 2r94 n PRO 144 Cb 0.53 -2.03 -0.12 0.00 -0.02 0.00 0.00 33.50 31.87 2r94 n PRO 144 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2r94 s VAL 145 N -1.30 4.22 0.00 -1.45 1.01 -1.26 -1.71 120.40 119.91 2r94 s VAL 145 Ca 0.64 -0.23 -0.06 0.00 0.00 0.00 0.00 61.98 62.33 2r94 s VAL 145 Cb -0.55 -2.91 -0.05 0.00 0.00 0.00 0.00 36.38 32.88 2r94 s VAL 145 CO 0.56 0.43 0.26 -0.36 0.00 0.00 0.00 175.10 175.99 2r94 s PHE 146 N 0.80 3.58 -0.05 5.22 0.40 0.12 -1.66 117.98 126.38 2r94 s PHE 146 Ca 0.01 0.56 -0.26 0.00 -0.60 0.00 0.00 56.93 56.64 2r94 s PHE 146 Cb -0.14 -1.98 -0.03 0.00 0.51 0.00 0.00 43.02 41.38 2r94 s PHE 146 CO 0.02 0.62 0.81 -1.17 0.70 0.00 0.00 175.22 176.20 2r94 s LEU 147 N -1.73 4.32 -0.41 -0.37 2.96 -0.02 -1.38 118.68 122.05 2r94 s LEU 147 Ca 0.27 1.35 -0.05 0.00 -0.22 0.00 0.00 54.13 55.48 2r94 s LEU 147 Cb -0.13 -3.27 0.10 0.00 0.50 0.00 0.00 46.19 43.39 2r94 s LEU 147 CO 0.16 -0.19 0.22 -0.47 -1.32 0.00 0.00 176.35 174.74 2r94 s TYR 148 N 1.01 3.50 -0.16 5.38 5.04 0.30 -0.06 117.35 132.35 2r94 s TYR 148 Ca 0.43 -2.15 -0.13 0.00 -2.44 0.00 0.00 57.07 52.77 2r94 s TYR 148 Cb -0.19 -3.13 -0.05 0.00 0.35 0.00 0.00 41.96 38.95 2r94 s TYR 148 CO 0.21 -0.94 0.28 1.21 -1.34 0.00 0.00 175.55 174.96 2r94 s ASN 149 N 1.95 6.42 -0.48 4.32 2.47 0.16 -3.86 114.94 125.92 2r94 s ASN 149 Ca 0.06 0.48 0.06 0.00 0.42 0.00 0.00 52.86 53.89 2r94 s ASN 149 Cb -0.23 -2.17 0.22 0.00 -1.45 0.00 0.00 41.25 37.61 2r94 s ASN 149 CO -0.02 0.11 0.71 0.00 -3.72 0.00 0.00 177.10 174.18 2r94 n TYR 150 N 3.55 -2.79 -0.08 0.43 4.19 -1.26 -0.41 117.16 120.79 2r94 n TYR 150 Ca -0.12 -2.07 0.08 0.00 3.31 0.00 0.00 57.90 59.09 2r94 n TYR 150 Cb 0.52 1.10 0.43 0.00 0.49 0.00 0.00 39.34 41.89 2r94 n TYR 150 CO 0.00 0.00 0.00 -1.35 0.91 0.00 0.00 176.86 176.42 2r94 h PRO 151 N 4.54 0.54 -0.34 2.98 0.11 -1.73 0.91 132.00 139.01 2r94 h PRO 151 Ca 0.01 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.03 2r94 h PRO 151 Cb 1.02 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.99 2r94 h PRO 151 CO 0.25 0.36 -0.02 0.00 -0.21 0.00 0.00 178.00 178.37 2r94 h ALA 152 N 1.69 1.34 0.06 -0.75 0.00 -1.87 0.63 119.26 120.35 2r94 h ALA 152 Ca 0.24 -0.21 -0.34 0.00 0.00 0.00 0.00 54.91 54.60 2r94 h ALA 152 Cb 0.25 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 2r94 h ALA 152 CO -0.07 0.45 -1.95 0.00 0.00 0.00 0.00 179.25 177.68 2r94 n ALA 153 N -2.48 1.22 0.02 0.00 0.00 -0.71 -4.40 120.51 114.16 2r94 n ALA 153 Ca 0.01 -0.76 -0.09 0.00 0.00 0.00 0.00 53.44 52.61 2r94 n ALA 153 Cb 0.26 -0.66 -0.13 0.00 0.00 0.00 0.00 19.45 18.91 2r94 n ALA 153 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2r94 h VAL 154 N 0.03 1.25 0.00 0.00 2.07 -0.73 -3.43 116.25 115.44 2r94 h VAL 154 Ca -0.39 -3.02 0.00 0.00 0.82 0.00 0.00 66.70 64.10 2r94 h VAL 154 Cb 2.03 2.64 0.00 0.00 -1.52 0.00 0.00 31.29 34.44 2r94 h VAL 154 CO 0.07 0.74 0.00 0.61 0.02 0.00 0.00 177.57 179.00 2r94 n GLY 155 N 1.48 0.81 3.17 2.17 0.00 0.20 -3.55 105.19 109.47 2r94 n GLY 155 Ca -0.10 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.84 2r94 n GLY 155 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2r94 s ARG 156 N -0.15 0.75 -0.11 1.61 1.70 -1.25 -4.96 118.95 116.54 2r94 s ARG 156 Ca 0.00 -0.93 -0.00 0.00 -0.47 0.00 0.00 55.73 54.33 2r94 s ARG 156 Cb 0.00 0.30 -0.02 0.00 -0.57 0.00 0.00 34.95 34.66 2r94 s ARG 156 CO 0.00 -0.22 -0.10 0.34 -1.08 0.00 0.00 175.30 174.25 2r94 s ASP 157 N -2.67 4.35 -0.57 -2.89 2.15 -1.26 -3.97 116.67 111.81 2r94 s ASP 157 Ca 0.03 -0.19 -0.05 0.00 0.43 0.00 0.00 52.55 52.77 2r94 s ASP 157 Cb 0.04 -1.45 0.15 0.00 -0.30 0.00 0.00 42.92 41.36 2r94 s ASP 157 CO -0.09 0.23 0.40 -0.69 -0.17 0.00 0.00 175.17 174.85 2r94 s VAL 158 N -0.05 3.85 1.03 1.11 1.01 -1.26 -5.09 120.40 121.01 2r94 s VAL 158 Ca -0.01 -2.54 -0.17 0.00 0.00 0.00 0.00 61.98 59.26 2r94 s VAL 158 Cb -0.14 -3.53 0.24 0.00 0.00 0.00 0.00 36.38 32.96 2r94 s VAL 158 CO 0.03 -0.83 1.20 -0.90 0.00 0.00 0.00 175.10 174.60 2r94 n ASP 159 N 3.99 -0.69 -0.25 3.32 5.68 -1.26 -4.61 116.55 122.74 2r94 n ASP 159 Ca 0.04 -1.35 -0.02 0.00 -0.50 0.00 0.00 54.79 52.96 2r94 n ASP 159 Cb 0.40 -0.97 0.10 0.00 -1.14 0.00 0.00 41.12 39.50 2r94 n ASP 159 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2r94 h ALA 160 N -2.14 0.93 -0.20 2.12 0.00 -1.87 0.36 119.26 118.46 2r94 h ALA 160 Ca -0.41 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 2r94 h ALA 160 Cb 1.16 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2r94 h ALA 160 CO 0.28 0.13 0.07 -0.09 0.00 0.00 0.00 179.25 179.65 2r94 h ARG 161 N 0.78 0.30 -0.71 0.00 2.43 -1.93 -1.10 114.38 114.15 2r94 h ARG 161 Ca 0.30 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 2r94 h ARG 161 Cb 0.12 -0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.59 2r94 h ARG 161 CO -0.15 0.38 0.46 0.00 -1.51 0.00 0.00 179.97 179.15 2r94 h ALA 162 N 0.91 0.91 -0.74 2.80 0.00 -1.81 -1.00 119.26 120.33 2r94 h ALA 162 Ca 0.07 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.94 2r94 h ALA 162 Cb 0.20 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 2r94 h ALA 162 CO -0.00 0.35 0.47 0.00 0.00 0.00 0.00 179.25 180.06 2r94 h ALA 163 N 1.25 0.96 -0.54 0.00 0.00 -0.09 -2.14 119.26 118.70 2r94 h ALA 163 Ca 0.26 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 2r94 h ALA 163 Cb -0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.43 2r94 h ALA 163 CO -0.05 0.28 0.16 -0.22 0.00 0.00 0.00 179.25 179.42 2r94 h LYS 164 N 0.93 0.84 -0.53 0.00 3.64 -0.90 -2.63 116.57 117.91 2r94 h LYS 164 Ca 0.29 -0.18 0.09 0.00 -1.27 0.00 0.00 60.65 59.58 2r94 h LYS 164 Cb -0.01 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.66 2r94 h LYS 164 CO -0.10 0.77 0.36 1.49 -2.27 0.00 0.00 179.45 179.70 2r94 h GLU 165 N 0.74 0.34 -0.93 1.90 4.57 -0.71 -1.99 114.58 118.50 2r94 h GLU 165 Ca 0.17 -0.02 0.04 0.00 -1.18 0.00 0.00 59.36 58.37 2r94 h GLU 165 Cb 0.29 -0.08 -0.05 0.00 -0.16 0.00 0.00 28.75 28.75 2r94 h GLU 165 CO -0.00 0.22 0.61 -0.07 -1.18 0.00 0.00 179.01 178.59 2r94 h LEU 166 N 0.35 0.99 0.00 1.64 3.38 -1.01 -3.46 115.31 117.19 2r94 h LEU 166 Ca 0.24 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2r94 h LEU 166 Cb 0.50 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2r94 h LEU 166 CO -0.06 0.67 0.00 0.61 0.09 0.00 0.00 178.44 179.75 2r94 n GLY 167 N -1.39 0.78 0.00 0.83 0.00 -0.75 -4.83 105.19 99.84 2r94 n GLY 167 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2r94 n GLY 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r94 s ILE 169 N 0.00 4.24 -0.85 0.00 -1.09 -1.26 -4.59 121.20 117.65 2r94 s ILE 169 Ca 0.00 1.54 0.09 0.00 -2.23 0.00 0.00 60.65 60.05 2r94 s ILE 169 Cb 0.00 -3.99 0.22 0.00 -1.58 0.00 0.00 42.46 37.11 2r94 s ILE 169 CO 0.00 -0.07 1.14 0.54 -1.23 0.00 0.00 174.94 175.32 2r94 n ARG 170 N 5.90 2.41 -3.53 2.79 1.74 -0.67 -4.86 116.66 120.45 2r94 n ARG 170 Ca 0.12 -1.79 -0.10 0.00 -0.77 0.00 0.00 57.85 55.32 2r94 n ARG 170 Cb 0.45 -1.22 -0.03 0.00 -1.02 0.00 0.00 32.46 30.65 2r94 n ARG 170 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2r94 s GLY 171 N -0.96 -0.41 -0.02 -0.13 0.00 -1.23 -2.39 107.32 102.18 2r94 s GLY 171 Ca 0.18 1.35 0.00 0.00 0.00 0.00 0.00 44.72 46.26 2r94 s GLY 171 CO 0.13 0.59 0.02 0.14 0.00 0.00 0.00 173.10 173.97 2r94 s VAL 172 N -2.38 0.05 -0.20 1.40 1.01 0.45 -0.84 120.40 119.89 2r94 s VAL 172 Ca 0.02 0.15 -0.05 0.00 0.00 0.00 0.00 61.98 62.11 2r94 s VAL 172 Cb -0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 36.38 36.18 2r94 s VAL 172 CO -0.05 0.11 -0.02 -0.75 0.00 0.00 0.00 175.10 174.40 2r94 s LYS 173 N 1.02 3.56 -0.31 2.72 2.20 0.91 -0.98 119.74 128.87 2r94 s LYS 173 Ca -0.09 -0.55 0.03 0.00 -0.36 0.00 0.00 55.97 55.00 2r94 s LYS 173 Cb -0.13 -3.04 0.08 0.00 -1.51 0.00 0.00 37.83 33.23 2r94 s LYS 173 CO -0.02 -0.02 -0.02 0.34 -0.36 0.00 0.00 175.35 175.27 2r94 s ASP 174 N 1.05 4.62 -0.61 1.43 2.15 -0.64 0.37 116.67 125.03 2r94 s ASP 174 Ca 0.02 -1.83 -0.21 0.00 0.43 0.00 0.00 52.55 50.95 2r94 s ASP 174 Cb -0.14 -1.58 0.08 0.00 -0.30 0.00 0.00 42.92 40.97 2r94 s ASP 174 CO 0.01 -0.30 0.85 -0.89 -0.17 0.00 0.00 175.17 174.67 2r94 s THR 175 N 1.00 4.53 -0.28 1.71 2.01 0.46 0.09 115.64 125.16 2r94 s THR 175 Ca 0.03 -0.50 -0.20 0.00 0.31 0.00 0.00 61.69 61.33 2r94 s THR 175 Cb -0.19 -4.57 0.11 0.00 0.01 0.00 0.00 72.50 67.85 2r94 s THR 175 CO -0.07 -1.26 0.86 0.21 -0.69 0.00 0.00 174.62 173.67 2r94 s ASN 176 N 3.48 -0.67 0.19 3.53 3.84 -1.26 -4.20 114.94 119.85 2r94 s ASN 176 Ca 0.19 1.15 0.26 0.00 0.21 0.00 0.00 52.86 54.66 2r94 s ASN 176 Cb -0.19 1.23 0.72 0.00 -0.55 0.00 0.00 41.25 42.46 2r94 s ASN 176 CO 0.10 -0.19 1.69 -0.62 -2.79 0.00 0.00 177.10 175.29 2r94 n GLU 177 N 3.35 0.27 -2.82 0.43 -0.58 -1.26 -4.55 120.64 115.48 2r94 n GLU 177 Ca -0.17 0.19 -0.43 0.00 -0.42 0.00 0.00 57.16 56.34 2r94 n GLU 177 Cb 0.57 -1.79 -0.03 0.00 -0.57 0.00 0.00 31.44 29.62 2r94 n GLU 177 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2r94 s SER 178 N -4.48 6.31 0.47 1.62 0.15 -1.26 -4.89 113.70 111.62 2r94 s SER 178 Ca 0.10 -1.23 0.13 0.00 0.70 0.00 0.00 55.95 55.65 2r94 s SER 178 Cb 0.12 -2.44 1.10 0.00 -1.71 0.00 0.00 66.02 63.09 2r94 s SER 178 CO 0.62 -1.40 2.09 0.25 1.20 0.00 0.00 173.24 176.00 2r94 h LEU 179 N 11.42 0.21 -1.03 3.45 5.85 -2.01 -1.17 115.31 132.03 2r94 h LEU 179 Ca -0.14 -0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.48 2r94 h LEU 179 Cb 1.05 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.02 2r94 h LEU 179 CO 1.20 0.15 -0.33 0.00 -0.34 0.00 0.00 178.44 179.12 2r94 h ALA 180 N 1.86 1.19 -0.63 1.25 0.00 -1.97 0.19 119.26 121.15 2r94 h ALA 180 Ca 0.10 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 2r94 h ALA 180 Cb 0.10 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2r94 h ALA 180 CO -0.02 0.54 0.17 1.25 0.00 0.00 0.00 179.25 181.19 2r94 h HIS 181 N 0.24 1.00 -0.12 0.00 -0.00 -1.63 -1.08 115.15 113.56 2r94 h HIS 181 Ca 0.03 -0.10 -0.13 0.00 -0.00 0.00 0.00 60.37 60.17 2r94 h HIS 181 Cb 0.70 -0.29 0.00 0.00 -0.00 0.00 0.00 27.41 27.83 2r94 h HIS 181 CO 0.01 0.81 -0.43 1.15 -0.00 0.00 0.00 177.93 179.48 2r94 h THR 182 N 0.93 1.37 -0.16 6.26 2.02 -1.19 -3.06 112.91 119.08 2r94 h THR 182 Ca 0.20 -1.74 -0.02 0.00 0.77 0.00 0.00 66.41 65.62 2r94 h THR 182 Cb 0.30 2.13 -0.01 0.00 -1.74 0.00 0.00 68.15 68.83 2r94 h THR 182 CO -0.00 0.52 -0.00 -0.07 0.37 0.00 0.00 175.52 176.34 2r94 h LEU 183 N 0.11 0.20 -2.05 2.58 3.38 -0.37 -2.27 115.31 116.88 2r94 h LEU 183 Ca -0.02 -0.02 0.11 0.00 0.09 0.00 0.00 57.88 58.04 2r94 h LEU 183 Cb 1.06 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.74 2r94 h LEU 183 CO 0.09 0.25 0.37 0.00 0.09 0.00 0.00 178.44 179.24 2r94 h ALA 184 N 1.78 2.14 -0.18 1.53 0.00 -1.09 -0.78 119.26 122.66 2r94 h ALA 184 Ca 0.05 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 2r94 h ALA 184 Cb 0.16 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2r94 h ALA 184 CO 0.00 -0.56 -0.32 1.88 0.00 0.00 0.00 179.25 180.25 2r94 h TYR 185 N 0.00 0.42 0.00 0.00 0.05 -1.52 -1.29 116.97 114.64 2r94 h TYR 185 Ca 0.18 -0.10 -0.04 0.00 0.05 0.00 0.00 58.73 58.82 2r94 h TYR 185 Cb 0.91 -0.10 -0.01 0.00 1.01 0.00 0.00 36.73 38.55 2r94 h TYR 185 CO 0.00 0.66 -0.19 0.87 -1.05 0.00 0.00 178.16 178.45 2r94 h LYS 186 N 0.32 0.00 0.13 4.88 1.57 -1.28 0.52 116.57 122.71 2r94 h LYS 186 Ca 0.04 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.61 2r94 h LYS 186 Cb 0.73 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.05 2r94 h LYS 186 CO 0.06 0.19 -0.96 -0.09 -0.57 0.00 0.00 179.45 178.07 2r94 h ARG 187 N 0.00 0.28 0.00 3.15 2.43 -1.23 -3.22 114.38 115.79 2r94 h ARG 187 Ca -0.00 -0.47 -0.07 0.00 -0.81 0.00 0.00 59.98 58.63 2r94 h ARG 187 Cb 0.52 0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.24 2r94 h ARG 187 CO 0.02 1.23 -0.55 1.88 -1.51 0.00 0.00 179.97 181.04 2r94 h TYR 188 N -0.38 0.00 -2.27 2.20 0.05 -1.26 -3.39 116.97 111.91 2r94 h TYR 188 Ca -0.18 0.00 -0.59 0.00 0.05 0.00 0.00 58.73 58.01 2r94 h TYR 188 Cb 1.66 0.00 -0.40 0.00 1.01 0.00 0.00 36.73 38.99 2r94 h TYR 188 CO 0.18 0.30 -0.83 1.28 -1.05 0.00 0.00 178.16 178.04 2r94 n LEU 189 N -3.07 1.74 0.26 3.88 4.77 0.18 -4.86 117.00 119.90 2r94 n LEU 189 Ca 0.01 -4.98 0.09 0.00 -0.03 0.00 0.00 56.01 51.10 2r94 n LEU 189 Cb 0.67 -0.03 0.69 0.00 -2.33 0.00 0.00 43.42 42.42 2r94 n LEU 189 CO 0.39 1.99 1.08 -0.65 -1.33 0.00 0.00 177.39 178.87 2r94 h PRO 190 N 4.49 0.00 0.00 3.23 0.11 -1.74 -1.02 132.00 137.07 2r94 h PRO 190 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 2r94 h PRO 190 Cb 0.79 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.90 2r94 h PRO 190 CO 0.62 0.00 -0.18 1.04 -0.21 0.00 0.00 178.00 179.26 2r94 n GLN 191 N -4.43 0.01 -2.32 1.05 1.13 -1.26 -4.91 117.38 106.64 2r94 n GLN 191 Ca -0.03 0.00 -0.41 0.00 -1.94 0.00 0.00 57.00 54.63 2r94 n GLN 191 Cb 0.10 -1.51 -0.03 0.00 0.11 0.00 0.00 30.24 28.91 2r94 n GLN 191 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2r94 s ALA 192 N -3.00 3.45 -0.06 -1.58 0.00 -0.39 -4.96 121.76 115.23 2r94 s ALA 192 Ca 0.13 1.03 -0.30 0.00 0.00 0.00 0.00 51.96 52.82 2r94 s ALA 192 Cb 0.18 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.86 2r94 s ALA 192 CO 0.59 -0.38 1.24 1.03 0.00 0.00 0.00 175.76 178.24 2r94 s ARG 193 N -1.07 4.33 -0.14 0.00 0.52 -1.01 -4.91 118.95 116.68 2r94 s ARG 193 Ca 0.49 1.72 0.02 0.00 -0.52 0.00 0.00 55.73 57.45 2r94 s ARG 193 Cb -0.35 -3.59 0.01 0.00 0.52 0.00 0.00 34.95 31.55 2r94 s ARG 193 CO 0.43 -0.50 -0.20 0.08 0.02 0.00 0.00 175.30 175.12 2r94 s VAL 194 N 2.40 1.95 0.01 3.52 1.01 -1.26 -0.41 120.40 127.61 2r94 s VAL 194 Ca 0.57 -0.90 0.07 0.00 0.00 0.00 0.00 61.98 61.72 2r94 s VAL 194 Cb -0.25 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 2r94 s VAL 194 CO 0.22 0.53 -0.21 -0.31 0.00 0.00 0.00 175.10 175.33 2r94 s TYR 195 N 0.93 2.48 0.06 5.22 2.02 -0.15 -0.49 117.35 127.42 2r94 s TYR 195 Ca -0.05 -0.31 -0.17 0.00 -0.37 0.00 0.00 57.07 56.17 2r94 s TYR 195 Cb -0.15 -1.49 -0.06 0.00 -0.40 0.00 0.00 41.96 39.86 2r94 s TYR 195 CO -0.04 0.15 0.50 1.21 -1.57 0.00 0.00 175.55 175.80 2r94 s ASN 196 N -1.08 6.92 -0.09 2.29 3.84 -1.11 -1.63 114.94 124.09 2r94 s ASN 196 Ca 0.12 1.11 0.18 0.00 0.21 0.00 0.00 52.86 54.48 2r94 s ASN 196 Cb -0.10 -2.30 0.65 0.00 -0.55 0.00 0.00 41.25 38.94 2r94 s ASN 196 CO 0.02 0.26 1.56 0.61 -2.79 0.00 0.00 177.10 176.77 2r94 n GLY 197 N 1.58 2.85 3.53 1.21 0.00 0.11 -1.35 105.19 113.13 2r94 n GLY 197 Ca -0.11 -0.81 -0.34 0.00 0.00 0.00 0.00 46.02 44.76 2r94 n GLY 197 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2r94 s SER 198 N -1.03 5.14 0.58 1.61 0.15 -1.26 -4.70 113.70 114.19 2r94 s SER 198 Ca 0.47 -0.07 0.28 0.00 0.70 0.00 0.00 55.95 57.32 2r94 s SER 198 Cb 0.30 -1.87 1.59 0.00 -1.71 0.00 0.00 66.02 64.33 2r94 s SER 198 CO 0.23 0.13 2.05 0.44 1.20 0.00 0.00 173.24 177.30 2r94 h ASP 199 N 7.00 0.00 0.41 5.45 3.32 -1.92 -1.47 116.42 129.21 2r94 h ASP 199 Ca -0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.70 2r94 h ASP 199 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2r94 h ASP 199 CO 0.65 0.00 -0.09 -1.54 -1.72 0.00 0.00 179.24 176.53 2r94 n SER 200 N -3.85 0.37 -0.48 6.45 3.41 -1.26 -3.36 113.62 114.90 2r94 n SER 200 Ca 0.03 -0.48 0.08 0.00 -0.26 0.00 0.00 58.87 58.24 2r94 n SER 200 Cb 0.41 -0.11 0.19 0.00 -0.26 0.00 0.00 64.21 64.43 2r94 n SER 200 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2r94 n LEU 201 N -1.03 3.00 0.11 1.04 4.77 -0.55 -4.77 117.00 119.57 2r94 n LEU 201 Ca 0.14 -3.26 -0.13 0.00 -0.03 0.00 0.00 56.01 52.73 2r94 n LEU 201 Cb 0.27 -0.50 -0.08 0.00 -2.33 0.00 0.00 43.42 40.78 2r94 n LEU 201 CO 0.24 0.86 0.60 0.58 -1.33 0.00 0.00 177.39 178.33 2r94 h VAL 202 N 0.72 0.87 -0.23 4.08 2.07 -1.65 0.52 116.25 122.63 2r94 h VAL 202 Ca 0.02 -0.65 0.06 0.00 0.82 0.00 0.00 66.70 66.96 2r94 h VAL 202 Cb 1.19 1.23 -0.07 0.00 -1.52 0.00 0.00 31.29 32.12 2r94 h VAL 202 CO 0.10 0.14 -0.26 0.15 0.02 0.00 0.00 177.57 177.72 2r94 h PHE 203 N -0.63 -0.69 -0.30 1.57 3.57 -1.87 -2.52 116.94 116.07 2r94 h PHE 203 Ca -0.03 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.46 2r94 h PHE 203 Cb 0.45 0.34 -0.02 0.00 2.79 0.00 0.00 35.95 39.52 2r94 h PHE 203 CO 0.03 -0.34 -0.01 0.00 -2.23 0.00 0.00 178.31 175.76 2r94 h ALA 204 N 0.73 1.43 -0.33 2.41 0.00 -1.85 -0.09 119.26 121.57 2r94 h ALA 204 Ca 0.13 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2r94 h ALA 204 Cb 0.48 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2r94 h ALA 204 CO -0.39 0.40 0.15 0.77 0.00 0.00 0.00 179.25 180.18 2r94 h SER 205 N 0.44 0.45 -0.33 0.00 0.02 -0.51 -0.62 113.55 113.00 2r94 h SER 205 Ca 0.10 -0.15 -0.05 0.00 -0.84 0.00 0.00 61.79 60.85 2r94 h SER 205 Cb 0.31 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 2r94 h SER 205 CO 0.01 0.47 0.01 -0.26 -1.14 0.00 0.00 176.83 175.92 2r94 h PHE 206 N 0.39 0.62 -0.53 3.45 0.04 -1.19 -0.62 116.94 119.09 2r94 h PHE 206 Ca 0.11 -0.10 0.03 0.00 2.80 0.00 0.00 57.97 60.81 2r94 h PHE 206 Cb 0.15 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.11 2r94 h PHE 206 CO -0.01 0.68 0.35 0.00 -0.60 0.00 0.00 178.31 178.73 2r94 h ALA 207 N 0.86 1.75 -0.44 2.45 0.00 -0.78 -0.40 119.26 122.69 2r94 h ALA 207 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2r94 h ALA 207 Cb 0.42 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2r94 h ALA 207 CO 0.01 0.19 0.00 1.33 0.00 0.00 0.00 179.25 180.79 2r94 n VAL 208 N -4.47 0.57 -3.52 0.00 0.24 -0.26 -4.96 118.33 105.93 2r94 n VAL 208 Ca 0.06 -0.71 -0.19 0.00 -2.04 0.00 0.00 64.34 61.46 2r94 n VAL 208 Cb 0.15 0.67 0.07 0.00 -1.47 0.00 0.00 33.84 33.26 2r94 n VAL 208 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2r94 n ARG 209 N 1.24 -5.37 -1.08 7.34 1.74 -0.16 -5.01 116.66 115.36 2r94 n ARG 209 Ca 0.19 0.76 -0.29 0.00 -0.77 0.00 0.00 57.85 57.74 2r94 n ARG 209 Cb 0.53 -5.56 0.20 0.00 -1.02 0.00 0.00 32.46 26.61 2r94 n ARG 209 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2r94 s LEU 210 N -6.38 1.28 0.23 0.55 1.43 -0.32 -4.92 118.68 110.55 2r94 s LEU 210 Ca 0.06 1.10 0.24 0.00 -1.03 0.00 0.00 54.13 54.50 2r94 s LEU 210 Cb -0.01 -3.16 0.94 0.00 0.03 0.00 0.00 46.19 43.99 2r94 s LEU 210 CO 0.76 -3.47 1.71 0.47 0.23 0.00 0.00 176.35 176.05 2r94 n ASP 211 N -4.39 0.64 0.00 2.29 8.00 0.35 -4.84 116.55 118.61 2r94 n ASP 211 Ca 0.06 0.64 0.00 0.00 0.71 0.00 0.00 54.79 56.20 2r94 n ASP 211 Cb 0.57 -0.78 0.00 0.00 -0.02 0.00 0.00 41.12 40.89 2r94 n ASP 211 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2r94 n GLY 212 N 0.22 -0.70 3.13 0.44 0.00 -1.19 -0.79 105.19 106.29 2r94 n GLY 212 Ca 0.03 -1.13 -0.17 0.00 0.00 0.00 0.00 46.02 44.74 2r94 n GLY 212 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2r94 s VAL 213 N -3.00 0.94 -0.48 1.61 -7.23 0.11 -2.74 120.40 109.61 2r94 s VAL 213 Ca 0.00 -1.10 -0.01 0.00 -1.81 0.00 0.00 61.98 59.06 2r94 s VAL 213 Cb 0.00 -0.90 0.13 0.00 0.56 0.00 0.00 36.38 36.16 2r94 s VAL 213 CO 0.00 -0.18 0.26 -0.69 -0.31 0.00 0.00 175.10 174.19 2r94 s VAL 214 N -1.11 3.18 -0.13 1.32 1.01 -0.46 -0.76 120.40 123.45 2r94 s VAL 214 Ca -0.03 -2.56 0.01 0.00 0.00 0.00 0.00 61.98 59.40 2r94 s VAL 214 Cb -0.09 -3.16 -0.01 0.00 0.00 0.00 0.00 36.38 33.12 2r94 s VAL 214 CO 0.01 -0.75 -0.17 0.00 0.00 0.00 0.00 175.10 174.19 2r94 s ALA 215 N 0.53 2.46 0.56 5.51 0.00 -0.96 -4.25 121.76 125.60 2r94 s ALA 215 Ca 0.13 -0.96 0.24 0.00 0.00 0.00 0.00 51.96 51.36 2r94 s ALA 215 Cb -0.22 -1.11 1.51 0.00 0.00 0.00 0.00 23.12 23.30 2r94 s ALA 215 CO -0.04 0.16 2.12 0.66 0.00 0.00 0.00 175.76 178.67 2r94 h SER 216 N 6.91 0.00 0.56 0.00 4.64 -1.87 0.14 113.55 123.93 2r94 h SER 216 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 2r94 h SER 216 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2r94 h SER 216 CO 0.54 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.96 2r94 n SER 217 N -4.16 0.03 0.14 4.97 3.41 -1.26 -1.82 113.62 114.92 2r94 n SER 217 Ca 0.01 0.51 0.10 0.00 -0.26 0.00 0.00 58.87 59.23 2r94 n SER 217 Cb 0.26 -0.51 0.51 0.00 -0.26 0.00 0.00 64.21 64.21 2r94 n SER 217 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2r94 n ALA 218 N -1.51 1.23 0.02 7.33 0.00 0.49 0.71 120.51 128.78 2r94 n ALA 218 Ca 0.04 0.15 -0.11 0.00 0.00 0.00 0.00 53.44 53.51 2r94 n ALA 218 Cb 0.19 -1.31 0.02 0.00 0.00 0.00 0.00 19.45 18.35 2r94 n ALA 218 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2r94 h ASN 219 N 0.00 0.62 0.00 0.00 2.35 -1.55 -3.34 115.58 113.66 2r94 h ASN 219 Ca 0.00 -0.38 -0.06 0.00 -0.55 0.00 0.00 56.30 55.31 2r94 h ASN 219 Cb 0.11 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 2r94 h ASN 219 CO 0.00 1.12 -1.33 0.00 -1.65 0.00 0.00 177.43 175.57 2r94 n TYR 220 N -3.90 0.00 -2.75 1.19 0.18 -0.21 -4.78 117.16 106.89 2r94 n TYR 220 Ca -0.04 0.00 -0.15 0.00 1.88 0.00 0.00 57.90 59.58 2r94 n TYR 220 Cb 0.68 -0.22 0.01 0.00 -0.38 0.00 0.00 39.34 39.43 2r94 n TYR 220 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 2r94 n LEU 221 N -2.00 2.10 0.24 -3.48 4.77 0.22 -4.40 117.00 114.45 2r94 n LEU 221 Ca -0.06 -4.36 0.07 0.00 -0.03 0.00 0.00 56.01 51.64 2r94 n LEU 221 Cb 0.47 0.27 0.59 0.00 -2.33 0.00 0.00 43.42 42.42 2r94 n LEU 221 CO 0.12 1.87 0.97 1.55 -1.33 0.00 0.00 177.39 180.58 2r94 h PRO 222 N 2.92 0.00 0.00 3.23 0.13 -1.68 -0.23 132.00 136.37 2r94 h PRO 222 Ca 0.02 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.04 2r94 h PRO 222 Cb 1.05 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 2r94 h PRO 222 CO 0.58 0.11 -0.57 1.05 -0.23 0.00 0.00 178.00 178.94 2r94 h GLU 223 N 0.00 0.00 -0.29 0.86 9.09 -1.91 0.15 114.58 122.47 2r94 h GLU 223 Ca -0.00 0.00 -0.14 0.00 0.05 0.00 0.00 59.36 59.27 2r94 h GLU 223 Cb 0.20 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.30 2r94 h GLU 223 CO 0.01 0.57 -0.37 1.25 0.05 0.00 0.00 179.01 180.52 2r94 h LEU 224 N 0.00 0.83 -0.90 3.06 5.85 -1.40 -0.94 115.31 121.81 2r94 h LEU 224 Ca -0.01 -0.50 -0.02 0.00 0.84 0.00 0.00 57.88 58.20 2r94 h LEU 224 Cb 1.33 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 42.08 2r94 h LEU 224 CO 0.07 1.16 0.49 -0.07 -0.34 0.00 0.00 178.44 179.75 2r94 h LEU 225 N 0.52 1.13 -1.12 2.25 3.38 -1.19 0.01 115.31 120.28 2r94 h LEU 225 Ca 0.04 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 2r94 h LEU 225 Cb 0.96 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 41.40 2r94 h LEU 225 CO 0.09 0.91 0.18 0.00 0.09 0.00 0.00 178.44 179.70 2r94 h ALA 226 N 1.27 1.30 -0.23 1.53 0.00 -0.84 0.71 119.26 122.99 2r94 h ALA 226 Ca 0.32 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2r94 h ALA 226 Cb 0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2r94 h ALA 226 CO -0.05 0.51 0.06 0.78 0.00 0.00 0.00 179.25 180.55 2r94 h GLY 227 N 0.93 0.40 0.56 0.00 0.00 -0.22 0.15 103.07 104.89 2r94 h GLY 227 Ca 0.18 -0.25 0.04 0.00 0.00 0.00 0.00 47.33 47.31 2r94 h GLY 227 CO -0.01 0.23 -0.04 -2.22 0.00 0.00 0.00 176.54 174.49 2r94 h ILE 228 N 0.20 0.78 -0.86 2.60 2.04 -0.70 0.13 117.51 121.69 2r94 h ILE 228 Ca 0.07 -0.01 0.05 0.00 1.00 0.00 0.00 64.86 65.98 2r94 h ILE 228 Cb 0.27 0.77 -0.06 0.00 -0.74 0.00 0.00 36.82 37.06 2r94 h ILE 228 CO 0.00 0.00 0.54 -0.09 0.00 0.00 0.00 178.15 178.61 2r94 h ARG 229 N 0.02 0.98 -0.72 2.37 2.43 -0.39 0.01 114.38 119.07 2r94 h ARG 229 Ca 0.11 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.16 2r94 h ARG 229 Cb 0.16 -0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 29.46 2r94 h ARG 229 CO -0.23 0.65 0.19 -0.44 -1.51 0.00 0.00 179.97 178.63 2r94 h ASP 230 N 1.00 1.08 -0.30 -3.80 3.32 -0.33 -2.15 116.42 115.24 2r94 h ASP 230 Ca 0.37 -0.23 -0.05 0.00 0.02 0.00 0.00 57.03 57.14 2r94 h ASP 230 Cb 0.13 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 2r94 h ASP 230 CO -0.16 1.02 0.00 0.00 -1.72 0.00 0.00 179.24 178.38 2r94 h ALA 231 N 1.10 0.40 -0.74 3.45 0.00 -0.05 -1.47 119.26 121.94 2r94 h ALA 231 Ca 0.23 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2r94 h ALA 231 Cb 0.36 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2r94 h ALA 231 CO -0.00 0.15 0.48 0.28 0.00 0.00 0.00 179.25 180.16 2r94 h VAL 232 N 0.32 1.16 0.00 0.00 2.07 -1.00 0.16 116.25 118.96 2r94 h VAL 232 Ca 0.08 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.27 2r94 h VAL 232 Cb 0.43 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 2r94 h VAL 232 CO 0.02 0.18 0.00 0.00 0.02 0.00 0.00 177.57 177.78 2r94 h ALA 233 N 1.29 1.00 -0.21 1.67 0.00 -0.95 -1.84 119.26 120.21 2r94 h ALA 233 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2r94 h ALA 233 Cb -0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2r94 h ALA 233 CO -0.08 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.17 2r94 n ALA 234 N -2.04 2.46 -1.18 0.00 0.00 -0.59 -4.92 120.51 114.24 2r94 n ALA 234 Ca 0.01 -0.78 -0.06 0.00 0.00 0.00 0.00 53.44 52.61 2r94 n ALA 234 Cb 0.31 -0.91 -0.03 0.00 0.00 0.00 0.00 19.45 18.82 2r94 n ALA 234 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r94 n GLY 235 N 1.37 0.86 2.78 0.00 0.00 -0.69 -4.94 105.19 104.57 2r94 n GLY 235 Ca 0.17 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 2r94 n GLY 235 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2r94 n ASP 236 N 0.94 6.95 -0.09 1.61 -0.08 0.54 -4.80 116.55 121.63 2r94 n ASP 236 Ca -0.06 -3.52 0.06 0.00 -1.51 0.00 0.00 54.79 49.75 2r94 n ASP 236 Cb 0.21 -1.24 0.40 0.00 2.34 0.00 0.00 41.12 42.83 2r94 n ASP 236 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 2r94 h ILE 237 N 2.78 1.06 -0.00 5.18 1.08 -1.90 -1.14 117.51 124.56 2r94 h ILE 237 Ca 0.41 -0.22 -0.12 0.00 -0.39 0.00 0.00 64.86 64.54 2r94 h ILE 237 Cb 0.45 0.37 -0.02 0.00 -3.07 0.00 0.00 36.82 34.55 2r94 h ILE 237 CO 1.28 0.12 -0.58 -0.33 -0.69 0.00 0.00 178.15 177.95 2r94 h GLU 238 N 0.64 0.01 -0.01 2.37 4.39 -1.95 -1.39 114.58 118.64 2r94 h GLU 238 Ca 0.23 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.92 2r94 h GLU 238 Cb 0.12 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.77 2r94 h GLU 238 CO -0.06 0.59 -0.01 -0.09 -1.16 0.00 0.00 179.01 178.28 2r94 h ARG 239 N 0.01 0.02 -0.60 2.33 2.43 -1.62 -2.71 114.38 114.24 2r94 h ARG 239 Ca -0.01 -0.01 0.11 0.00 -0.81 0.00 0.00 59.98 59.26 2r94 h ARG 239 Cb 1.03 0.00 -0.12 0.00 -0.42 0.00 0.00 29.97 30.47 2r94 h ARG 239 CO 0.08 0.53 -0.34 0.00 -1.51 0.00 0.00 179.97 178.73 2r94 h ALA 240 N 0.49 -0.04 -0.50 2.80 0.00 -1.25 0.19 119.26 120.94 2r94 h ALA 240 Ca 0.00 0.17 0.01 0.00 0.00 0.00 0.00 54.91 55.09 2r94 h ALA 240 Cb 0.53 0.79 -0.03 0.00 0.00 0.00 0.00 17.79 19.09 2r94 h ALA 240 CO 0.00 -0.68 0.33 -0.09 0.00 0.00 0.00 179.25 178.81 2r94 h ARG 241 N -0.16 0.65 0.00 0.00 2.43 -1.31 0.17 114.38 116.16 2r94 h ARG 241 Ca 0.24 -0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.27 2r94 h ARG 241 Cb 0.55 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 2r94 h ARG 241 CO -0.69 0.43 -0.47 0.66 -1.51 0.00 0.00 179.97 178.39 2r94 h SER 242 N 0.66 0.00 -0.48 -3.80 4.64 -0.94 0.18 113.55 113.81 2r94 h SER 242 Ca 0.19 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.38 2r94 h SER 242 Cb -0.06 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.02 2r94 h SER 242 CO -0.05 0.47 -0.21 -0.07 -0.87 0.00 0.00 176.83 176.10 2r94 h LEU 243 N 0.00 1.01 -1.04 5.97 3.38 -0.09 -1.58 115.31 122.97 2r94 h LEU 243 Ca -0.00 -0.39 -0.03 0.00 0.09 0.00 0.00 57.88 57.55 2r94 h LEU 243 Cb 1.09 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.53 2r94 h LEU 243 CO 0.06 1.18 0.35 -0.61 0.09 0.00 0.00 178.44 179.51 2r94 h GLN 244 N 0.84 1.03 -0.30 1.13 5.75 0.21 -1.56 115.11 122.22 2r94 h GLN 244 Ca 0.11 -0.14 -0.16 0.00 -0.15 0.00 0.00 58.65 58.31 2r94 h GLN 244 Cb 0.78 -0.19 -0.01 0.00 1.07 0.00 0.00 27.48 29.14 2r94 h GLN 244 CO 0.07 0.79 -0.45 0.74 -2.65 0.00 0.00 178.83 177.33 2r94 h PHE 245 N 1.03 0.92 -0.14 3.99 0.04 -0.55 0.80 116.94 123.02 2r94 h PHE 245 Ca 0.25 -0.29 0.04 0.00 2.80 0.00 0.00 57.97 60.77 2r94 h PHE 245 Cb 0.10 -0.19 -0.05 0.00 2.20 0.00 0.00 35.95 38.01 2r94 h PHE 245 CO 0.01 1.07 -0.14 1.25 -0.60 0.00 0.00 178.31 179.90 2r94 h LEU 246 N 0.61 -0.45 -0.19 1.54 7.12 -1.02 -2.09 115.31 120.83 2r94 h LEU 246 Ca 0.04 0.09 0.03 0.00 0.13 0.00 0.00 57.88 58.17 2r94 h LEU 246 Cb 1.01 0.22 -0.03 0.00 -0.53 0.00 0.00 40.66 41.33 2r94 h LEU 246 CO 0.10 -0.19 0.00 0.25 -0.13 0.00 0.00 178.44 178.47 2r94 h LEU 247 N -0.17 -0.07 -1.32 2.25 5.85 -0.98 -2.24 115.31 118.62 2r94 h LEU 247 Ca 0.10 0.04 0.14 0.00 0.84 0.00 0.00 57.88 59.00 2r94 h LEU 247 Cb 0.31 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.35 2r94 h LEU 247 CO -0.24 -0.01 0.56 0.44 -0.34 0.00 0.00 178.44 178.85 2r94 h ASP 248 N 0.06 0.63 0.02 1.25 3.32 -0.63 0.28 116.42 121.35 2r94 h ASP 248 Ca 0.09 0.04 -0.13 0.00 0.02 0.00 0.00 57.03 57.05 2r94 h ASP 248 Cb 0.11 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 2r94 h ASP 248 CO -0.15 0.33 -0.40 -0.33 -1.72 0.00 0.00 179.24 176.96 2r94 h GLU 249 N 0.67 0.49 0.02 3.56 5.08 -0.81 -0.68 114.58 122.90 2r94 h GLU 249 Ca 0.43 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 58.54 2r94 h GLU 249 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 2r94 h GLU 249 CO -0.19 0.81 -0.01 0.82 -1.00 0.00 0.00 179.01 179.45 2r94 h ILE 250 N 0.41 1.27 -0.79 3.13 2.04 -0.64 -2.76 117.51 120.16 2r94 h ILE 250 Ca 0.04 -0.87 0.09 0.00 1.00 0.00 0.00 64.86 65.11 2r94 h ILE 250 Cb 0.88 1.86 -0.07 0.00 -0.74 0.00 0.00 36.82 38.75 2r94 h ILE 250 CO 0.07 0.22 0.45 0.58 0.00 0.00 0.00 178.15 179.47 2r94 h VAL 251 N -0.40 0.92 -0.30 1.67 2.07 -0.93 -1.58 116.25 117.70 2r94 h VAL 251 Ca -0.00 -0.26 0.04 0.00 0.82 0.00 0.00 66.70 67.30 2r94 h VAL 251 Cb 0.38 0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.20 2r94 h VAL 251 CO 0.00 0.14 0.06 -0.33 0.02 0.00 0.00 177.57 177.46 2r94 h GLU 252 N 0.77 0.17 -0.76 1.57 5.08 -1.08 0.33 114.58 120.64 2r94 h GLU 252 Ca 0.37 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.73 2r94 h GLU 252 Cb 0.32 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 2r94 h GLU 252 CO -0.23 0.11 0.50 0.77 -1.00 0.00 0.00 179.01 179.15 2r94 h SER 253 N 0.17 0.88 -0.58 1.42 0.02 -1.15 -1.12 113.55 113.19 2r94 h SER 253 Ca 0.14 -0.03 -0.07 0.00 -0.84 0.00 0.00 61.79 60.99 2r94 h SER 253 Cb 0.15 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.45 2r94 h SER 253 CO -0.19 0.65 0.09 0.00 -1.14 0.00 0.00 176.83 176.24 2r94 h ALA 254 N 1.27 0.77 -1.00 3.77 0.00 -0.30 -2.12 119.26 121.66 2r94 h ALA 254 Ca 0.28 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.96 2r94 h ALA 254 Cb -0.10 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 17.41 2r94 h ALA 254 CO -0.06 0.53 0.66 0.00 0.00 0.00 0.00 179.25 180.38 2r94 h ARG 255 N 0.87 1.24 -0.37 0.00 3.08 -0.16 -1.24 114.38 117.80 2r94 h ARG 255 Ca 0.18 -0.07 0.09 0.00 0.07 0.00 0.00 59.98 60.24 2r94 h ARG 255 Cb 0.43 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 2r94 h ARG 255 CO 0.01 0.82 0.26 1.25 -1.07 0.00 0.00 179.97 181.24 2r94 h HIS 256 N 1.28 0.12 -0.01 3.04 2.76 -0.51 -2.82 115.15 119.00 2r94 h HIS 256 Ca 0.39 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.56 2r94 h HIS 256 Cb -0.03 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 28.89 2r94 h HIS 256 CO -0.00 0.06 -0.21 1.51 -1.30 0.00 0.00 177.93 177.99 2r94 n ILE 257 N -4.45 0.00 0.00 6.26 0.13 -0.52 -4.98 119.36 115.80 2r94 n ILE 257 Ca 0.05 -0.39 0.00 0.00 -1.10 0.00 0.00 62.75 61.31 2r94 n ILE 257 Cb 0.36 1.24 0.00 0.00 -0.84 0.00 0.00 39.64 40.41 2r94 n ILE 257 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2r94 n GLY 258 N 1.06 0.93 0.18 4.50 0.00 -0.92 -4.88 105.19 106.07 2r94 n GLY 258 Ca 0.08 -0.64 -0.14 0.00 0.00 0.00 0.00 46.02 45.32 2r94 n GLY 258 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2r94 h TYR 259 N 0.00 -0.37 -0.85 1.61 3.20 -1.72 0.05 116.97 118.89 2r94 h TYR 259 Ca 0.00 -0.00 0.18 0.00 3.14 0.00 0.00 58.73 62.05 2r94 h TYR 259 Cb 0.00 0.14 -0.11 0.00 1.54 0.00 0.00 36.73 38.30 2r94 h TYR 259 CO 0.00 -0.22 0.39 0.00 -1.64 0.00 0.00 178.16 176.69 2r94 h ALA 260 N 0.43 1.31 0.08 1.82 0.00 -1.96 0.59 119.26 121.53 2r94 h ALA 260 Ca -0.01 0.12 -0.26 0.00 0.00 0.00 0.00 54.91 54.76 2r94 h ALA 260 Cb 0.30 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 2r94 h ALA 260 CO 0.00 -0.22 -1.20 0.00 0.00 0.00 0.00 179.25 177.83 2r94 h ALA 261 N 1.62 0.21 -0.75 0.00 0.00 -1.79 -3.34 119.26 115.21 2r94 h ALA 261 Ca 0.50 -0.93 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2r94 h ALA 261 Cb 0.83 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 2r94 h ALA 261 CO -0.44 1.10 0.47 0.00 0.00 0.00 0.00 179.25 180.38 2r94 h ALA 262 N 0.72 1.42 -0.89 0.00 0.00 0.10 -3.02 119.26 117.60 2r94 h ALA 262 Ca -0.11 -0.07 0.23 0.00 0.00 0.00 0.00 54.91 54.96 2r94 h ALA 262 Cb 1.91 -0.31 -0.13 0.00 0.00 0.00 0.00 17.79 19.27 2r94 h ALA 262 CO 0.17 0.52 0.35 0.28 0.00 0.00 0.00 179.25 180.57 2r94 h VAL 263 N 1.03 0.42 -0.65 0.00 2.07 -1.10 -0.17 116.25 117.85 2r94 h VAL 263 Ca 0.27 -0.12 -0.05 0.00 0.82 0.00 0.00 66.70 67.63 2r94 h VAL 263 Cb -0.08 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 29.72 2r94 h VAL 263 CO -0.05 0.06 0.22 1.88 0.02 0.00 0.00 177.57 179.70 2r94 h TYR 264 N 0.34 1.00 -0.06 1.57 0.05 -1.74 -1.73 116.97 116.40 2r94 h TYR 264 Ca 0.56 -0.08 -0.17 0.00 0.05 0.00 0.00 58.73 59.09 2r94 h TYR 264 Cb 1.09 -0.30 -0.01 0.00 1.01 0.00 0.00 36.73 38.52 2r94 h TYR 264 CO -0.17 0.79 -0.70 1.49 -1.05 0.00 0.00 178.16 178.52 2r94 h GLU 265 N 0.95 0.30 -0.32 4.88 4.57 -1.22 -2.92 114.58 120.82 2r94 h GLU 265 Ca 0.22 -0.24 -0.12 0.00 -1.18 0.00 0.00 59.36 58.04 2r94 h GLU 265 Cb 0.24 0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.87 2r94 h GLU 265 CO -0.01 0.88 -0.29 -0.07 -1.18 0.00 0.00 179.01 178.34 2r94 h LEU 266 N 0.21 0.69 -0.26 1.64 3.38 -0.65 -0.93 115.31 119.39 2r94 h LEU 266 Ca -0.02 -0.27 0.05 0.00 0.09 0.00 0.00 57.88 57.73 2r94 h LEU 266 Cb 1.25 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 2r94 h LEU 266 CO 0.11 0.94 -0.02 0.58 0.09 0.00 0.00 178.44 180.15 2r94 h VAL 267 N 0.58 0.79 -0.09 1.22 2.07 -1.21 0.89 116.25 120.49 2r94 h VAL 267 Ca 0.07 -0.02 -0.00 0.00 0.82 0.00 0.00 66.70 67.57 2r94 h VAL 267 Cb 0.79 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 31.28 2r94 h VAL 267 CO 0.06 0.01 0.05 -0.33 0.02 0.00 0.00 177.57 177.38 2r94 h GLU 268 N 0.05 0.13 -0.55 1.57 5.08 -1.29 0.40 114.58 119.97 2r94 h GLU 268 Ca 0.12 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.49 2r94 h GLU 268 Cb 0.17 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 2r94 h GLU 268 CO -0.23 0.19 0.34 0.82 -1.00 0.00 0.00 179.01 179.13 2r94 h ILE 269 N 0.04 1.06 0.00 3.13 2.04 -1.04 -0.31 117.51 122.44 2r94 h ILE 269 Ca 0.03 -0.23 -0.30 0.00 1.00 0.00 0.00 64.86 65.36 2r94 h ILE 269 Cb 0.10 0.34 -0.05 0.00 -0.74 0.00 0.00 36.82 36.47 2r94 h ILE 269 CO -0.00 0.12 -1.81 0.49 0.00 0.00 0.00 178.15 176.95 2r94 n PHE 270 N -4.77 0.88 0.46 1.37 3.72 0.29 -4.45 117.46 114.97 2r94 n PHE 270 Ca 0.04 0.31 0.08 0.00 -0.05 0.00 0.00 57.45 57.84 2r94 n PHE 270 Cb 0.08 -1.16 -0.11 0.00 -0.94 0.00 0.00 39.48 37.34 2r94 n PHE 270 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2r94 n GLN 271 N -3.02 1.05 -2.61 -1.08 1.13 0.14 -5.02 117.38 107.97 2r94 n GLN 271 Ca -0.19 -0.07 -0.08 0.00 -1.94 0.00 0.00 57.00 54.72 2r94 n GLN 271 Cb 1.07 -1.35 0.02 0.00 0.11 0.00 0.00 30.24 30.09 2r94 n GLN 271 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2r94 n GLY 272 N 1.45 0.29 3.54 1.08 0.00 -0.13 -5.00 105.19 106.42 2r94 n GLY 272 Ca 0.01 -0.43 -0.11 0.00 0.00 0.00 0.00 46.02 45.49 2r94 n GLY 272 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2r94 s TYR 273 N -2.84 0.60 0.32 1.61 -0.85 -1.26 -5.09 117.35 109.86 2r94 s TYR 273 Ca 0.13 -0.93 -0.26 0.00 -0.52 0.00 0.00 57.07 55.48 2r94 s TYR 273 Cb -0.06 0.09 -0.10 0.00 0.38 0.00 0.00 41.96 42.27 2r94 s TYR 273 CO 0.16 -1.03 0.97 -1.21 -1.52 0.00 0.00 175.55 172.92 2r94 s GLU 274 N -3.69 4.56 0.00 -3.49 2.02 -1.26 -4.03 118.70 112.81 2r94 s GLU 274 Ca 0.26 1.40 0.00 0.00 0.02 0.00 0.00 54.97 56.65 2r94 s GLU 274 Cb -0.00 -2.84 0.00 0.00 0.10 0.00 0.00 34.13 31.39 2r94 s GLU 274 CO 0.12 0.25 0.63 0.00 0.02 0.00 0.00 175.26 176.28 2r94 n ALA 275 N 0.61 2.29 -0.36 5.21 0.00 -1.26 -4.94 120.51 122.06 2r94 n ALA 275 Ca 0.02 -0.63 0.00 0.00 0.00 0.00 0.00 53.44 52.83 2r94 n ALA 275 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 2r94 n ALA 275 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r94 n GLY 276 N -0.14 -0.44 3.21 0.00 0.00 -1.26 -4.67 105.19 101.88 2r94 n GLY 276 Ca 0.00 -1.09 -0.12 0.00 0.00 0.00 0.00 46.02 44.81 2r94 n GLY 276 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2r94 s GLU 277 N 0.00 1.01 0.63 1.61 2.02 0.16 -4.87 118.70 119.26 2r94 s GLU 277 Ca 0.00 -1.47 -0.08 0.00 0.02 0.00 0.00 54.97 53.44 2r94 s GLU 277 Cb 0.00 -0.16 0.14 0.00 0.10 0.00 0.00 34.13 34.21 2r94 s GLU 277 CO 0.00 -0.13 0.85 -0.35 0.02 0.00 0.00 175.26 175.65 2r94 n PRO 278 N -0.17 -0.57 -4.43 0.39 -0.04 -1.26 -1.19 135.00 127.73 2r94 n PRO 278 Ca -0.08 -1.59 -0.20 0.00 -0.04 0.00 0.00 63.50 61.59 2r94 n PRO 278 Cb 0.63 -0.79 -0.14 0.00 -0.04 0.00 0.00 33.50 33.15 2r94 n PRO 278 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 2r94 s ARG 279 N -4.78 0.90 0.11 0.54 3.52 -1.17 -4.50 118.95 113.57 2r94 s ARG 279 Ca 0.51 -0.53 -0.33 0.00 -0.13 0.00 0.00 55.73 55.25 2r94 s ARG 279 Cb -0.02 -0.88 -0.12 0.00 -1.56 0.00 0.00 34.95 32.38 2r94 s ARG 279 CO 0.35 0.23 1.76 0.41 -0.81 0.00 0.00 175.30 177.24 2r94 n GLY 280 N 2.46 1.47 0.48 8.12 0.00 -1.26 -1.71 105.19 114.75 2r94 n GLY 280 Ca -0.15 0.71 0.11 0.00 0.00 0.00 0.00 46.02 46.69 2r94 n GLY 280 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2r94 n PRO 281 N 4.98 1.17 -2.42 1.61 -0.04 -1.26 -4.88 135.00 134.16 2r94 n PRO 281 Ca 0.18 -0.97 -0.42 0.00 -0.04 0.00 0.00 63.50 62.25 2r94 n PRO 281 Cb 0.33 -1.48 0.01 0.00 -0.04 0.00 0.00 33.50 32.32 2r94 n PRO 281 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2r94 n VAL 282 N -0.07 4.56 -1.80 0.52 0.31 -0.69 -4.99 118.33 116.16 2r94 n VAL 282 Ca 0.09 -4.65 -0.37 0.00 -0.01 0.00 0.00 64.34 59.40 2r94 n VAL 282 Cb 0.46 -2.29 0.05 0.00 -0.91 0.00 0.00 33.84 31.15 2r94 n VAL 282 CO 0.00 0.00 0.00 -0.31 -1.32 0.00 0.00 176.83 175.20 2r94 s TYR 283 N -0.24 2.20 0.70 3.52 1.51 -1.26 -3.02 117.35 120.76 2r94 s TYR 283 Ca 0.39 1.45 -0.16 0.00 -1.01 0.00 0.00 57.07 57.73 2r94 s TYR 283 Cb 0.09 -3.70 0.00 0.00 -0.11 0.00 0.00 41.96 38.24 2r94 s TYR 283 CO 0.02 -2.81 1.05 -2.30 -1.11 0.00 0.00 175.55 170.40 2r94 n PRO 284 N -1.54 0.65 -1.79 -1.71 -0.02 -1.26 -4.76 135.00 124.57 2r94 n PRO 284 Ca 0.14 0.28 -0.36 0.00 -2.02 0.00 0.00 63.50 61.53 2r94 n PRO 284 Cb 0.47 -2.29 0.06 0.00 -0.02 0.00 0.00 33.50 31.72 2r94 n PRO 284 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2r94 s LEU 285 N -3.41 3.58 0.73 2.45 1.43 -1.26 -5.04 118.68 117.15 2r94 s LEU 285 Ca 0.76 2.54 -0.05 0.00 -1.03 0.00 0.00 54.13 56.35 2r94 s LEU 285 Cb -0.36 -4.61 0.10 0.00 0.03 0.00 0.00 46.19 41.35 2r94 s LEU 285 CO 0.48 -1.92 1.02 1.51 0.23 0.00 0.00 176.35 177.67 2r94 s ASP 286 N -1.50 4.44 0.26 2.29 1.47 -1.26 -4.84 116.67 117.53 2r94 s ASP 286 Ca 0.81 0.08 -0.01 0.00 1.18 0.00 0.00 52.55 54.60 2r94 s ASP 286 Cb -0.35 -0.57 0.52 0.00 -0.34 0.00 0.00 42.92 42.18 2r94 s ASP 286 CO 0.38 -1.81 1.78 -0.65 0.68 0.00 0.00 175.17 175.55 2r94 h PRO 287 N -0.65 0.67 -0.33 2.11 0.11 -1.98 0.87 132.00 132.79 2r94 h PRO 287 Ca -0.41 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.56 2r94 h PRO 287 Cb 1.28 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2r94 h PRO 287 CO 0.49 0.44 -0.18 0.93 -0.21 0.00 0.00 178.00 179.47 2r94 h GLU 288 N 0.69 0.71 -0.38 1.05 3.07 -1.98 -1.03 114.58 116.70 2r94 h GLU 288 Ca 0.46 -0.32 -0.06 0.00 -0.50 0.00 0.00 59.36 58.94 2r94 h GLU 288 Cb 0.59 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.47 2r94 h GLU 288 CO -0.33 0.92 -0.00 0.93 -1.40 0.00 0.00 179.01 179.13 2r94 h GLU 289 N 0.48 0.66 -0.47 2.33 5.08 -1.84 -0.05 114.58 120.77 2r94 h GLU 289 Ca 0.07 -0.21 -0.03 0.00 -1.00 0.00 0.00 59.36 58.19 2r94 h GLU 289 Cb 0.73 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.90 2r94 h GLU 289 CO 0.05 0.77 0.19 0.87 -1.00 0.00 0.00 179.01 179.89 2r94 h LYS 290 N 0.48 0.70 -0.80 2.33 1.57 -0.76 -0.99 116.57 119.10 2r94 h LYS 290 Ca 0.11 -0.13 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 2r94 h LYS 290 Cb 0.47 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.63 2r94 h LYS 290 CO 0.02 0.63 0.43 0.00 -0.57 0.00 0.00 179.45 179.96 2r94 h ALA 291 N 1.03 1.03 -0.14 3.86 0.00 -1.05 0.85 119.26 124.85 2r94 h ALA 291 Ca 0.16 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2r94 h ALA 291 Cb 0.19 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2r94 h ALA 291 CO -0.01 0.55 0.06 2.35 0.00 0.00 0.00 179.25 182.20 2r94 h TRP 292 N 1.11 0.20 -0.31 0.00 7.01 -0.88 -1.78 115.95 121.30 2r94 h TRP 292 Ca 0.28 -0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.26 2r94 h TRP 292 Cb 0.05 -0.06 -0.01 0.00 -2.10 0.00 0.00 29.16 27.03 2r94 h TRP 292 CO 0.00 0.25 0.17 1.25 -2.79 0.00 0.00 178.44 177.32 2r94 h LEU 293 N 0.09 0.39 -0.08 0.65 5.85 -0.62 0.10 115.31 121.69 2r94 h LEU 293 Ca 0.05 -0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.72 2r94 h LEU 293 Cb 0.12 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.00 2r94 h LEU 293 CO -0.01 0.36 -0.28 0.03 -0.34 0.00 0.00 178.44 178.20 2r94 h ARG 294 N 0.38 -0.37 -0.53 1.25 3.08 -0.77 0.15 114.38 117.58 2r94 h ARG 294 Ca 0.11 0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.23 2r94 h ARG 294 Cb 0.06 0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.15 2r94 h ARG 294 CO -0.02 -0.24 0.27 0.00 -1.07 0.00 0.00 179.97 178.91 2r94 h ALA 295 N 0.47 0.68 -0.96 0.04 0.00 -0.99 0.15 119.26 118.63 2r94 h ALA 295 Ca 0.08 0.02 0.13 0.00 0.00 0.00 0.00 54.91 55.14 2r94 h ALA 295 Cb 0.50 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 18.13 2r94 h ALA 295 CO -0.29 -0.07 0.59 0.00 0.00 0.00 0.00 179.25 179.48 2r94 h ALA 296 N 1.28 1.47 0.00 0.00 0.00 -0.34 -2.42 119.26 119.24 2r94 h ALA 296 Ca 0.23 0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.95 2r94 h ALA 296 Cb 0.13 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 2r94 h ALA 296 CO -0.15 0.14 -1.31 -0.39 0.00 0.00 0.00 179.25 177.54 2r94 h VAL 297 N 0.90 1.05 -0.75 0.00 -1.51 -0.11 -2.16 116.25 113.67 2r94 h VAL 297 Ca 0.49 -2.74 -0.01 0.00 -1.23 0.00 0.00 66.70 63.20 2r94 h VAL 297 Cb 0.54 2.48 -0.04 0.00 -2.13 0.00 0.00 31.29 32.15 2r94 h VAL 297 CO -0.29 0.60 0.41 0.00 -1.23 0.00 0.00 177.57 177.06 2r94 h ALA 298 N 1.13 1.31 0.00 5.19 0.00 -0.36 -1.76 119.26 124.78 2r94 h ALA 298 Ca -0.15 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.52 2r94 h ALA 298 Cb 1.79 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 19.27 2r94 h ALA 298 CO 0.09 0.56 -0.60 -0.22 0.00 0.00 0.00 179.25 179.08 2r94 h LYS 299 N 1.04 0.00 -5.31 0.00 3.64 -1.51 -3.41 116.57 111.02 2r94 h LYS 299 Ca 0.26 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.59 2r94 h LYS 299 Cb 0.03 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 2r94 h LYS 299 CO -0.04 0.60 0.14 0.00 -2.27 0.00 0.00 179.45 177.88 2r94 s ALA 300 N -3.61 0.75 0.00 5.00 0.00 -0.66 -5.11 121.76 118.13 2r94 s ALA 300 Ca -0.01 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 50.81 2r94 s ALA 300 Cb 0.13 -4.62 0.00 0.00 0.00 0.00 0.00 23.12 18.63 2r94 s ALA 300 CO 0.76 -6.12 0.00 1.17 0.00 0.00 0.00 175.76 171.57