#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dtr n ILE 6 N 0.00 1.05 -3.99 -1.44 2.08 -1.26 -5.02 119.36 110.77 3dtr n ILE 6 Ca 0.00 -0.34 -0.32 0.00 0.56 0.00 0.00 62.75 62.65 3dtr n ILE 6 Cb 0.00 -1.41 -0.06 0.00 -0.75 0.00 0.00 39.64 37.42 3dtr n ILE 6 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 3dtr s PHE 7 N -2.36 3.39 0.42 1.39 0.08 -1.26 -4.90 117.98 114.74 3dtr s PHE 7 Ca -0.26 0.23 -0.26 0.00 0.12 0.00 0.00 56.93 56.76 3dtr s PHE 7 Cb 0.08 -1.74 -0.09 0.00 -0.57 0.00 0.00 43.02 40.70 3dtr s PHE 7 CO 0.38 0.58 1.36 -1.12 -0.10 0.00 0.00 175.22 176.33 3dtr s SER 8 N -2.13 6.16 0.00 1.36 0.01 -0.99 -4.93 113.70 113.17 3dtr s SER 8 Ca 0.29 2.79 0.17 0.00 1.31 0.00 0.00 55.95 60.50 3dtr s SER 8 Cb -0.12 -2.65 0.03 0.00 0.21 0.00 0.00 66.02 63.49 3dtr s SER 8 CO 0.21 -0.97 0.92 0.00 0.41 0.00 0.00 173.24 173.81 3dtr n GLN 9 N 0.05 1.59 -3.66 12.44 10.64 -1.26 -4.91 117.38 132.27 3dtr n GLN 9 Ca 0.04 -0.99 -0.07 0.00 -1.83 0.00 0.00 57.00 54.14 3dtr n GLN 9 Cb 0.42 -1.31 -0.08 0.00 -0.86 0.00 0.00 30.24 28.42 3dtr n GLN 9 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 3dtr s VAL 10 N -1.87 -0.29 -0.14 -0.39 1.01 -1.26 -5.16 120.40 112.30 3dtr s VAL 10 Ca 0.15 0.05 -0.07 0.00 0.00 0.00 0.00 61.98 62.11 3dtr s VAL 10 Cb 0.14 -0.84 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 3dtr s VAL 10 CO 0.38 0.02 0.13 -1.10 0.00 0.00 0.00 175.10 174.53 3dtr s GLN 11 N 1.95 3.61 -0.04 2.72 -0.21 -1.26 -5.10 119.66 121.34 3dtr s GLN 11 Ca -0.08 -0.17 0.05 0.00 0.02 0.00 0.00 55.36 55.18 3dtr s GLN 11 Cb -0.08 -3.23 -0.01 0.00 1.00 0.00 0.00 33.01 30.70 3dtr s GLN 11 CO -0.17 0.65 -0.18 0.08 -2.12 0.00 0.00 175.29 173.55 3dtr s VAL 12 N -0.65 1.48 0.09 1.09 1.01 -1.26 -5.15 120.40 117.01 3dtr s VAL 12 Ca 0.13 -0.75 0.05 0.00 0.00 0.00 0.00 61.98 61.40 3dtr s VAL 12 Cb -0.12 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 34.97 3dtr s VAL 12 CO 0.02 0.42 -0.12 -0.60 0.00 0.00 0.00 175.10 174.82 3dtr s ARG 13 N -0.05 0.85 0.10 2.72 3.52 -1.26 -5.07 118.95 119.76 3dtr s ARG 13 Ca -0.02 -1.07 0.00 0.00 -0.13 0.00 0.00 55.73 54.51 3dtr s ARG 13 Cb -0.11 -0.71 -0.00 0.00 -1.56 0.00 0.00 34.95 32.56 3dtr s ARG 13 CO 0.02 0.14 0.12 0.41 -0.81 0.00 0.00 175.30 175.17 3dtr n GLY 14 N 0.90 3.16 3.72 8.12 0.00 -1.26 -5.12 105.19 114.71 3dtr n GLY 14 Ca -0.18 -1.54 -0.43 0.00 0.00 0.00 0.00 46.02 43.87 3dtr n GLY 14 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3dtr n PRO 15 N -0.17 2.53 -1.61 1.61 -0.02 -1.26 -4.81 135.00 131.27 3dtr n PRO 15 Ca 0.01 0.90 -0.59 0.00 -2.02 0.00 0.00 63.50 61.80 3dtr n PRO 15 Cb 0.16 -2.67 -0.08 0.00 -0.02 0.00 0.00 33.50 30.89 3dtr n PRO 15 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dtr n ALA 16 N 2.55 -1.94 -2.63 3.55 0.00 -1.26 -4.87 120.51 115.90 3dtr n ALA 16 Ca 0.11 0.52 -0.43 0.00 0.00 0.00 0.00 53.44 53.65 3dtr n ALA 16 Cb 0.35 -1.94 -0.02 0.00 0.00 0.00 0.00 19.45 17.83 3dtr n ALA 16 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3dtr s ASP 17 N 1.40 6.85 0.00 0.00 -1.08 -1.26 -4.91 116.67 117.67 3dtr s ASP 17 Ca 0.94 0.91 0.27 0.00 -0.52 0.00 0.00 52.55 54.15 3dtr s ASP 17 Cb -1.22 -2.53 1.06 0.00 -1.46 0.00 0.00 42.92 38.76 3dtr s ASP 17 CO 0.62 -0.92 1.74 0.18 0.52 0.00 0.00 175.17 177.32 3dtr n LEU 18 N 6.97 1.41 -0.40 -1.34 4.77 -1.26 -4.71 117.00 122.44 3dtr n LEU 18 Ca 0.11 -0.49 0.05 0.00 -0.03 0.00 0.00 56.01 55.65 3dtr n LEU 18 Cb 0.47 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.53 3dtr n LEU 18 CO 0.60 0.25 -0.13 0.61 -1.33 0.00 0.00 177.39 177.39 3dtr n GLY 19 N 1.15 -2.23 3.73 -0.72 0.00 -1.26 -4.92 105.19 100.94 3dtr n GLY 19 Ca 0.19 -1.38 -0.38 0.00 0.00 0.00 0.00 46.02 44.45 3dtr n GLY 19 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3dtr n MET 20 N -2.96 1.36 -3.34 1.61 2.81 -1.26 -4.99 117.12 110.35 3dtr n MET 20 Ca -0.01 0.52 -0.27 0.00 -1.81 0.00 0.00 57.70 56.13 3dtr n MET 20 Cb 0.19 -2.53 -0.07 0.00 -0.71 0.00 0.00 33.22 30.10 3dtr n MET 20 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 3dtr n THR 21 N -1.51 2.08 0.00 2.03 -1.04 -1.26 -4.99 114.28 109.59 3dtr n THR 21 Ca 0.13 -5.13 0.00 0.00 -2.04 0.00 0.00 64.05 57.02 3dtr n THR 21 Cb 0.46 -1.98 0.00 0.00 -1.82 0.00 0.00 70.33 66.99 3dtr n THR 21 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3dtr n GLU 22 N 0.77 0.00 -0.24 -2.82 -0.58 -1.26 -4.68 120.64 111.83 3dtr n GLU 22 Ca 0.29 0.00 0.12 0.00 -0.42 0.00 0.00 57.16 57.15 3dtr n GLU 22 Cb 0.42 0.00 0.25 0.00 -0.57 0.00 0.00 31.44 31.54 3dtr n GLU 22 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 3dtr n ASP 23 N 0.00 3.58 -4.71 1.62 8.00 -0.52 -4.99 116.55 119.54 3dtr n ASP 23 Ca 0.00 -1.99 -0.43 0.00 0.71 0.00 0.00 54.79 53.07 3dtr n ASP 23 Cb 0.00 -0.32 -0.02 0.00 -0.02 0.00 0.00 41.12 40.76 3dtr n ASP 23 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 3dtr n VAL 24 N 1.53 0.80 -2.34 2.53 0.31 -1.18 -4.91 118.33 115.07 3dtr n VAL 24 Ca 0.21 -0.20 -0.39 0.00 -0.01 0.00 0.00 64.34 63.95 3dtr n VAL 24 Cb 0.61 -1.73 -0.03 0.00 -0.91 0.00 0.00 33.84 31.78 3dtr n VAL 24 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 3dtr s ASN 25 N 0.52 5.83 0.41 4.52 3.84 -1.26 -4.82 114.94 123.97 3dtr s ASN 25 Ca 0.68 -0.40 0.28 0.00 0.21 0.00 0.00 52.86 53.63 3dtr s ASN 25 Cb -0.58 -2.55 1.46 0.00 -0.55 0.00 0.00 41.25 39.03 3dtr s ASN 25 CO 0.46 -2.05 1.85 -0.07 -2.79 0.00 0.00 177.10 174.50 3dtr h LEU 26 N 14.58 0.00 -1.49 3.21 3.38 -1.97 -0.22 115.31 132.81 3dtr h LEU 26 Ca -0.16 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.79 3dtr h LEU 26 Cb 1.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 3dtr h LEU 26 CO 1.28 0.00 -0.10 0.00 0.09 0.00 0.00 178.44 179.71 3dtr h ALA 27 N 2.03 1.05 0.00 1.53 0.00 -2.01 -3.20 119.26 118.66 3dtr h ALA 27 Ca 0.00 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.64 3dtr h ALA 27 Cb 0.06 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3dtr h ALA 27 CO 0.00 0.12 -1.74 0.09 0.00 0.00 0.00 179.25 177.72 3dtr n ASN 28 N -3.27 0.50 -4.72 0.00 3.02 -0.09 -4.92 115.26 105.77 3dtr n ASN 28 Ca -0.00 0.22 -0.35 0.00 -0.03 0.00 0.00 54.58 54.42 3dtr n ASN 28 Cb 0.33 0.69 0.08 0.00 -0.61 0.00 0.00 39.78 40.27 3dtr n ASN 28 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3dtr s ARG 29 N -2.94 2.27 0.00 3.52 0.52 -1.21 -2.16 118.95 118.96 3dtr s ARG 29 Ca -0.05 1.89 0.00 0.00 -0.52 0.00 0.00 55.73 57.04 3dtr s ARG 29 Cb 0.09 -1.83 0.00 0.00 0.52 0.00 0.00 34.95 33.73 3dtr s ARG 29 CO 0.83 -1.76 0.00 -1.13 0.02 0.00 0.00 175.30 173.26 3dtr n SER 30 N -2.42 0.00 -4.92 0.23 3.41 0.23 -4.88 113.62 105.27 3dtr n SER 30 Ca 0.14 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.46 3dtr n SER 30 Cb 0.49 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.41 3dtr n SER 30 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3dtr s GLY 31 N -0.96 2.04 0.40 5.00 0.00 -1.26 -4.72 107.32 107.81 3dtr s GLY 31 Ca 0.00 -0.90 -0.25 0.00 0.00 0.00 0.00 44.72 43.57 3dtr s GLY 31 CO 0.00 -0.89 0.91 -0.62 0.00 0.00 0.00 173.10 172.50 3dtr n VAL 32 N 0.04 2.25 -2.70 1.40 0.31 -1.26 -4.34 118.33 114.02 3dtr n VAL 32 Ca -0.06 -0.50 -0.19 0.00 -0.01 0.00 0.00 64.34 63.58 3dtr n VAL 32 Cb 0.52 -0.99 0.09 0.00 -0.91 0.00 0.00 33.84 32.55 3dtr n VAL 32 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3dtr n GLY 33 N 1.32 1.03 1.70 2.92 0.00 0.41 -4.91 105.19 107.67 3dtr n GLY 33 Ca 0.10 -2.08 -0.16 0.00 0.00 0.00 0.00 46.02 43.89 3dtr n GLY 33 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dtr n PRO 34 N -2.45 -3.38 -3.95 1.61 -0.04 -1.26 -4.38 135.00 121.16 3dtr n PRO 34 Ca 0.14 -0.76 -0.28 0.00 -0.04 0.00 0.00 63.50 62.56 3dtr n PRO 34 Cb 0.51 -1.01 -0.17 0.00 -0.04 0.00 0.00 33.50 32.80 3dtr n PRO 34 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3dtr s PHE 35 N -1.57 1.81 -0.48 0.54 0.40 -1.26 -1.52 117.98 115.91 3dtr s PHE 35 Ca 0.35 -1.02 -0.23 0.00 -0.60 0.00 0.00 56.93 55.42 3dtr s PHE 35 Cb -0.06 -1.40 0.03 0.00 0.51 0.00 0.00 43.02 42.11 3dtr s PHE 35 CO 0.29 -0.60 0.83 0.45 0.70 0.00 0.00 175.22 176.89 3dtr s SER 36 N 1.60 6.39 0.47 1.36 0.15 0.17 -4.82 113.70 119.01 3dtr s SER 36 Ca 0.04 -0.21 0.19 0.00 0.70 0.00 0.00 55.95 56.66 3dtr s SER 36 Cb -0.13 -2.40 1.15 0.00 -1.71 0.00 0.00 66.02 62.93 3dtr s SER 36 CO -0.09 -1.01 2.01 0.74 1.20 0.00 0.00 173.24 176.10 3dtr h THR 37 N 5.99 0.94 0.35 6.45 2.02 -1.97 0.69 112.91 127.39 3dtr h THR 37 Ca -0.25 -0.63 -0.02 0.00 0.77 0.00 0.00 66.41 66.28 3dtr h THR 37 Cb 1.08 1.36 -0.00 0.00 -1.74 0.00 0.00 68.15 68.85 3dtr h THR 37 CO 1.00 0.17 -0.21 0.25 0.37 0.00 0.00 175.52 177.09 3dtr h LEU 38 N 0.00 -0.54 -1.20 2.58 5.85 -1.96 -2.36 115.31 117.69 3dtr h LEU 38 Ca -0.00 0.03 0.20 0.00 0.84 0.00 0.00 57.88 58.95 3dtr h LEU 38 Cb 0.34 0.16 -0.09 0.00 0.37 0.00 0.00 40.66 41.44 3dtr h LEU 38 CO 0.02 -0.33 0.62 -0.07 -0.34 0.00 0.00 178.44 178.34 3dtr h LEU 39 N -0.52 0.64 0.00 2.25 3.38 -1.63 -2.27 115.31 117.15 3dtr h LEU 39 Ca -0.05 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3dtr h LEU 39 Cb 0.42 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3dtr h LEU 39 CO 0.05 0.22 0.17 0.61 0.09 0.00 0.00 178.44 179.58 3dtr n GLY 40 N -1.40 -0.31 0.13 0.83 0.00 0.23 -1.58 105.19 103.09 3dtr n GLY 40 Ca 0.23 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.03 3dtr n GLY 40 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3dtr n TRP 41 N -1.30 1.00 -0.02 1.61 7.02 -0.85 -4.31 117.44 120.59 3dtr n TRP 41 Ca 0.00 0.27 -0.16 0.00 -1.02 0.00 0.00 57.50 56.59 3dtr n TRP 41 Cb 0.17 -1.12 -0.12 0.00 -2.42 0.00 0.00 31.31 27.82 3dtr n TRP 41 CO 0.00 0.00 0.00 0.35 -2.02 0.00 0.00 177.69 176.02 3dtr h PHE 42 N -0.26 0.29 0.00 -5.99 3.57 -1.48 -2.63 116.94 110.44 3dtr h PHE 42 Ca -0.44 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 60.89 3dtr h PHE 42 Cb 1.82 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 40.53 3dtr h PHE 42 CO 0.07 1.03 0.00 0.41 -2.23 0.00 0.00 178.31 177.58 3dtr n GLY 43 N 1.24 4.44 3.76 2.40 0.00 -0.77 -4.91 105.19 111.35 3dtr n GLY 43 Ca -0.10 -0.49 -0.41 0.00 0.00 0.00 0.00 46.02 45.01 3dtr n GLY 43 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3dtr s ASN 44 N 1.61 6.66 0.18 1.61 0.02 -1.26 -3.89 114.94 119.88 3dtr s ASN 44 Ca 0.00 2.74 0.22 0.00 -1.02 0.00 0.00 52.86 54.80 3dtr s ASN 44 Cb 0.00 -2.64 -0.02 0.00 0.02 0.00 0.00 41.25 38.60 3dtr s ASN 44 CO 0.00 -0.64 1.01 0.00 0.02 0.00 0.00 177.10 177.48 3dtr n ALA 45 N 1.24 2.43 -2.68 0.60 0.00 -1.26 -4.20 120.51 116.64 3dtr n ALA 45 Ca 0.02 -0.28 -0.42 0.00 0.00 0.00 0.00 53.44 52.76 3dtr n ALA 45 Cb 0.41 -1.08 -0.03 0.00 0.00 0.00 0.00 19.45 18.75 3dtr n ALA 45 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3dtr s GLN 46 N -3.30 4.39 -0.19 0.00 0.74 -1.26 0.45 119.66 120.49 3dtr s GLN 46 Ca -0.01 1.30 -0.09 0.00 0.05 0.00 0.00 55.36 56.61 3dtr s GLN 46 Cb 0.09 -3.55 -0.05 0.00 1.10 0.00 0.00 33.01 30.61 3dtr s GLN 46 CO 0.79 -0.32 0.12 -0.51 -0.55 0.00 0.00 175.29 174.83 3dtr s LEU 47 N 2.04 4.17 0.00 3.68 1.43 -0.57 -4.97 118.68 124.46 3dtr s LEU 47 Ca 0.46 0.24 0.00 0.00 -1.03 0.00 0.00 54.13 53.80 3dtr s LEU 47 Cb -0.18 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 43.97 3dtr s LEU 47 CO 0.16 0.21 0.00 0.61 0.23 0.00 0.00 176.35 177.56 3dtr n GLY 48 N 3.32 -2.20 3.93 -3.19 0.00 -1.26 0.16 105.19 105.94 3dtr n GLY 48 Ca -0.17 -1.47 -0.29 0.00 0.00 0.00 0.00 46.02 44.10 3dtr n GLY 48 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3dtr s PRO 49 N -1.20 1.34 0.10 1.61 0.05 -1.26 -4.45 135.00 131.18 3dtr s PRO 49 Ca 0.00 -0.27 0.06 0.00 0.05 0.00 0.00 61.00 60.84 3dtr s PRO 49 Cb 0.00 -1.95 -0.03 0.00 0.05 0.00 0.00 34.50 32.56 3dtr s PRO 49 CO 0.00 -1.94 -0.15 -1.50 0.05 0.00 0.00 177.00 173.46 3dtr s ILE 50 N -3.66 1.32 -0.24 0.56 2.07 -1.26 -4.84 121.20 115.16 3dtr s ILE 50 Ca 0.68 -1.55 -0.14 0.00 -1.41 0.00 0.00 60.65 58.23 3dtr s ILE 50 Cb -0.07 -1.37 -0.04 0.00 0.13 0.00 0.00 42.46 41.10 3dtr s ILE 50 CO 0.50 -0.29 0.31 -0.47 -1.91 0.00 0.00 174.94 173.08 3dtr s TYR 51 N -1.67 3.31 0.00 3.50 6.14 -1.26 0.76 117.35 128.12 3dtr s TYR 51 Ca 0.05 0.42 0.00 0.00 0.64 0.00 0.00 57.07 58.18 3dtr s TYR 51 Cb -0.08 -2.46 0.00 0.00 0.42 0.00 0.00 41.96 39.84 3dtr s TYR 51 CO 0.03 -0.06 0.00 1.28 0.64 0.00 0.00 175.55 177.44 3dtr n LEU 52 N 4.69 0.00 -0.10 6.97 4.77 -0.92 -4.91 117.00 127.50 3dtr n LEU 52 Ca -0.10 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 55.89 3dtr n LEU 52 Cb 0.51 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.60 3dtr n LEU 52 CO 0.37 0.00 -0.03 0.61 -1.33 0.00 0.00 177.39 177.01 3dtr n GLY 53 N 3.12 -1.91 0.11 -0.72 0.00 -1.26 -3.72 105.19 100.81 3dtr n GLY 53 Ca 0.00 -1.48 -0.12 0.00 0.00 0.00 0.00 46.02 44.42 3dtr n GLY 53 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3dtr h SER 54 N -0.09 0.26 -0.10 1.61 0.02 -2.00 -2.89 113.55 110.35 3dtr h SER 54 Ca -0.01 -0.37 -0.11 0.00 -0.84 0.00 0.00 61.79 60.47 3dtr h SER 54 Cb 0.09 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 3dtr h SER 54 CO 0.00 0.56 -0.27 0.25 -1.14 0.00 0.00 176.83 176.23 3dtr h LEU 55 N -0.06 0.57 -0.19 5.07 5.85 -1.94 -1.69 115.31 122.92 3dtr h LEU 55 Ca 0.03 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.55 3dtr h LEU 55 Cb 0.45 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 3dtr h LEU 55 CO 0.01 0.82 0.11 1.23 -0.34 0.00 0.00 178.44 180.28 3dtr h GLY 56 N 1.02 0.28 0.78 3.75 0.00 -1.63 -0.48 103.07 106.78 3dtr h GLY 56 Ca 0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 47.33 47.26 3dtr h GLY 56 CO 0.06 0.11 0.01 -2.08 0.00 0.00 0.00 176.54 174.64 3dtr h VAL 57 N 0.23 1.24 0.13 4.60 2.07 -1.28 0.41 116.25 123.64 3dtr h VAL 57 Ca 0.07 -0.77 0.02 0.00 0.82 0.00 0.00 66.70 66.84 3dtr h VAL 57 Cb 0.03 1.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.28 3dtr h VAL 57 CO -0.01 0.22 -0.28 0.25 0.02 0.00 0.00 177.57 177.77 3dtr h LEU 58 N -0.04 -0.80 0.18 2.57 5.85 -1.28 0.44 115.31 122.23 3dtr h LEU 58 Ca 0.04 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.85 3dtr h LEU 58 Cb 0.34 0.30 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 3dtr h LEU 58 CO 0.00 -0.37 -0.44 -1.28 -0.34 0.00 0.00 178.44 176.01 3dtr h SER 59 N -0.50 -1.30 -0.84 1.25 0.87 -1.00 0.18 113.55 112.21 3dtr h SER 59 Ca 0.03 0.13 0.15 0.00 -1.23 0.00 0.00 61.79 60.86 3dtr h SER 59 Cb 0.52 0.47 -0.06 0.00 -0.44 0.00 0.00 62.40 62.89 3dtr h SER 59 CO -0.16 -0.49 0.55 0.25 -0.53 0.00 0.00 176.83 176.45 3dtr h LEU 60 N -0.69 0.55 -0.00 2.23 5.85 0.08 0.20 115.31 123.53 3dtr h LEU 60 Ca -0.02 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 3dtr h LEU 60 Cb 0.66 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.62 3dtr h LEU 60 CO -0.20 0.28 -0.06 0.15 -0.34 0.00 0.00 178.44 178.28 3dtr h PHE 61 N 0.59 0.06 -0.59 1.25 3.57 0.42 -2.84 116.94 119.40 3dtr h PHE 61 Ca 0.42 -0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.89 3dtr h PHE 61 Cb 0.77 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.47 3dtr h PHE 61 CO -0.00 0.79 0.39 0.77 -2.23 0.00 0.00 178.31 178.03 3dtr h SER 62 N -0.68 0.68 -0.36 0.41 0.02 -0.29 -1.28 113.55 112.05 3dtr h SER 62 Ca -0.01 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 60.95 3dtr h SER 62 Cb 0.80 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 63.14 3dtr h SER 62 CO 0.01 0.49 0.17 1.23 -1.14 0.00 0.00 176.83 177.60 3dtr h GLY 63 N 0.80 0.49 1.22 -3.77 0.00 -0.63 -0.09 103.07 101.09 3dtr h GLY 63 Ca 0.22 -0.12 -0.20 0.00 0.00 0.00 0.00 47.33 47.22 3dtr h GLY 63 CO -0.05 0.09 -0.66 1.41 0.00 0.00 0.00 176.54 177.33 3dtr h LEU 64 N 0.36 0.91 -0.47 3.11 3.38 -1.20 -2.75 115.31 118.65 3dtr h LEU 64 Ca 0.15 -0.54 0.03 0.00 0.09 0.00 0.00 57.88 57.61 3dtr h LEU 64 Cb 0.07 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.52 3dtr h LEU 64 CO -0.11 1.33 0.26 0.24 0.09 0.00 0.00 178.44 180.24 3dtr h MET 65 N 0.57 0.49 0.33 1.13 2.86 -0.93 0.27 114.93 119.65 3dtr h MET 65 Ca -0.02 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 3dtr h MET 65 Cb 1.28 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 32.80 3dtr h MET 65 CO 0.14 0.33 -0.36 2.35 1.06 0.00 0.00 176.91 180.42 3dtr h TRP 66 N 0.51 -0.98 -0.94 -0.22 7.01 -1.00 0.23 115.95 120.56 3dtr h TRP 66 Ca 0.20 0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.25 3dtr h TRP 66 Cb 0.07 0.39 -0.06 0.00 -2.10 0.00 0.00 29.16 27.46 3dtr h TRP 66 CO -0.09 -0.50 0.62 0.35 -2.79 0.00 0.00 178.44 176.03 3dtr h PHE 67 N -0.73 1.13 0.02 2.65 3.57 -1.16 -2.29 116.94 120.15 3dtr h PHE 67 Ca -0.02 0.03 -0.24 0.00 3.53 0.00 0.00 57.97 61.27 3dtr h PHE 67 Cb 0.67 -0.38 0.02 0.00 2.79 0.00 0.00 35.95 39.05 3dtr h PHE 67 CO -0.22 0.64 -0.94 0.74 -2.23 0.00 0.00 178.31 176.30 3dtr h PHE 68 N 1.15 0.90 -0.62 0.41 0.04 -0.24 -1.29 116.94 117.29 3dtr h PHE 68 Ca 0.38 -0.51 0.09 0.00 2.80 0.00 0.00 57.97 60.74 3dtr h PHE 68 Cb 0.07 -0.10 -0.04 0.00 2.20 0.00 0.00 35.95 38.08 3dtr h PHE 68 CO -0.00 1.34 0.42 1.15 -0.60 0.00 0.00 178.31 180.62 3dtr h THR 69 N 0.21 0.91 -0.05 -1.55 2.02 -0.17 0.11 112.91 114.39 3dtr h THR 69 Ca -0.12 -0.16 -0.16 0.00 0.77 0.00 0.00 66.41 66.74 3dtr h THR 69 Cb 1.62 0.41 0.01 0.00 -1.74 0.00 0.00 68.15 68.45 3dtr h THR 69 CO 0.18 0.08 -0.58 0.40 0.37 0.00 0.00 175.52 175.97 3dtr h ILE 70 N 0.46 1.38 -0.53 3.11 2.04 -1.35 -3.21 117.51 119.42 3dtr h ILE 70 Ca 0.29 -1.96 0.08 0.00 1.00 0.00 0.00 64.86 64.27 3dtr h ILE 70 Cb 0.50 2.37 -0.07 0.00 -0.74 0.00 0.00 36.82 38.89 3dtr h ILE 70 CO -0.08 0.58 0.17 1.23 0.00 0.00 0.00 178.15 180.05 3dtr h GLY 71 N 0.05 0.71 1.46 5.37 0.00 0.19 -1.10 103.07 109.76 3dtr h GLY 71 Ca -0.06 -0.09 -0.08 0.00 0.00 0.00 0.00 47.33 47.11 3dtr h GLY 71 CO 0.12 -0.02 -0.10 0.16 0.00 0.00 0.00 176.54 176.70 3dtr h ILE 72 N 0.34 1.24 -0.30 2.60 3.07 -0.96 -1.40 117.51 122.10 3dtr h ILE 72 Ca 0.26 -1.07 -0.01 0.00 1.55 0.00 0.00 64.86 65.59 3dtr h ILE 72 Cb 0.32 1.06 -0.01 0.00 -0.27 0.00 0.00 36.82 37.91 3dtr h ILE 72 CO -0.29 0.36 0.15 -0.25 -1.05 0.00 0.00 178.15 177.07 3dtr h TRP 73 N 0.60 0.43 -0.56 0.16 2.91 -1.36 0.12 115.95 118.25 3dtr h TRP 73 Ca 0.11 -0.02 0.05 0.00 1.13 0.00 0.00 58.89 60.16 3dtr h TRP 73 Cb 0.52 -0.13 -0.05 0.00 -0.51 0.00 0.00 29.16 28.99 3dtr h TRP 73 CO 0.02 0.38 0.29 0.74 -1.03 0.00 0.00 178.44 178.84 3dtr h PHE 74 N 0.35 0.53 -0.61 2.65 -1.00 -0.77 -0.00 116.94 118.09 3dtr h PHE 74 Ca 0.10 0.02 -0.01 0.00 2.81 0.00 0.00 57.97 60.90 3dtr h PHE 74 Cb 0.11 -0.15 -0.03 0.00 3.61 0.00 0.00 35.95 39.49 3dtr h PHE 74 CO -0.02 0.25 0.35 -1.49 -1.61 0.00 0.00 178.31 175.79 3dtr h TRP 75 N 0.55 0.82 -0.69 -0.55 4.06 -0.85 0.77 115.95 120.07 3dtr h TRP 75 Ca 0.25 -0.01 -0.03 0.00 2.06 0.00 0.00 58.89 61.16 3dtr h TRP 75 Cb 0.16 -0.27 -0.03 0.00 -1.00 0.00 0.00 29.16 28.02 3dtr h TRP 75 CO -0.10 0.58 0.31 -0.92 -3.56 0.00 0.00 178.44 174.75 3dtr h TYR 76 N 0.83 0.99 -0.55 0.49 3.20 -0.06 -1.59 116.97 120.28 3dtr h TYR 76 Ca 0.22 -0.05 -0.10 0.00 3.14 0.00 0.00 58.73 61.94 3dtr h TYR 76 Cb 0.02 -0.31 -0.02 0.00 1.54 0.00 0.00 36.73 37.96 3dtr h TYR 76 CO -0.01 0.74 -0.04 1.96 -1.64 0.00 0.00 178.16 179.17 3dtr h GLN 77 N 0.98 1.00 0.00 1.82 4.20 -0.29 -3.18 115.11 119.64 3dtr h GLN 77 Ca 0.24 -0.34 0.00 0.00 0.06 0.00 0.00 58.65 58.61 3dtr h GLN 77 Cb 0.14 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.83 3dtr h GLN 77 CO -0.03 1.02 0.00 0.00 -0.67 0.00 0.00 178.83 179.15 3dtr n ALA 78 N -2.48 2.16 -2.70 3.87 0.00 0.20 -4.82 120.51 116.74 3dtr n ALA 78 Ca 0.02 -0.11 -0.16 0.00 0.00 0.00 0.00 53.44 53.19 3dtr n ALA 78 Cb 0.36 -1.30 0.02 0.00 0.00 0.00 0.00 19.45 18.52 3dtr n ALA 78 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dtr n GLY 79 N 0.18 -0.19 2.25 0.00 0.00 -1.09 -2.52 105.19 103.83 3dtr n GLY 79 Ca 0.13 -0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.89 3dtr n GLY 79 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3dtr n TRP 80 N -4.13 -0.24 -3.40 1.61 7.02 -0.67 -4.90 117.44 112.74 3dtr n TRP 80 Ca -0.10 0.00 -0.40 0.00 -1.02 0.00 0.00 57.50 55.98 3dtr n TRP 80 Cb 0.60 -2.41 -0.09 0.00 -2.42 0.00 0.00 31.31 26.99 3dtr n TRP 80 CO 0.00 0.00 0.00 1.21 -2.02 0.00 0.00 177.69 176.88 3dtr s ASN 81 N -2.00 6.22 0.56 -0.99 3.84 -1.05 -4.95 114.94 116.58 3dtr s ASN 81 Ca 0.00 0.08 0.28 0.00 0.21 0.00 0.00 52.86 53.43 3dtr s ASN 81 Cb 0.00 -2.20 1.67 0.00 -0.55 0.00 0.00 41.25 40.16 3dtr s ASN 81 CO 0.00 -0.24 2.20 1.55 -2.79 0.00 0.00 177.10 177.81 3dtr h PRO 82 N 8.30 0.00 0.03 0.43 0.13 -1.90 -0.52 132.00 138.47 3dtr h PRO 82 Ca -0.31 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.82 3dtr h PRO 82 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3dtr h PRO 82 CO 0.66 0.04 -0.01 0.00 -0.23 0.00 0.00 178.00 178.45 3dtr h ALA 83 N 1.96 -0.04 -0.42 -0.56 0.00 -1.93 -2.62 119.26 115.65 3dtr h ALA 83 Ca -0.00 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.62 3dtr h ALA 83 Cb 0.09 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3dtr h ALA 83 CO 0.00 -0.20 0.25 0.28 0.00 0.00 0.00 179.25 179.58 3dtr h VAL 84 N -0.68 1.05 -0.85 0.00 2.07 -1.76 -0.26 116.25 115.83 3dtr h VAL 84 Ca -0.00 -0.17 0.19 0.00 0.82 0.00 0.00 66.70 67.53 3dtr h VAL 84 Cb 0.62 0.50 -0.11 0.00 -1.52 0.00 0.00 31.29 30.78 3dtr h VAL 84 CO 0.01 0.09 0.36 0.15 0.02 0.00 0.00 177.57 178.20 3dtr h PHE 85 N 0.51 0.61 0.06 1.57 3.57 -1.14 0.40 116.94 122.51 3dtr h PHE 85 Ca 0.16 0.04 -0.24 0.00 3.53 0.00 0.00 57.97 61.46 3dtr h PHE 85 Cb -0.00 -0.14 -0.00 0.00 2.79 0.00 0.00 35.95 38.60 3dtr h PHE 85 CO -0.07 0.00 -1.07 -0.07 -2.23 0.00 0.00 178.31 174.88 3dtr h LEU 86 N 0.43 0.41 -0.34 0.59 4.07 -0.97 -2.90 115.31 116.60 3dtr h LEU 86 Ca 0.51 -0.39 -0.09 0.00 0.08 0.00 0.00 57.88 57.99 3dtr h LEU 86 Cb 0.89 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.49 3dtr h LEU 86 CO -0.48 1.24 -0.13 -0.09 -1.08 0.00 0.00 178.44 177.90 3dtr h ARG 87 N 0.13 0.69 -0.48 1.13 2.43 0.75 -3.30 114.38 115.73 3dtr h ARG 87 Ca -0.10 -0.29 -0.10 0.00 -0.81 0.00 0.00 59.98 58.69 3dtr h ARG 87 Cb 1.75 -0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 31.21 3dtr h ARG 87 CO 0.18 0.88 0.08 -0.25 -1.51 0.00 0.00 179.97 179.35 3dtr n ASP 88 N -4.37 4.28 -0.03 -3.80 8.00 0.12 -4.71 116.55 116.05 3dtr n ASP 88 Ca -0.02 -3.18 0.03 0.00 0.71 0.00 0.00 54.79 52.33 3dtr n ASP 88 Cb 0.37 -0.65 0.39 0.00 -0.02 0.00 0.00 41.12 41.22 3dtr n ASP 88 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3dtr h LEU 89 N 2.29 0.53 0.00 0.64 5.85 -1.59 0.22 115.31 123.26 3dtr h LEU 89 Ca 0.12 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3dtr h LEU 89 Cb 1.86 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.76 3dtr h LEU 89 CO 0.46 0.39 -0.50 0.49 -0.34 0.00 0.00 178.44 178.94 3dtr n PHE 90 N -4.46 0.10 -0.01 1.25 3.72 -1.26 -4.06 117.46 112.73 3dtr n PHE 90 Ca 0.04 0.03 -0.09 0.00 -0.05 0.00 0.00 57.45 57.38 3dtr n PHE 90 Cb 0.06 -0.34 -0.14 0.00 -0.94 0.00 0.00 39.48 38.13 3dtr n PHE 90 CO 0.00 0.00 0.00 0.74 -0.05 0.00 0.00 176.76 177.45 3dtr h PHE 91 N 0.00 0.01 -4.16 1.38 0.04 -1.32 -1.42 116.94 111.47 3dtr h PHE 91 Ca 0.00 -0.01 -0.53 0.00 2.80 0.00 0.00 57.97 60.23 3dtr h PHE 91 Cb 0.55 -0.00 0.19 0.00 2.20 0.00 0.00 35.95 38.89 3dtr h PHE 91 CO 0.00 1.02 0.23 1.19 -0.60 0.00 0.00 178.31 180.14 3dtr n PHE 92 N -3.08 0.93 -3.64 -0.55 3.72 -1.00 -4.84 117.46 109.01 3dtr n PHE 92 Ca -0.16 0.39 -0.06 0.00 -0.05 0.00 0.00 57.45 57.58 3dtr n PHE 92 Cb 1.04 -2.05 -0.07 0.00 -0.94 0.00 0.00 39.48 37.47 3dtr n PHE 92 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3dtr s SER 93 N -2.29 -0.67 -0.50 4.37 0.15 -1.26 -4.42 113.70 109.08 3dtr s SER 93 Ca 0.70 1.10 -0.16 0.00 0.70 0.00 0.00 55.95 58.30 3dtr s SER 93 Cb -0.27 1.24 0.10 0.00 -1.71 0.00 0.00 66.02 65.38 3dtr s SER 93 CO 0.54 -0.18 0.45 -0.22 1.20 0.00 0.00 173.24 175.04 3dtr s LEU 94 N 1.21 5.85 0.15 3.45 2.96 0.76 -4.97 118.68 128.10 3dtr s LEU 94 Ca -0.07 -1.52 -0.08 0.00 -0.22 0.00 0.00 54.13 52.24 3dtr s LEU 94 Cb -0.04 -2.20 -0.06 0.00 0.50 0.00 0.00 46.19 44.38 3dtr s LEU 94 CO -0.14 -0.75 0.43 -1.61 -1.32 0.00 0.00 176.35 172.96 3dtr s GLU 95 N 1.67 3.72 1.13 1.98 0.41 -1.26 -0.32 118.70 126.02 3dtr s GLU 95 Ca 0.04 0.10 -0.14 0.00 -0.41 0.00 0.00 54.97 54.56 3dtr s GLU 95 Cb -0.27 -2.84 0.26 0.00 -1.78 0.00 0.00 34.13 29.50 3dtr s GLU 95 CO 0.05 0.46 1.05 -1.25 -0.49 0.00 0.00 175.26 175.08 3dtr s PRO 96 N -2.45 -0.62 0.68 0.39 0.04 -1.26 -4.49 135.00 127.28 3dtr s PRO 96 Ca 0.40 0.52 -0.16 0.00 0.04 0.00 0.00 61.00 61.80 3dtr s PRO 96 Cb -0.13 -1.61 0.01 0.00 0.04 0.00 0.00 34.50 32.81 3dtr s PRO 96 CO 0.22 -3.44 1.18 -1.25 0.04 0.00 0.00 177.00 173.75 3dtr s PRO 97 N -4.82 2.51 0.77 0.56 0.04 -1.26 -4.68 135.00 128.12 3dtr s PRO 97 Ca 0.67 1.69 -0.15 0.00 0.04 0.00 0.00 61.00 63.26 3dtr s PRO 97 Cb -0.20 -1.89 0.05 0.00 0.04 0.00 0.00 34.50 32.51 3dtr s PRO 97 CO 0.60 -1.53 1.14 0.00 0.04 0.00 0.00 177.00 177.25 3dtr n ALA 98 N -2.34 0.02 0.33 8.56 0.00 -1.25 -3.24 120.51 122.58 3dtr n ALA 98 Ca 0.13 -0.26 0.21 0.00 0.00 0.00 0.00 53.44 53.52 3dtr n ALA 98 Cb 0.50 -2.22 1.13 0.00 0.00 0.00 0.00 19.45 18.86 3dtr n ALA 98 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3dtr h PRO 99 N -0.57 0.00 -0.52 0.00 0.13 -1.93 -2.55 132.00 126.56 3dtr h PRO 99 Ca -0.47 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.72 3dtr h PRO 99 Cb 1.31 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.39 3dtr h PRO 99 CO 0.47 0.00 0.23 0.93 -0.23 0.00 0.00 178.00 179.40 3dtr h GLU 100 N 0.00 0.43 0.00 0.86 3.07 -2.00 -2.50 114.58 114.44 3dtr h GLU 100 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 3dtr h GLU 100 Cb 0.14 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 3dtr h GLU 100 CO -0.00 0.29 0.00 1.88 -1.40 0.00 0.00 179.01 179.78 3dtr h TYR 101 N 0.44 0.00 0.00 4.33 0.05 -1.81 -3.49 116.97 116.50 3dtr h TYR 101 Ca 0.24 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.02 3dtr h TYR 101 Cb 0.21 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.95 3dtr h TYR 101 CO -0.13 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.39 3dtr n GLY 102 N 0.61 3.53 1.67 3.88 0.00 -0.95 -1.29 105.19 112.64 3dtr n GLY 102 Ca 0.03 -0.13 -0.08 0.00 0.00 0.00 0.00 46.02 45.84 3dtr n GLY 102 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dtr n LEU 103 N 0.00 4.99 -4.76 0.99 4.77 -1.17 -2.24 117.00 119.58 3dtr n LEU 103 Ca 0.00 -2.60 -0.39 0.00 -0.03 0.00 0.00 56.01 52.98 3dtr n LEU 103 Cb 0.00 -0.69 -0.05 0.00 -2.33 0.00 0.00 43.42 40.35 3dtr n LEU 103 CO 0.00 0.73 0.70 -0.55 -1.33 0.00 0.00 177.39 176.94 3dtr s SER 104 N -0.51 7.42 -0.21 -1.43 0.15 -0.41 -4.95 113.70 113.76 3dtr s SER 104 Ca 0.37 2.05 0.15 0.00 0.70 0.00 0.00 55.95 59.22 3dtr s SER 104 Cb 0.30 -2.61 0.77 0.00 -1.71 0.00 0.00 66.02 62.77 3dtr s SER 104 CO 0.08 -0.02 1.69 0.49 1.20 0.00 0.00 173.24 176.69 3dtr n PHE 105 N 1.16 1.85 0.04 3.44 3.72 -1.26 -4.40 117.46 122.01 3dtr n PHE 105 Ca -0.01 -0.73 0.04 0.00 -0.05 0.00 0.00 57.45 56.71 3dtr n PHE 105 Cb 0.47 -0.45 0.09 0.00 -0.94 0.00 0.00 39.48 38.65 3dtr n PHE 105 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3dtr n ALA 106 N 0.57 2.27 -1.71 4.37 0.00 -1.26 -5.02 120.51 119.73 3dtr n ALA 106 Ca 0.27 -0.92 -0.42 0.00 0.00 0.00 0.00 53.44 52.37 3dtr n ALA 106 Cb 1.11 -0.33 -0.01 0.00 0.00 0.00 0.00 19.45 20.23 3dtr n ALA 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dtr n ALA 107 N 0.38 1.44 -0.69 0.00 0.00 -1.26 -4.94 120.51 115.44 3dtr n ALA 107 Ca 0.08 0.36 -0.31 0.00 0.00 0.00 0.00 53.44 53.57 3dtr n ALA 107 Cb 0.33 -2.28 0.17 0.00 0.00 0.00 0.00 19.45 17.67 3dtr n ALA 107 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3dtr s PRO 108 N -1.88 0.99 0.10 0.00 0.01 -1.26 -3.88 135.00 129.08 3dtr s PRO 108 Ca 0.55 1.57 -0.17 0.00 0.01 0.00 0.00 61.00 62.96 3dtr s PRO 108 Cb -0.56 -1.72 -0.06 0.00 0.01 0.00 0.00 34.50 32.17 3dtr s PRO 108 CO 0.62 -2.66 1.56 -0.07 0.01 0.00 0.00 177.00 176.46 3dtr h LEU 109 N -1.88 0.50 0.00 -5.54 3.38 -1.92 0.34 115.31 110.20 3dtr h LEU 109 Ca -0.43 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.25 3dtr h LEU 109 Cb 1.27 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.89 3dtr h LEU 109 CO 0.41 0.66 0.00 0.29 0.09 0.00 0.00 178.44 179.90 3dtr n LYS 110 N -4.60 0.10 -0.26 1.13 5.02 -1.26 -2.88 118.16 115.42 3dtr n LYS 110 Ca -0.02 0.14 0.07 0.00 -2.02 0.00 0.00 58.31 56.48 3dtr n LYS 110 Cb 0.24 -1.50 0.18 0.00 -0.02 0.00 0.00 35.03 33.93 3dtr n LYS 110 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3dtr n GLU 111 N -1.42 2.59 0.00 1.97 1.02 -0.83 -4.93 120.64 119.04 3dtr n GLU 111 Ca 0.06 -2.46 0.00 0.00 -0.02 0.00 0.00 57.16 54.75 3dtr n GLU 111 Cb 0.20 -1.55 0.00 0.00 -0.02 0.00 0.00 31.44 30.07 3dtr n GLU 111 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dtr n GLY 112 N -0.46 0.85 0.29 0.62 0.00 -0.86 -3.95 105.19 101.68 3dtr n GLY 112 Ca 0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.09 3dtr n GLY 112 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3dtr h GLY 113 N 0.00 1.02 1.72 -0.02 0.00 -0.93 -2.39 103.07 102.46 3dtr h GLY 113 Ca 0.00 -0.79 -0.04 0.00 0.00 0.00 0.00 47.33 46.50 3dtr h GLY 113 CO 0.00 0.73 -0.02 -2.00 0.00 0.00 0.00 176.54 175.24 3dtr h LEU 114 N 0.84 0.33 -0.64 3.11 5.85 -1.76 -2.11 115.31 120.93 3dtr h LEU 114 Ca 0.14 -0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.71 3dtr h LEU 114 Cb 0.64 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 3dtr h LEU 114 CO 0.04 0.41 0.03 -0.25 -0.34 0.00 0.00 178.44 178.33 3dtr h TRP 115 N 0.35 1.18 -0.62 1.25 7.01 -1.70 -2.15 115.95 121.27 3dtr h TRP 115 Ca 0.08 -0.19 -0.08 0.00 2.11 0.00 0.00 58.89 60.80 3dtr h TRP 115 Cb 0.28 -0.31 -0.02 0.00 -2.10 0.00 0.00 29.16 27.00 3dtr h TRP 115 CO 0.01 1.02 0.07 -0.07 -2.79 0.00 0.00 178.44 176.68 3dtr h LEU 116 N 1.00 0.99 0.13 0.65 3.38 -1.18 -0.44 115.31 119.84 3dtr h LEU 116 Ca 0.18 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 3dtr h LEU 116 Cb 0.54 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3dtr h LEU 116 CO 0.03 1.00 -0.06 0.40 0.09 0.00 0.00 178.44 179.90 3dtr h ILE 117 N 0.96 0.94 -0.28 1.22 2.04 -1.22 0.12 117.51 121.29 3dtr h ILE 117 Ca 0.19 -0.27 0.04 0.00 1.00 0.00 0.00 64.86 65.82 3dtr h ILE 117 Cb 0.45 1.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.60 3dtr h ILE 117 CO 0.02 0.06 0.02 0.00 0.00 0.00 0.00 178.15 178.25 3dtr h ALA 118 N 0.56 0.27 -0.21 1.87 0.00 -1.25 -0.40 119.26 120.10 3dtr h ALA 118 Ca -0.02 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 3dtr h ALA 118 Cb 0.24 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3dtr h ALA 118 CO 0.03 -0.39 0.13 0.77 0.00 0.00 0.00 179.25 179.79 3dtr h SER 119 N 0.12 0.25 -0.98 0.00 0.02 -0.97 0.34 113.55 112.33 3dtr h SER 119 Ca 0.13 -0.04 0.16 0.00 -0.84 0.00 0.00 61.79 61.20 3dtr h SER 119 Cb 0.16 -0.06 -0.10 0.00 0.14 0.00 0.00 62.40 62.54 3dtr h SER 119 CO -0.20 0.21 0.59 0.15 -1.14 0.00 0.00 176.83 176.44 3dtr h PHE 120 N 0.26 1.04 -0.37 3.45 3.57 -0.24 0.46 116.94 125.10 3dtr h PHE 120 Ca 0.07 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.55 3dtr h PHE 120 Cb 0.01 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.42 3dtr h PHE 120 CO -0.05 0.30 0.01 0.74 -2.23 0.00 0.00 178.31 177.09 3dtr h PHE 121 N 0.82 0.70 -0.69 0.41 0.04 -0.29 -2.63 116.94 115.31 3dtr h PHE 121 Ca 0.53 -0.12 -0.05 0.00 2.80 0.00 0.00 57.97 61.13 3dtr h PHE 121 Cb 0.71 -0.19 -0.03 0.00 2.20 0.00 0.00 35.95 38.64 3dtr h PHE 121 CO -0.02 0.73 0.23 1.98 -0.60 0.00 0.00 178.31 180.63 3dtr h MET 122 N 0.47 1.06 0.07 1.51 4.05 0.14 -0.81 114.93 121.42 3dtr h MET 122 Ca 0.11 -0.22 0.02 0.00 -0.28 0.00 0.00 59.70 59.33 3dtr h MET 122 Cb 0.44 -0.16 -0.04 0.00 -0.80 0.00 0.00 31.60 31.04 3dtr h MET 122 CO 0.02 0.91 -0.29 0.35 0.23 0.00 0.00 176.91 178.12 3dtr h PHE 123 N 1.00 -0.80 -0.51 1.39 3.57 -0.07 0.12 116.94 121.63 3dtr h PHE 123 Ca 0.22 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.67 3dtr h PHE 123 Cb 0.29 0.34 -0.02 0.00 2.79 0.00 0.00 35.95 39.35 3dtr h PHE 123 CO 0.02 -0.40 0.01 0.28 -2.23 0.00 0.00 178.31 176.00 3dtr h VAL 124 N -0.48 1.25 0.18 1.41 2.07 -1.37 -1.80 116.25 117.51 3dtr h VAL 124 Ca 0.04 -1.02 0.01 0.00 0.82 0.00 0.00 66.70 66.55 3dtr h VAL 124 Cb 0.54 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 3dtr h VAL 124 CO -0.21 0.36 -0.21 0.00 0.02 0.00 0.00 177.57 177.54 3dtr h ALA 125 N 1.22 -0.40 -0.24 1.67 0.00 -0.45 -2.08 119.26 118.97 3dtr h ALA 125 Ca 0.15 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 3dtr h ALA 125 Cb 0.46 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3dtr h ALA 125 CO 0.02 -0.76 -0.09 0.28 0.00 0.00 0.00 179.25 178.71 3dtr h VAL 126 N -0.43 1.29 -0.57 0.00 2.07 -0.60 -2.33 116.25 115.68 3dtr h VAL 126 Ca 0.01 -1.12 -0.10 0.00 0.82 0.00 0.00 66.70 66.30 3dtr h VAL 126 Cb 0.42 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 3dtr h VAL 126 CO -0.07 0.35 -0.05 -0.50 0.02 0.00 0.00 177.57 177.32 3dtr h TRP 127 N 0.20 1.15 -0.62 1.57 4.06 -1.34 -0.68 115.95 120.29 3dtr h TRP 127 Ca 0.06 -0.22 -0.04 0.00 2.06 0.00 0.00 58.89 60.75 3dtr h TRP 127 Cb 0.57 -0.29 -0.03 0.00 -1.00 0.00 0.00 29.16 28.41 3dtr h TRP 127 CO 0.06 1.04 0.24 0.66 -3.56 0.00 0.00 178.44 176.88 3dtr h SER 128 N 0.93 0.86 0.27 -3.49 4.64 -1.37 -0.43 113.55 114.95 3dtr h SER 128 Ca 0.15 -0.17 -0.05 0.00 -0.47 0.00 0.00 61.79 61.25 3dtr h SER 128 Cb 0.62 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 3dtr h SER 128 CO 0.04 0.80 -0.22 -0.25 -0.87 0.00 0.00 176.83 176.33 3dtr h TRP 129 N 0.86 0.00 0.03 4.77 2.91 -1.13 0.27 115.95 123.66 3dtr h TRP 129 Ca 0.21 0.00 -0.00 0.00 1.13 0.00 0.00 58.89 60.22 3dtr h TRP 129 Cb 0.21 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 28.86 3dtr h TRP 129 CO 0.01 0.22 -0.01 2.35 -1.03 0.00 0.00 178.44 179.97 3dtr h TRP 130 N 0.00 -0.04 -0.06 2.65 7.01 0.02 -2.21 115.95 123.31 3dtr h TRP 130 Ca -0.00 -0.00 0.02 0.00 2.11 0.00 0.00 58.89 61.02 3dtr h TRP 130 Cb 0.41 0.01 -0.00 0.00 -2.10 0.00 0.00 29.16 27.48 3dtr h TRP 130 CO 0.00 0.32 0.05 0.78 -2.79 0.00 0.00 178.44 176.80 3dtr h GLY 131 N -0.40 0.00 0.87 2.65 0.00 -0.43 -0.65 103.07 105.11 3dtr h GLY 131 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3dtr h GLY 131 CO 0.01 0.00 0.06 -0.09 0.00 0.00 0.00 176.54 176.52 3dtr h ARG 132 N 0.00 0.36 -0.52 4.80 2.43 -0.73 -1.24 114.38 119.48 3dtr h ARG 132 Ca 0.03 -0.08 0.02 0.00 -0.81 0.00 0.00 59.98 59.13 3dtr h ARG 132 Cb 0.12 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.60 3dtr h ARG 132 CO -0.00 0.46 0.35 1.79 -1.51 0.00 0.00 179.97 181.06 3dtr h THR 133 N 0.20 1.10 0.23 0.20 1.35 -0.50 -1.29 112.91 114.21 3dtr h THR 133 Ca 0.07 -0.23 -0.01 0.00 -0.55 0.00 0.00 66.41 65.69 3dtr h THR 133 Cb 0.26 0.38 0.00 0.00 -1.73 0.00 0.00 68.15 67.06 3dtr h THR 133 CO -0.00 0.12 -0.11 0.22 -0.25 0.00 0.00 175.52 175.50 3dtr h TYR 134 N 0.66 -0.29 -0.47 4.73 5.03 -1.09 -3.18 116.97 122.36 3dtr h TYR 134 Ca 0.20 -0.01 0.02 0.00 2.58 0.00 0.00 58.73 61.52 3dtr h TYR 134 Cb -0.01 0.10 -0.03 0.00 1.55 0.00 0.00 36.73 38.34 3dtr h TYR 134 CO -0.00 0.09 0.28 -0.07 -1.32 0.00 0.00 178.16 177.14 3dtr h LEU 135 N -0.84 0.47 -1.68 2.82 3.38 -1.01 -1.17 115.31 117.27 3dtr h LEU 135 Ca -0.03 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.07 3dtr h LEU 135 Cb 0.51 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 3dtr h LEU 135 CO 0.05 0.33 0.45 0.03 0.09 0.00 0.00 178.44 179.40 3dtr h ARG 136 N 0.57 0.32 0.10 1.13 -0.00 -1.35 0.22 114.38 115.38 3dtr h ARG 136 Ca 0.18 -0.02 -0.25 0.00 -0.50 0.00 0.00 59.98 59.40 3dtr h ARG 136 Cb -0.00 -0.07 0.02 0.00 0.00 0.00 0.00 29.97 29.92 3dtr h ARG 136 CO -0.08 0.21 -1.03 0.00 0.00 0.00 0.00 179.97 179.08 3dtr h ALA 137 N 1.68 -0.02 -0.54 0.04 0.00 -1.32 -3.30 119.26 115.80 3dtr h ALA 137 Ca 0.32 -0.72 0.01 0.00 0.00 0.00 0.00 54.91 54.53 3dtr h ALA 137 Cb 0.80 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 3dtr h ALA 137 CO -0.08 0.55 0.35 0.37 0.00 0.00 0.00 179.25 180.43 3dtr h GLN 138 N 0.06 0.68 0.00 0.00 4.15 -0.04 -1.10 115.11 118.85 3dtr h GLN 138 Ca -0.16 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.22 3dtr h GLN 138 Cb 1.74 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 29.28 3dtr h GLN 138 CO 0.20 0.45 0.00 0.00 -1.93 0.00 0.00 178.83 177.54 3dtr n ALA 139 N -2.26 1.87 0.06 3.38 0.00 -0.06 -1.22 120.51 122.28 3dtr n ALA 139 Ca 0.04 -0.07 0.01 0.00 0.00 0.00 0.00 53.44 53.41 3dtr n ALA 139 Cb 0.05 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.28 3dtr n ALA 139 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3dtr n LEU 140 N -1.18 0.72 0.00 0.00 4.77 -0.66 -1.44 117.00 119.20 3dtr n LEU 140 Ca 0.08 -0.81 0.00 0.00 -0.03 0.00 0.00 56.01 55.25 3dtr n LEU 140 Cb 0.09 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 3dtr n LEU 140 CO 0.09 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 3dtr n GLY 141 N 0.44 0.41 3.90 -0.72 0.00 -0.36 -4.96 105.19 103.91 3dtr n GLY 141 Ca 0.01 -0.89 -0.28 0.00 0.00 0.00 0.00 46.02 44.85 3dtr n GLY 141 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3dtr s MET 142 N -1.62 3.58 0.95 1.61 -1.94 -0.51 -5.00 119.30 116.38 3dtr s MET 142 Ca 0.00 0.34 -0.11 0.00 -1.71 0.00 0.00 55.69 54.21 3dtr s MET 142 Cb 0.00 -2.32 0.15 0.00 2.01 0.00 0.00 34.83 34.67 3dtr s MET 142 CO 0.00 -0.25 1.04 0.41 -0.01 0.00 0.00 175.02 176.21 3dtr n GLY 143 N -2.22 -0.76 1.82 -0.03 0.00 -1.26 -4.49 105.19 98.24 3dtr n GLY 143 Ca 0.02 -0.77 -0.12 0.00 0.00 0.00 0.00 46.02 45.14 3dtr n GLY 143 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3dtr n LYS 144 N -4.02 2.59 0.02 1.61 4.01 -1.26 -4.66 118.16 116.44 3dtr n LYS 144 Ca 0.10 -3.07 -0.13 0.00 -0.51 0.00 0.00 58.31 54.71 3dtr n LYS 144 Cb 0.52 -2.08 -0.07 0.00 -0.51 0.00 0.00 35.03 32.90 3dtr n LYS 144 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 3dtr h HIS 145 N 1.50 -1.25 -0.42 2.13 3.86 -1.98 -1.95 115.15 117.04 3dtr h HIS 145 Ca 0.40 0.05 0.09 0.00 -1.16 0.00 0.00 60.37 59.74 3dtr h HIS 145 Cb 2.34 0.56 -0.09 0.00 1.06 0.00 0.00 27.41 31.29 3dtr h HIS 145 CO 1.31 -0.49 -0.22 1.15 0.86 0.00 0.00 177.93 180.54 3dtr h THR 146 N -0.53 0.38 -0.70 2.45 2.02 -1.95 0.39 112.91 114.97 3dtr h THR 146 Ca 0.06 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.28 3dtr h THR 146 Cb 0.64 0.38 -0.05 0.00 -1.74 0.00 0.00 68.15 67.38 3dtr h THR 146 CO -0.38 0.00 0.43 0.00 0.37 0.00 0.00 175.52 175.94 3dtr h ALA 147 N 1.12 0.93 -0.33 6.16 0.00 -1.68 -0.55 119.26 124.91 3dtr h ALA 147 Ca 0.20 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 3dtr h ALA 147 Cb 0.45 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3dtr h ALA 147 CO -0.50 0.17 -0.24 -1.49 0.00 0.00 0.00 179.25 177.19 3dtr h TRP 148 N 0.82 0.88 -0.74 0.00 -0.00 -0.61 -1.41 115.95 114.89 3dtr h TRP 148 Ca 0.29 -0.24 0.03 0.00 -0.00 0.00 0.00 58.89 58.97 3dtr h TRP 148 Cb 0.08 -0.19 -0.04 0.00 -0.00 0.00 0.00 29.16 29.00 3dtr h TRP 148 CO -0.05 0.99 0.47 0.00 -0.00 0.00 0.00 178.44 179.85 3dtr h ALA 149 N 0.75 0.96 -0.30 1.49 0.00 -0.11 -2.06 119.26 119.98 3dtr h ALA 149 Ca 0.06 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3dtr h ALA 149 Cb 0.80 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3dtr h ALA 149 CO 0.06 0.28 0.07 0.35 0.00 0.00 0.00 179.25 180.01 3dtr h PHE 150 N 0.93 0.44 -0.15 0.00 3.57 -0.89 -2.41 116.94 118.42 3dtr h PHE 150 Ca 0.29 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.74 3dtr h PHE 150 Cb -0.01 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 3dtr h PHE 150 CO -0.03 0.39 -0.02 1.25 -2.23 0.00 0.00 178.31 177.67 3dtr h LEU 151 N 0.43 0.20 0.38 0.59 5.85 -0.51 -1.70 115.31 120.54 3dtr h LEU 151 Ca 0.10 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 3dtr h LEU 151 Cb 0.18 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.16 3dtr h LEU 151 CO -0.00 0.26 -0.18 -1.28 -0.34 0.00 0.00 178.44 176.89 3dtr h SER 152 N 0.22 -0.43 -0.02 1.25 0.87 -1.38 -0.13 113.55 113.93 3dtr h SER 152 Ca 0.05 -0.03 0.03 0.00 -1.23 0.00 0.00 61.79 60.61 3dtr h SER 152 Cb 0.18 0.11 -0.05 0.00 -0.44 0.00 0.00 62.40 62.20 3dtr h SER 152 CO 0.01 -0.24 -0.37 0.00 -0.53 0.00 0.00 176.83 175.69 3dtr h ALA 153 N 0.01 -0.56 -1.04 6.23 0.00 -1.55 -1.09 119.26 121.25 3dtr h ALA 153 Ca -0.05 -0.03 0.27 0.00 0.00 0.00 0.00 54.91 55.10 3dtr h ALA 153 Cb 0.44 0.67 -0.09 0.00 0.00 0.00 0.00 17.79 18.80 3dtr h ALA 153 CO 0.08 -0.89 0.68 0.82 0.00 0.00 0.00 179.25 179.94 3dtr h ILE 154 N -0.52 0.52 0.26 0.00 2.04 -1.08 -1.10 117.51 117.63 3dtr h ILE 154 Ca 0.06 -0.13 0.01 0.00 1.00 0.00 0.00 64.86 65.80 3dtr h ILE 154 Cb 0.61 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.78 3dtr h ILE 154 CO -0.30 0.07 -0.38 -0.25 0.00 0.00 0.00 178.15 177.28 3dtr h TRP 155 N 0.37 -1.05 -0.95 1.37 -0.00 0.32 0.35 115.95 116.36 3dtr h TRP 155 Ca 0.59 0.02 0.02 0.00 -0.00 0.00 0.00 58.89 59.52 3dtr h TRP 155 Cb 1.54 0.43 -0.05 0.00 -0.00 0.00 0.00 29.16 31.07 3dtr h TRP 155 CO -0.00 -0.51 0.63 1.25 -0.00 0.00 0.00 178.44 179.80 3dtr h LEU 156 N -0.70 1.06 -0.18 0.65 5.85 -1.08 -0.28 115.31 120.63 3dtr h LEU 156 Ca -0.00 -0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.59 3dtr h LEU 156 Cb 0.67 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.45 3dtr h LEU 156 CO -0.14 0.74 -0.30 -0.25 -0.34 0.00 0.00 178.44 178.15 3dtr h TRP 157 N 1.24 0.64 -0.65 1.25 7.01 -1.28 -1.25 115.95 122.91 3dtr h TRP 157 Ca 0.36 -0.22 0.10 0.00 2.11 0.00 0.00 58.89 61.24 3dtr h TRP 157 Cb -0.06 -0.12 -0.08 0.00 -2.10 0.00 0.00 29.16 26.80 3dtr h TRP 157 CO -0.00 0.94 0.26 0.52 -2.79 0.00 0.00 178.44 177.37 3dtr h MET 158 N 0.16 0.43 -0.35 2.65 2.86 0.11 -2.53 114.93 118.27 3dtr h MET 158 Ca 0.01 -0.03 -0.11 0.00 -2.06 0.00 0.00 59.70 57.51 3dtr h MET 158 Cb 0.89 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.44 3dtr h MET 158 CO 0.07 0.29 -0.23 0.28 1.06 0.00 0.00 176.91 178.38 3dtr h VAL 159 N 0.45 1.29 0.06 -2.22 2.07 -0.92 -0.36 116.25 116.61 3dtr h VAL 159 Ca 0.33 -1.37 -0.00 0.00 0.82 0.00 0.00 66.70 66.48 3dtr h VAL 159 Cb 0.41 1.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 3dtr h VAL 159 CO -0.31 0.45 -0.03 -0.07 0.02 0.00 0.00 177.57 177.63 3dtr h LEU 160 N 0.55 -0.07 -2.23 2.57 3.38 -0.83 -2.01 115.31 116.66 3dtr h LEU 160 Ca 0.07 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.86 3dtr h LEU 160 Cb 0.78 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.55 3dtr h LEU 160 CO 0.06 0.14 0.00 0.61 0.09 0.00 0.00 178.44 179.34 3dtr n GLY 161 N -0.60 1.39 1.81 0.83 0.00 -1.00 -4.36 105.19 103.27 3dtr n GLY 161 Ca -0.08 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.54 3dtr n GLY 161 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3dtr n PHE 162 N 0.68 -1.35 -0.12 1.61 7.35 -0.51 -4.79 117.46 120.33 3dtr n PHE 162 Ca 0.11 0.24 -0.11 0.00 -0.76 0.00 0.00 57.45 56.92 3dtr n PHE 162 Cb 0.39 0.45 -0.02 0.00 0.35 0.00 0.00 39.48 40.65 3dtr n PHE 162 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 3dtr h ILE 163 N 0.00 1.27 0.01 -2.13 2.04 -1.23 -1.98 117.51 115.49 3dtr h ILE 163 Ca 0.00 -1.08 -0.00 0.00 1.00 0.00 0.00 64.86 64.78 3dtr h ILE 163 Cb 0.00 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.33 3dtr h ILE 163 CO 0.00 0.36 -0.01 -0.09 0.00 0.00 0.00 178.15 178.41 3dtr h ARG 164 N 0.46 -0.02 -0.96 2.37 2.43 -1.59 -1.38 114.38 115.70 3dtr h ARG 164 Ca 0.09 0.00 0.19 0.00 -0.81 0.00 0.00 59.98 59.46 3dtr h ARG 164 Cb 0.54 0.00 -0.09 0.00 -0.42 0.00 0.00 29.97 30.01 3dtr h ARG 164 CO 0.03 0.56 0.61 -1.35 -1.51 0.00 0.00 179.97 178.31 3dtr h PRO 165 N -0.60 0.60 -0.19 0.20 0.11 -1.77 -1.23 132.00 129.11 3dtr h PRO 165 Ca -0.00 -0.04 -0.21 0.00 0.11 0.00 0.00 66.00 65.86 3dtr h PRO 165 Cb 0.58 -0.13 0.01 0.00 0.11 0.00 0.00 31.00 31.57 3dtr h PRO 165 CO 0.00 0.40 -0.70 0.82 -0.21 0.00 0.00 178.00 178.31 3dtr h ILE 166 N 0.62 1.28 0.00 4.15 2.04 -1.28 -1.36 117.51 122.96 3dtr h ILE 166 Ca 0.53 -1.91 0.00 0.00 1.00 0.00 0.00 64.86 64.48 3dtr h ILE 166 Cb 1.01 1.88 0.00 0.00 -0.74 0.00 0.00 36.82 38.96 3dtr h ILE 166 CO -0.28 0.61 0.00 0.18 0.00 0.00 0.00 178.15 178.66 3dtr n LEU 167 N -3.95 0.66 0.03 1.44 4.77 -0.53 -2.92 117.00 116.51 3dtr n LEU 167 Ca -0.06 0.60 0.09 0.00 -0.03 0.00 0.00 56.01 56.61 3dtr n LEU 167 Cb 0.70 -0.44 -0.10 0.00 -2.33 0.00 0.00 43.42 41.25 3dtr n LEU 167 CO 0.52 -0.32 -0.45 0.23 -1.33 0.00 0.00 177.39 176.04 3dtr n MET 168 N -2.16 0.64 0.00 3.23 2.81 -0.54 -4.99 117.12 116.11 3dtr n MET 168 Ca 0.04 -0.04 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 3dtr n MET 168 Cb 0.33 -1.66 0.00 0.00 -0.71 0.00 0.00 33.22 31.19 3dtr n MET 168 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3dtr n GLY 169 N 1.26 0.74 3.58 3.03 0.00 -0.98 -5.08 105.19 107.74 3dtr n GLY 169 Ca -0.04 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.83 3dtr n GLY 169 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dtr s SER 170 N -2.43 -0.65 0.57 1.61 1.04 -0.55 -3.03 113.70 110.25 3dtr s SER 170 Ca 0.00 0.98 0.34 0.00 0.48 0.00 0.00 55.95 57.75 3dtr s SER 170 Cb 0.00 0.90 1.63 0.00 0.10 0.00 0.00 66.02 68.65 3dtr s SER 170 CO 0.00 -0.41 2.09 -0.50 0.98 0.00 0.00 173.24 175.40 3dtr h TRP 171 N 3.82 0.00 0.00 5.02 -0.00 -1.65 -2.89 115.95 120.25 3dtr h TRP 171 Ca -0.27 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.62 3dtr h TRP 171 Cb 1.15 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 30.31 3dtr h TRP 171 CO 0.37 0.05 0.00 0.66 -0.00 0.00 0.00 178.44 179.52 3dtr h SER 172 N 0.00 0.00 0.27 -3.49 4.64 -1.80 0.37 113.55 113.54 3dtr h SER 172 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dtr h SER 172 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 3dtr h SER 172 CO 0.01 0.00 -0.03 -0.62 -0.87 0.00 0.00 176.83 175.31 3dtr n GLU 173 N -2.80 0.79 -2.08 4.77 -0.58 -1.09 -4.89 120.64 114.77 3dtr n GLU 173 Ca -0.02 -0.15 -0.28 0.00 -0.42 0.00 0.00 57.16 56.29 3dtr n GLU 173 Cb 0.07 -1.50 0.14 0.00 -0.57 0.00 0.00 31.44 29.58 3dtr n GLU 173 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3dtr s ALA 174 N -2.31 2.69 -0.09 0.62 0.00 0.12 -4.78 121.76 118.00 3dtr s ALA 174 Ca 0.36 -1.16 -0.20 0.00 0.00 0.00 0.00 51.96 50.96 3dtr s ALA 174 Cb 0.21 -2.65 -0.04 0.00 0.00 0.00 0.00 23.12 20.64 3dtr s ALA 174 CO 0.43 -1.98 0.56 0.08 0.00 0.00 0.00 175.76 174.85 3dtr s VAL 175 N -3.62 5.13 0.48 0.00 1.01 -1.26 -4.86 120.40 117.27 3dtr s VAL 175 Ca 0.69 1.14 -0.21 0.00 0.00 0.00 0.00 61.98 63.60 3dtr s VAL 175 Cb -0.06 -3.90 -0.08 0.00 0.00 0.00 0.00 36.38 32.33 3dtr s VAL 175 CO 0.50 0.30 1.04 -2.16 0.00 0.00 0.00 175.10 174.78 3dtr s PRO 176 N 0.65 3.84 -0.35 2.72 0.04 -1.26 -4.82 135.00 135.81 3dtr s PRO 176 Ca 0.30 1.39 -0.26 0.00 0.04 0.00 0.00 61.00 62.47 3dtr s PRO 176 Cb -0.16 -2.15 0.01 0.00 0.04 0.00 0.00 34.50 32.24 3dtr s PRO 176 CO 0.13 -0.40 0.93 0.71 0.04 0.00 0.00 177.00 178.41 3dtr s TYR 177 N -1.93 3.10 0.00 0.56 2.02 0.57 -4.40 117.35 117.26 3dtr s TYR 177 Ca 0.66 0.83 0.00 0.00 -0.37 0.00 0.00 57.07 58.19 3dtr s TYR 177 Cb -0.17 -3.60 0.00 0.00 -0.40 0.00 0.00 41.96 37.79 3dtr s TYR 177 CO 0.21 -0.79 0.00 0.41 -1.57 0.00 0.00 175.55 173.81 3dtr n GLY 178 N 4.29 1.80 0.25 0.71 0.00 -1.26 -0.17 105.19 110.81 3dtr n GLY 178 Ca 0.07 -0.45 -0.08 0.00 0.00 0.00 0.00 46.02 45.55 3dtr n GLY 178 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3dtr h ILE 179 N 1.46 0.00 0.00 -0.61 1.08 -1.77 -2.84 117.51 114.83 3dtr h ILE 179 Ca 0.00 -0.58 -0.20 0.00 -0.39 0.00 0.00 64.86 63.69 3dtr h ILE 179 Cb 0.00 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 33.74 3dtr h ILE 179 CO 0.00 0.00 -0.88 -0.26 -0.69 0.00 0.00 178.15 176.32 3dtr h PHE 180 N -1.13 0.32 -0.47 1.37 0.04 -1.56 -3.23 116.94 112.28 3dtr h PHE 180 Ca -0.06 -0.18 -0.09 0.00 2.80 0.00 0.00 57.97 60.45 3dtr h PHE 180 Cb 0.42 -0.04 -0.02 0.00 2.20 0.00 0.00 35.95 38.52 3dtr h PHE 180 CO 0.00 0.99 -0.06 0.66 -0.60 0.00 0.00 178.31 179.30 3dtr h SER 181 N 0.12 0.79 1.25 2.17 4.64 -1.75 -1.11 113.55 119.67 3dtr h SER 181 Ca -0.05 -0.22 -0.10 0.00 -0.47 0.00 0.00 61.79 60.95 3dtr h SER 181 Cb 1.50 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 63.37 3dtr h SER 181 CO 0.14 0.89 -0.49 1.12 -0.87 0.00 0.00 176.83 177.62 3dtr h HIS 182 N 0.74 0.00 -0.14 4.77 2.07 -1.58 -1.31 115.15 119.70 3dtr h HIS 182 Ca 0.13 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.65 3dtr h HIS 182 Cb 0.53 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.51 3dtr h HIS 182 CO 0.03 0.49 0.07 -0.07 -3.07 0.00 0.00 177.93 175.38 3dtr h LEU 183 N 0.00 0.19 -0.23 6.12 3.38 -1.49 -2.42 115.31 120.86 3dtr h LEU 183 Ca -0.00 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 3dtr h LEU 183 Cb 1.24 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 3dtr h LEU 183 CO 0.06 0.25 0.13 0.44 0.09 0.00 0.00 178.44 179.41 3dtr h ASP 184 N 0.11 0.29 -0.99 -0.43 3.32 -0.99 -1.49 116.42 116.24 3dtr h ASP 184 Ca 0.05 -0.09 0.14 0.00 0.02 0.00 0.00 57.03 57.15 3dtr h ASP 184 Cb 0.11 -0.07 -0.09 0.00 0.22 0.00 0.00 39.33 39.50 3dtr h ASP 184 CO -0.01 0.30 0.62 -0.25 -1.72 0.00 0.00 179.24 178.18 3dtr h TRP 185 N 0.26 1.07 0.06 4.55 7.01 -1.22 0.31 115.95 127.99 3dtr h TRP 185 Ca 0.08 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.11 3dtr h TRP 185 Cb 0.07 -0.33 0.00 0.00 -2.10 0.00 0.00 29.16 26.80 3dtr h TRP 185 CO -0.03 0.37 -0.03 1.15 -2.79 0.00 0.00 178.44 177.11 3dtr h THR 186 N 0.88 1.20 -0.99 2.65 2.02 -1.10 0.21 112.91 117.78 3dtr h THR 186 Ca 0.51 -0.91 0.05 0.00 0.77 0.00 0.00 66.41 66.83 3dtr h THR 186 Cb 0.65 1.80 -0.06 0.00 -1.74 0.00 0.00 68.15 68.80 3dtr h THR 186 CO -0.29 0.23 0.65 -1.13 0.37 0.00 0.00 175.52 175.35 3dtr h ASN 187 N -0.48 1.07 0.11 4.18 -1.24 -0.37 -2.56 115.58 116.28 3dtr h ASN 187 Ca -0.01 -0.00 -0.22 0.00 0.71 0.00 0.00 56.30 56.78 3dtr h ASN 187 Cb 0.43 -0.24 0.01 0.00 0.73 0.00 0.00 38.32 39.25 3dtr h ASN 187 CO 0.01 0.72 -0.84 -1.13 -1.29 0.00 0.00 177.43 174.90 3dtr h ASN 188 N 1.23 0.70 -0.85 1.15 -0.00 -0.30 -3.12 115.58 114.39 3dtr h ASN 188 Ca 0.41 -0.50 0.10 0.00 -0.00 0.00 0.00 56.30 56.31 3dtr h ASN 188 Cb 0.05 -0.21 -0.06 0.00 -0.00 0.00 0.00 38.32 38.10 3dtr h ASN 188 CO -0.14 1.28 0.55 0.15 -0.00 0.00 0.00 177.43 179.27 3dtr h PHE 189 N 0.37 0.86 -0.29 0.67 3.04 -0.16 -1.84 116.94 119.59 3dtr h PHE 189 Ca -0.06 0.02 -0.19 0.00 3.98 0.00 0.00 57.97 61.72 3dtr h PHE 189 Cb 1.45 -0.28 0.00 0.00 2.56 0.00 0.00 35.95 39.69 3dtr h PHE 189 CO 0.07 0.39 -0.55 1.03 -2.02 0.00 0.00 178.31 177.22 3dtr h SER 190 N 0.79 0.98 -0.86 0.41 0.87 -1.46 -2.87 113.55 111.41 3dtr h SER 190 Ca 0.40 -0.53 -0.03 0.00 -1.23 0.00 0.00 61.79 60.40 3dtr h SER 190 Cb 0.48 -0.28 -0.04 0.00 -0.44 0.00 0.00 62.40 62.11 3dtr h SER 190 CO -0.17 1.33 0.42 -0.07 -0.53 0.00 0.00 176.83 177.82 3dtr h LEU 191 N 0.67 1.12 -0.54 2.23 3.38 -1.34 0.45 115.31 121.28 3dtr h LEU 191 Ca 0.01 -0.13 -0.15 0.00 0.09 0.00 0.00 57.88 57.71 3dtr h LEU 191 Cb 1.16 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 3dtr h LEU 191 CO 0.12 0.93 -0.72 0.58 0.09 0.00 0.00 178.44 179.45 3dtr h VAL 192 N 1.22 1.49 -0.66 1.22 2.07 -1.35 -3.17 116.25 117.07 3dtr h VAL 192 Ca 0.30 -2.47 0.00 0.00 0.82 0.00 0.00 66.70 65.34 3dtr h VAL 192 Cb 0.10 2.34 0.00 0.00 -1.52 0.00 0.00 31.29 32.21 3dtr h VAL 192 CO -0.04 0.70 0.00 1.41 0.02 0.00 0.00 177.57 179.66 3dtr n HIS 193 N -3.65 0.88 -1.65 1.57 8.25 -1.06 -4.80 115.22 114.75 3dtr n HIS 193 Ca -0.01 -0.44 0.00 0.00 -0.26 0.00 0.00 57.72 57.01 3dtr n HIS 193 Cb 0.71 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.82 3dtr n HIS 193 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dtr n GLY 194 N 1.61 0.90 1.44 -1.41 0.00 -0.95 0.38 105.19 107.16 3dtr n GLY 194 Ca 0.23 -0.56 -0.00 0.00 0.00 0.00 0.00 46.02 45.68 3dtr n GLY 194 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3dtr n ASN 195 N 1.25 -2.68 0.10 1.61 5.15 0.15 -3.39 115.26 117.46 3dtr n ASN 195 Ca 0.00 0.30 0.07 0.00 -0.60 0.00 0.00 54.58 54.35 3dtr n ASN 195 Cb 0.36 -1.78 0.37 0.00 -0.53 0.00 0.00 39.78 38.20 3dtr n ASN 195 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3dtr n LEU 196 N 0.33 0.35 0.14 1.20 4.32 -1.25 -1.88 117.00 120.20 3dtr n LEU 196 Ca -0.03 0.66 0.12 0.00 -0.02 0.00 0.00 56.01 56.73 3dtr n LEU 196 Cb 0.05 -0.70 0.52 0.00 -1.62 0.00 0.00 43.42 41.67 3dtr n LEU 196 CO 0.03 -0.76 0.85 0.49 -1.22 0.00 0.00 177.39 176.78 3dtr n PHE 197 N -1.97 0.82 1.04 -1.77 3.72 -1.26 -1.07 117.46 116.96 3dtr n PHE 197 Ca -0.01 0.34 0.11 0.00 -0.05 0.00 0.00 57.45 57.85 3dtr n PHE 197 Cb 0.03 -1.05 0.04 0.00 -0.94 0.00 0.00 39.48 37.56 3dtr n PHE 197 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3dtr n TYR 198 N -2.26 0.00 -2.44 1.38 4.01 -0.79 -4.83 117.16 112.23 3dtr n TYR 198 Ca 0.01 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.32 3dtr n TYR 198 Cb 0.19 -0.03 -0.02 0.00 -0.31 0.00 0.00 39.34 39.16 3dtr n TYR 198 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 3dtr s ASN 199 N -2.66 6.52 0.40 7.72 3.84 -0.23 -4.83 114.94 125.69 3dtr s ASN 199 Ca 0.16 0.86 0.28 0.00 0.21 0.00 0.00 52.86 54.37 3dtr s ASN 199 Cb 0.18 -2.54 1.00 0.00 -0.55 0.00 0.00 41.25 39.33 3dtr s ASN 199 CO 0.66 -1.27 1.81 1.55 -2.79 0.00 0.00 177.10 177.06 3dtr h PRO 200 N 9.86 0.00 -0.30 0.43 0.13 -1.88 -1.81 132.00 138.42 3dtr h PRO 200 Ca -0.26 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.79 3dtr h PRO 200 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 3dtr h PRO 200 CO 1.08 0.00 -0.13 0.74 -0.23 0.00 0.00 178.00 179.46 3dtr h PHE 201 N 0.00 0.72 -0.86 1.56 0.04 -1.90 -0.99 116.94 115.51 3dtr h PHE 201 Ca 0.00 -0.17 0.10 0.00 2.80 0.00 0.00 57.97 60.70 3dtr h PHE 201 Cb 0.58 -0.17 -0.08 0.00 2.20 0.00 0.00 35.95 38.49 3dtr h PHE 201 CO 0.00 0.85 0.50 1.25 -0.60 0.00 0.00 178.31 180.31 3dtr h HIS 202 N 0.39 0.90 -0.17 -0.55 2.76 -1.63 0.57 115.15 117.42 3dtr h HIS 202 Ca 0.07 0.03 -0.16 0.00 -2.20 0.00 0.00 60.37 58.11 3dtr h HIS 202 Cb 0.65 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 29.33 3dtr h HIS 202 CO 0.06 0.35 -0.56 0.78 -1.30 0.00 0.00 177.93 177.25 3dtr h GLY 203 N 0.81 0.57 0.81 5.26 0.00 -1.20 -1.73 103.07 107.60 3dtr h GLY 203 Ca 0.42 -0.68 -0.03 0.00 0.00 0.00 0.00 47.33 47.05 3dtr h GLY 203 CO -0.26 0.61 0.01 -2.00 0.00 0.00 0.00 176.54 174.89 3dtr h LEU 204 N 0.40 0.32 -1.07 3.11 5.85 0.07 -2.69 115.31 121.30 3dtr h LEU 204 Ca 0.00 -0.30 0.08 0.00 0.84 0.00 0.00 57.88 58.50 3dtr h LEU 204 Cb 1.11 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.98 3dtr h LEU 204 CO 0.10 0.54 0.62 -1.28 -0.34 0.00 0.00 178.44 178.08 3dtr h SER 205 N 0.08 0.96 -0.36 1.25 0.87 0.24 -0.86 113.55 115.73 3dtr h SER 205 Ca 0.05 0.02 -0.13 0.00 -1.23 0.00 0.00 61.79 60.50 3dtr h SER 205 Cb 0.37 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 3dtr h SER 205 CO 0.01 0.59 -0.26 0.40 -0.53 0.00 0.00 176.83 177.04 3dtr h ILE 206 N 1.08 1.27 -0.69 2.23 2.04 -1.24 -1.82 117.51 120.38 3dtr h ILE 206 Ca 0.43 -1.41 0.04 0.00 1.00 0.00 0.00 64.86 64.91 3dtr h ILE 206 Cb 0.25 1.23 -0.05 0.00 -0.74 0.00 0.00 36.82 37.51 3dtr h ILE 206 CO -0.18 0.48 0.42 0.00 0.00 0.00 0.00 178.15 178.86 3dtr h ALA 207 N 0.95 0.91 0.00 1.87 0.00 -0.84 0.13 119.26 122.28 3dtr h ALA 207 Ca 0.09 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 3dtr h ALA 207 Cb 0.81 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 3dtr h ALA 207 CO 0.07 0.16 -0.57 0.74 0.00 0.00 0.00 179.25 179.65 3dtr h PHE 208 N 0.80 0.00 0.11 0.00 0.04 -1.26 0.14 116.94 116.76 3dtr h PHE 208 Ca 0.29 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 61.05 3dtr h PHE 208 Cb 0.07 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.23 3dtr h PHE 208 CO -0.05 0.57 -0.05 1.25 -0.60 0.00 0.00 178.31 179.42 3dtr h LEU 209 N 0.00 -0.12 -0.93 1.54 5.85 -0.77 -0.09 115.31 120.80 3dtr h LEU 209 Ca -0.01 -0.45 0.11 0.00 0.84 0.00 0.00 57.88 58.38 3dtr h LEU 209 Cb 1.16 0.03 -0.08 0.00 0.37 0.00 0.00 40.66 42.14 3dtr h LEU 209 CO 0.07 0.45 0.56 1.88 -0.34 0.00 0.00 178.44 181.06 3dtr h TYR 210 N -0.76 1.01 -0.48 1.25 0.05 -0.77 -1.94 116.97 115.33 3dtr h TYR 210 Ca -0.01 0.03 -0.11 0.00 0.05 0.00 0.00 58.73 58.69 3dtr h TYR 210 Cb 0.56 -0.32 -0.02 0.00 1.01 0.00 0.00 36.73 37.97 3dtr h TYR 210 CO 0.10 0.40 -0.14 0.78 -1.05 0.00 0.00 178.16 178.25 3dtr h GLY 211 N 0.90 0.99 0.98 3.88 0.00 -0.92 -1.55 103.07 107.34 3dtr h GLY 211 Ca 0.46 -0.80 0.01 0.00 0.00 0.00 0.00 47.33 47.00 3dtr h GLY 211 CO -0.26 0.73 0.54 1.76 0.00 0.00 0.00 176.54 179.30 3dtr h SER 212 N 0.81 0.92 -0.25 0.19 0.02 -0.22 0.52 113.55 115.54 3dtr h SER 212 Ca 0.12 -0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 61.01 3dtr h SER 212 Cb 0.68 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 3dtr h SER 212 CO 0.05 0.66 -0.02 0.00 -1.14 0.00 0.00 176.83 176.38 3dtr h ALA 213 N 1.31 0.33 -0.48 3.77 0.00 -1.22 0.40 119.26 123.37 3dtr h ALA 213 Ca 0.30 -0.23 0.06 0.00 0.00 0.00 0.00 54.91 55.05 3dtr h ALA 213 Cb -0.09 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 17.55 3dtr h ALA 213 CO -0.08 0.08 0.17 1.25 0.00 0.00 0.00 179.25 180.67 3dtr h LEU 214 N 0.21 0.17 -0.00 0.00 5.85 -0.36 0.77 115.31 121.94 3dtr h LEU 214 Ca 0.07 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 3dtr h LEU 214 Cb 0.45 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.52 3dtr h LEU 214 CO 0.02 0.12 -0.00 0.25 -0.34 0.00 0.00 178.44 178.49 3dtr h LEU 215 N 0.34 0.00 -1.82 2.25 5.85 0.10 -1.05 115.31 120.98 3dtr h LEU 215 Ca 0.23 -0.73 -0.03 0.00 0.84 0.00 0.00 57.88 58.19 3dtr h LEU 215 Cb 0.24 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.26 3dtr h LEU 215 CO -0.24 0.73 -0.14 0.15 -0.34 0.00 0.00 178.44 178.60 3dtr h PHE 216 N -0.73 0.00 -0.28 1.25 3.04 -0.90 0.62 116.94 119.95 3dtr h PHE 216 Ca -0.00 0.00 -0.03 0.00 3.98 0.00 0.00 57.97 61.92 3dtr h PHE 216 Cb 0.73 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 39.23 3dtr h PHE 216 CO 0.18 0.14 0.04 0.00 -2.02 0.00 0.00 178.31 176.66 3dtr h ALA 217 N 1.86 0.37 0.19 2.41 0.00 -0.74 -0.82 119.26 122.52 3dtr h ALA 217 Ca -0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 3dtr h ALA 217 Cb 0.31 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3dtr h ALA 217 CO 0.02 0.06 -0.09 0.52 0.00 0.00 0.00 179.25 179.76 3dtr h MET 218 N 0.27 -0.24 0.04 0.00 2.86 0.43 -1.75 114.93 116.54 3dtr h MET 218 Ca 0.08 0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.74 3dtr h MET 218 Cb 0.34 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.06 3dtr h MET 218 CO 0.01 -0.01 -0.02 1.25 1.06 0.00 0.00 176.91 179.19 3dtr h HIS 219 N -0.44 -0.05 0.18 -0.22 6.17 0.14 -1.71 115.15 119.23 3dtr h HIS 219 Ca -0.03 -0.00 0.01 0.00 0.71 0.00 0.00 60.37 61.06 3dtr h HIS 219 Cb 0.34 0.02 -0.02 0.00 2.52 0.00 0.00 27.41 30.26 3dtr h HIS 219 CO -0.01 0.02 -0.23 0.78 0.71 0.00 0.00 177.93 179.20 3dtr h GLY 220 N -0.10 -0.47 2.00 5.26 0.00 -1.16 -0.75 103.07 107.85 3dtr h GLY 220 Ca -0.01 0.27 -0.03 0.00 0.00 0.00 0.00 47.33 47.57 3dtr h GLY 220 CO 0.01 -0.21 -0.12 0.00 0.00 0.00 0.00 176.54 176.21 3dtr h ALA 221 N 0.26 1.54 0.23 3.60 0.00 -1.24 -1.80 119.26 121.84 3dtr h ALA 221 Ca 0.01 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3dtr h ALA 221 Cb 0.46 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3dtr h ALA 221 CO -0.09 0.16 -0.11 1.15 0.00 0.00 0.00 179.25 180.36 3dtr h THR 222 N 0.00 0.65 -0.97 0.00 2.02 -0.47 0.32 112.91 114.47 3dtr h THR 222 Ca -0.00 -0.95 0.12 0.00 0.77 0.00 0.00 66.41 66.34 3dtr h THR 222 Cb 0.26 1.07 -0.08 0.00 -1.74 0.00 0.00 68.15 67.66 3dtr h THR 222 CO 0.02 0.16 0.60 0.40 0.37 0.00 0.00 175.52 177.06 3dtr h ILE 223 N -0.91 0.91 -0.53 3.11 1.08 -0.92 0.18 117.51 120.42 3dtr h ILE 223 Ca -0.03 -0.32 -0.09 0.00 -0.39 0.00 0.00 64.86 64.02 3dtr h ILE 223 Cb 0.50 -0.12 -0.02 0.00 -3.07 0.00 0.00 36.82 34.11 3dtr h ILE 223 CO 0.05 0.17 -0.03 -0.07 -0.69 0.00 0.00 178.15 177.59 3dtr h LEU 224 N 0.95 0.91 -1.79 1.44 3.38 -1.27 0.29 115.31 119.22 3dtr h LEU 224 Ca 0.48 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 58.16 3dtr h LEU 224 Cb 0.47 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 3dtr h LEU 224 CO -0.27 0.98 -0.15 0.00 0.09 0.00 0.00 178.44 179.09 3dtr h ALA 225 N 1.11 1.48 -0.14 1.53 0.00 0.15 -2.82 119.26 120.57 3dtr h ALA 225 Ca 0.15 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3dtr h ALA 225 Cb 0.54 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3dtr h ALA 225 CO 0.03 0.19 0.00 1.33 0.00 0.00 0.00 179.25 180.80 3dtr n VAL 226 N -3.97 1.46 0.28 0.00 0.24 -0.40 -4.50 118.33 111.44 3dtr n VAL 226 Ca -0.02 -1.47 0.18 0.00 -2.04 0.00 0.00 64.34 60.98 3dtr n VAL 226 Cb 0.24 0.18 0.73 0.00 -1.47 0.00 0.00 33.84 33.52 3dtr n VAL 226 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 3dtr h SER 227 N 0.88 0.00 0.00 -1.34 4.64 -0.67 -0.38 113.55 116.69 3dtr h SER 227 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dtr h SER 227 Cb 0.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 3dtr h SER 227 CO 0.05 0.01 0.01 -2.11 -0.87 0.00 0.00 176.83 173.91 3dtr n ARG 228 N -3.10 0.00 -0.36 4.77 1.85 -1.26 -0.80 116.66 117.76 3dtr n ARG 228 Ca 0.00 0.11 0.04 0.00 -1.00 0.00 0.00 57.85 57.01 3dtr n ARG 228 Cb 0.29 -1.51 0.06 0.00 -1.05 0.00 0.00 32.46 30.25 3dtr n ARG 228 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3dtr n PHE 229 N -1.08 0.00 -2.96 2.89 3.72 -0.17 -5.00 117.46 114.86 3dtr n PHE 229 Ca 0.00 -0.47 -0.10 0.00 -0.05 0.00 0.00 57.45 56.83 3dtr n PHE 229 Cb 0.01 -0.10 0.04 0.00 -0.94 0.00 0.00 39.48 38.49 3dtr n PHE 229 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3dtr n GLY 230 N -0.61 0.26 0.26 1.37 0.00 0.02 -4.54 105.19 101.95 3dtr n GLY 230 Ca 0.07 -0.25 -0.05 0.00 0.00 0.00 0.00 46.02 45.79 3dtr n GLY 230 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3dtr h GLY 231 N -1.19 0.91 1.98 -0.02 0.00 -1.64 -2.61 103.07 100.50 3dtr h GLY 231 Ca -0.26 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 46.74 3dtr h GLY 231 CO 0.25 0.33 0.01 1.05 0.00 0.00 0.00 176.54 178.18 3dtr h GLU 232 N 0.87 0.00 -3.36 4.80 9.09 -1.86 -3.24 114.58 120.88 3dtr h GLU 232 Ca 0.24 0.00 -0.73 0.00 0.05 0.00 0.00 59.36 58.92 3dtr h GLU 232 Cb -0.09 0.00 -0.10 0.00 -1.65 0.00 0.00 28.75 26.91 3dtr h GLU 232 CO -0.06 0.00 2.61 0.54 0.05 0.00 0.00 179.01 182.15 3dtr n ARG 233 N -2.29 3.66 0.13 1.06 1.74 -0.98 -4.73 116.66 115.24 3dtr n ARG 233 Ca -0.01 -3.13 -0.00 0.00 -0.77 0.00 0.00 57.85 53.94 3dtr n ARG 233 Cb 0.04 -2.93 0.28 0.00 -1.02 0.00 0.00 32.46 28.83 3dtr n ARG 233 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 3dtr h GLU 234 N 5.46 0.16 -0.25 5.56 5.08 -1.84 -2.46 114.58 126.28 3dtr h GLU 234 Ca 0.56 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.81 3dtr h GLU 234 Cb 0.52 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 3dtr h GLU 234 CO 1.68 0.52 -0.02 -0.07 -1.00 0.00 0.00 179.01 180.12 3dtr h LEU 235 N 0.13 0.45 -0.86 1.33 3.38 -1.92 -0.92 115.31 116.91 3dtr h LEU 235 Ca 0.01 -0.33 -0.11 0.00 0.09 0.00 0.00 57.88 57.54 3dtr h LEU 235 Cb 0.74 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 3dtr h LEU 235 CO 0.06 0.67 -0.38 -0.08 0.09 0.00 0.00 178.44 178.80 3dtr h GLU 236 N 0.22 0.38 -0.20 1.13 4.57 -1.89 -1.75 114.58 117.06 3dtr h GLU 236 Ca 0.07 -0.18 -0.07 0.00 -1.18 0.00 0.00 59.36 58.00 3dtr h GLU 236 Cb 0.45 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.02 3dtr h GLU 236 CO 0.02 0.70 -0.19 1.96 -1.18 0.00 0.00 179.01 180.32 3dtr h GLN 237 N 0.32 0.34 -0.28 1.92 1.08 -1.20 0.57 115.11 117.85 3dtr h GLN 237 Ca 0.03 -0.10 -0.09 0.00 -1.45 0.00 0.00 58.65 57.04 3dtr h GLN 237 Cb 0.81 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.20 3dtr h GLN 237 CO 0.07 0.52 -0.17 0.82 -0.95 0.00 0.00 178.83 179.11 3dtr h ILE 238 N 0.31 1.30 0.00 2.54 2.04 -0.82 -2.30 117.51 120.58 3dtr h ILE 238 Ca 0.05 -1.29 0.00 0.00 1.00 0.00 0.00 64.86 64.62 3dtr h ILE 238 Cb 0.52 1.53 0.00 0.00 -0.74 0.00 0.00 36.82 38.13 3dtr h ILE 238 CO 0.03 0.41 0.00 0.00 0.00 0.00 0.00 178.15 178.59 3dtr h ALA 239 N 0.73 1.00 -0.73 1.87 0.00 -0.60 -3.41 119.26 118.13 3dtr h ALA 239 Ca 0.06 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.00 3dtr h ALA 239 Cb 0.71 0.00 -0.19 0.00 0.00 0.00 0.00 17.79 18.31 3dtr h ALA 239 CO 0.05 0.00 -0.31 0.34 0.00 0.00 0.00 179.25 179.33 3dtr s ASP 240 N -5.68 -1.15 -0.07 0.00 2.15 0.19 -5.07 116.67 107.04 3dtr s ASP 240 Ca 0.05 -0.34 -0.36 0.00 0.43 0.00 0.00 52.55 52.33 3dtr s ASP 240 Cb 0.08 1.54 -0.14 0.00 -0.30 0.00 0.00 42.92 44.10 3dtr s ASP 240 CO 0.59 -0.15 1.72 -1.14 -0.17 0.00 0.00 175.17 176.01 3dtr n ARG 241 N 4.54 1.75 -3.22 4.34 0.63 -0.87 -4.20 116.66 119.63 3dtr n ARG 241 Ca 0.08 0.64 -0.20 0.00 -0.92 0.00 0.00 57.85 57.45 3dtr n ARG 241 Cb 0.58 -2.40 0.03 0.00 0.45 0.00 0.00 32.46 31.12 3dtr n ARG 241 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 3dtr s GLY 242 N 2.88 1.91 0.51 5.14 0.00 -1.26 -4.98 107.32 111.52 3dtr s GLY 242 Ca 0.91 -1.90 0.23 0.00 0.00 0.00 0.00 44.72 43.96 3dtr s GLY 242 CO 0.52 -1.70 2.08 0.00 0.00 0.00 0.00 173.10 174.00 3dtr h THR 243 N 0.42 0.76 0.39 0.90 1.03 -1.93 -2.58 112.91 111.90 3dtr h THR 243 Ca -0.34 -0.47 -0.01 0.00 -0.01 0.00 0.00 66.41 65.59 3dtr h THR 243 Cb 1.29 1.28 -0.03 0.00 -1.07 0.00 0.00 68.15 69.62 3dtr h THR 243 CO 0.46 0.12 -0.50 0.00 -0.01 0.00 0.00 175.52 175.59 3dtr h ALA 244 N 1.88 -1.06 -0.77 0.00 0.00 -1.90 0.40 119.26 117.81 3dtr h ALA 244 Ca -0.00 -0.16 0.15 0.00 0.00 0.00 0.00 54.91 54.90 3dtr h ALA 244 Cb 0.27 0.75 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 3dtr h ALA 244 CO 0.02 -1.15 0.51 0.00 0.00 0.00 0.00 179.25 178.63 3dtr h ALA 245 N -0.71 2.10 -0.02 0.00 0.00 -1.84 -0.72 119.26 118.07 3dtr h ALA 245 Ca -0.04 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3dtr h ALA 245 Cb 0.83 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.56 3dtr h ALA 245 CO -0.12 -0.31 -0.11 0.93 0.00 0.00 0.00 179.25 179.64 3dtr h GLU 246 N 0.43 0.11 -0.46 0.00 5.08 -0.97 -1.60 114.58 117.17 3dtr h GLU 246 Ca 0.38 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 58.60 3dtr h GLU 246 Cb 0.85 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.10 3dtr h GLU 246 CO -0.12 0.77 0.09 0.00 -1.00 0.00 0.00 179.01 178.75 3dtr h ARG 247 N -0.53 0.70 0.57 2.33 3.08 0.10 -0.57 114.38 120.06 3dtr h ARG 247 Ca -0.01 -0.14 -0.03 0.00 0.07 0.00 0.00 59.98 59.87 3dtr h ARG 247 Cb 0.79 -0.11 0.01 0.00 0.08 0.00 0.00 29.97 30.74 3dtr h ARG 247 CO 0.02 0.65 -0.27 0.00 -1.07 0.00 0.00 179.97 179.30 3dtr h ALA 248 N 1.42 -0.77 -0.49 0.04 0.00 -1.09 0.57 119.26 118.95 3dtr h ALA 248 Ca 0.15 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3dtr h ALA 248 Cb 0.29 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 3dtr h ALA 248 CO 0.00 -0.92 0.32 0.00 0.00 0.00 0.00 179.25 178.65 3dtr h ALA 249 N -0.36 0.62 -0.28 0.00 0.00 -1.10 -3.07 119.26 115.07 3dtr h ALA 249 Ca -0.08 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 3dtr h ALA 249 Cb 0.60 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3dtr h ALA 249 CO 0.13 0.04 -0.08 -0.07 0.00 0.00 0.00 179.25 179.27 3dtr h LEU 250 N 0.64 0.56 -0.95 0.00 3.38 -1.02 0.39 115.31 118.31 3dtr h LEU 250 Ca 0.19 -0.38 0.22 0.00 0.09 0.00 0.00 57.88 58.00 3dtr h LEU 250 Cb -0.05 -0.15 -0.12 0.00 0.09 0.00 0.00 40.66 40.43 3dtr h LEU 250 CO -0.05 0.81 0.51 0.15 0.09 0.00 0.00 178.44 179.94 3dtr h PHE 251 N 0.30 0.87 0.12 1.13 3.04 -0.79 0.31 116.94 121.92 3dtr h PHE 251 Ca 0.07 0.04 -0.28 0.00 3.98 0.00 0.00 57.97 61.78 3dtr h PHE 251 Cb 0.57 -0.24 0.01 0.00 2.56 0.00 0.00 35.95 38.86 3dtr h PHE 251 CO 0.05 0.06 -1.21 -1.49 -2.02 0.00 0.00 178.31 173.71 3dtr h TRP 252 N 0.55 0.69 -0.33 0.41 4.06 -1.38 -2.30 115.95 117.65 3dtr h TRP 252 Ca 0.59 -0.46 -0.01 0.00 2.06 0.00 0.00 58.89 61.07 3dtr h TRP 252 Cb 1.06 -0.05 -0.02 0.00 -1.00 0.00 0.00 29.16 29.16 3dtr h TRP 252 CO -0.06 1.33 0.18 -0.09 -3.56 0.00 0.00 178.44 176.24 3dtr h ARG 253 N 0.16 0.46 0.00 0.49 2.43 -0.00 -1.26 114.38 116.66 3dtr h ARG 253 Ca -0.15 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 58.90 3dtr h ARG 253 Cb 1.90 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 31.35 3dtr h ARG 253 CO 0.21 0.39 -0.32 -1.49 -1.51 0.00 0.00 179.97 177.24 3dtr h TRP 254 N 0.41 0.00 0.07 2.20 6.55 -0.98 0.14 115.95 124.34 3dtr h TRP 254 Ca 0.12 0.00 -0.00 0.00 0.95 0.00 0.00 58.89 59.95 3dtr h TRP 254 Cb 0.06 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.36 3dtr h TRP 254 CO -0.03 0.32 -0.03 1.15 -1.05 0.00 0.00 178.44 178.80 3dtr h THR 255 N 0.00 0.61 0.00 1.49 2.02 -1.17 -3.43 112.91 112.43 3dtr h THR 255 Ca -0.00 -1.32 0.00 0.00 0.77 0.00 0.00 66.41 65.85 3dtr h THR 255 Cb 0.68 1.11 0.00 0.00 -1.74 0.00 0.00 68.15 68.20 3dtr h THR 255 CO 0.04 0.19 0.00 1.15 0.37 0.00 0.00 175.52 177.28 3dtr n MET 256 N -4.80 -0.92 0.00 6.66 0.00 -0.50 -5.03 117.12 112.54 3dtr n MET 256 Ca -0.05 -0.47 0.00 0.00 0.00 0.00 0.00 57.70 57.19 3dtr n MET 256 Cb 0.19 -0.97 0.00 0.00 0.00 0.00 0.00 33.22 32.44 3dtr n MET 256 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3dtr n GLY 257 N 0.00 2.30 2.12 3.17 0.00 0.49 -5.01 105.19 108.26 3dtr n GLY 257 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 3dtr n GLY 257 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 3dtr n PHE 258 N -1.65 -0.70 -3.64 1.61 -1.74 -1.26 -4.95 117.46 105.13 3dtr n PHE 258 Ca 0.00 -1.73 -0.04 0.00 -0.56 0.00 0.00 57.45 55.12 3dtr n PHE 258 Cb 0.00 0.24 -0.01 0.00 1.52 0.00 0.00 39.48 41.23 3dtr n PHE 258 CO 0.00 0.00 0.00 0.54 -0.56 0.00 0.00 176.76 176.74 3dtr s ASN 259 N -2.48 -0.21 0.35 5.98 4.22 -1.26 -2.94 114.94 118.60 3dtr s ASN 259 Ca 0.24 -0.19 0.06 0.00 -2.14 0.00 0.00 52.86 50.82 3dtr s ASN 259 Cb 0.01 0.36 -0.01 0.00 1.28 0.00 0.00 41.25 42.89 3dtr s ASN 259 CO 0.17 -0.64 0.50 0.00 -2.04 0.00 0.00 177.10 175.09 3dtr s ALA 260 N -2.99 4.21 0.39 3.54 0.00 -1.26 -5.07 121.76 120.59 3dtr s ALA 260 Ca 0.10 -1.44 0.08 0.00 0.00 0.00 0.00 51.96 50.70 3dtr s ALA 260 Cb -0.00 -1.72 0.00 0.00 0.00 0.00 0.00 23.12 21.40 3dtr s ALA 260 CO -0.03 -0.09 0.53 0.95 0.00 0.00 0.00 175.76 177.12 3dtr s THR 261 N -2.23 3.32 0.19 0.00 -4.23 -1.26 -4.68 115.64 106.75 3dtr s THR 261 Ca 0.46 -1.02 -0.12 0.00 -1.18 0.00 0.00 61.69 59.84 3dtr s THR 261 Cb -0.10 -3.13 0.11 0.00 1.34 0.00 0.00 72.50 70.72 3dtr s THR 261 CO 0.32 -0.05 1.82 -0.03 -0.54 0.00 0.00 174.62 176.13 3dtr h MET 262 N 0.74 0.89 -0.38 3.99 4.05 -1.93 0.19 114.93 122.49 3dtr h MET 262 Ca -0.42 -0.09 -0.06 0.00 -0.28 0.00 0.00 59.70 58.85 3dtr h MET 262 Cb 1.27 -0.18 -0.01 0.00 -0.80 0.00 0.00 31.60 31.88 3dtr h MET 262 CO 0.48 0.65 0.02 1.49 0.23 0.00 0.00 176.91 179.78 3dtr h GLU 263 N 0.88 0.66 -0.06 0.39 4.81 -1.95 -3.31 114.58 116.01 3dtr h GLU 263 Ca 0.23 -0.20 0.04 0.00 -0.13 0.00 0.00 59.36 59.30 3dtr h GLU 263 Cb 0.00 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.26 3dtr h GLU 263 CO -0.04 0.75 -0.30 0.78 -0.73 0.00 0.00 179.01 179.46 3dtr h GLY 264 N 0.49 -0.44 0.10 1.92 0.00 -1.86 -2.38 103.07 100.89 3dtr h GLY 264 Ca 0.11 0.37 0.23 0.00 0.00 0.00 0.00 47.33 48.03 3dtr h GLY 264 CO 0.02 -0.22 0.63 1.19 0.00 0.00 0.00 176.54 178.16 3dtr h ILE 265 N -0.41 0.62 0.00 2.60 6.09 -0.71 0.51 117.51 126.20 3dtr h ILE 265 Ca 0.08 -0.15 0.00 0.00 -1.37 0.00 0.00 64.86 63.41 3dtr h ILE 265 Cb 0.53 0.13 0.00 0.00 0.47 0.00 0.00 36.82 37.95 3dtr h ILE 265 CO -0.30 0.08 0.00 0.45 -3.07 0.00 0.00 178.15 175.32 3dtr h HIS 266 N 0.45 0.00 0.10 2.19 3.86 -1.54 -1.73 115.15 118.48 3dtr h HIS 266 Ca 0.54 0.00 -0.26 0.00 -1.16 0.00 0.00 60.37 59.48 3dtr h HIS 266 Cb 1.28 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.75 3dtr h HIS 266 CO -0.00 0.00 -1.16 0.00 0.86 0.00 0.00 177.93 177.63 3dtr h ARG 267 N 0.00 0.34 -0.27 2.45 3.08 0.14 -2.37 114.38 117.76 3dtr h ARG 267 Ca 0.00 -0.49 0.04 0.00 0.07 0.00 0.00 59.98 59.60 3dtr h ARG 267 Cb 0.69 0.17 -0.04 0.00 0.08 0.00 0.00 29.97 30.87 3dtr h ARG 267 CO 0.00 1.20 0.01 -1.49 -1.07 0.00 0.00 179.97 178.61 3dtr h TRP 268 N 0.13 -0.00 0.12 3.04 4.06 -1.06 -2.62 115.95 119.62 3dtr h TRP 268 Ca -0.12 0.02 -0.00 0.00 2.06 0.00 0.00 58.89 60.84 3dtr h TRP 268 Cb 1.85 0.04 -0.01 0.00 -1.00 0.00 0.00 29.16 30.04 3dtr h TRP 268 CO 0.07 -0.03 -0.17 0.00 -3.56 0.00 0.00 178.44 174.75 3dtr h ALA 269 N 1.22 -0.81 -0.34 1.49 0.00 -1.32 -0.26 119.26 119.24 3dtr h ALA 269 Ca 0.13 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.07 3dtr h ALA 269 Cb 0.16 0.48 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 3dtr h ALA 269 CO -0.21 -0.83 0.24 0.97 0.00 0.00 0.00 179.25 179.42 3dtr h ILE 270 N -0.29 0.87 0.22 0.00 2.10 -1.42 -1.66 117.51 117.32 3dtr h ILE 270 Ca -0.01 -0.03 -0.32 0.00 1.08 0.00 0.00 64.86 65.57 3dtr h ILE 270 Cb 0.27 0.78 0.03 0.00 -1.09 0.00 0.00 36.82 36.81 3dtr h ILE 270 CO -0.05 0.02 -1.46 -0.50 -1.08 0.00 0.00 178.15 175.08 3dtr h TRP 271 N 0.08 0.84 -0.61 2.19 4.06 -1.32 -2.43 115.95 118.76 3dtr h TRP 271 Ca 0.16 -0.62 -0.01 0.00 2.06 0.00 0.00 58.89 60.48 3dtr h TRP 271 Cb 0.53 -0.03 -0.03 0.00 -1.00 0.00 0.00 29.16 28.62 3dtr h TRP 271 CO -0.00 1.51 0.33 1.98 -3.56 0.00 0.00 178.44 178.69 3dtr h MET 272 N 0.13 0.85 0.23 0.49 4.05 -0.11 -0.97 114.93 119.60 3dtr h MET 272 Ca -0.24 -0.09 -0.34 0.00 -0.28 0.00 0.00 59.70 58.76 3dtr h MET 272 Cb 2.12 -0.17 0.03 0.00 -0.80 0.00 0.00 31.60 32.78 3dtr h MET 272 CO 0.25 0.63 -1.52 0.00 0.23 0.00 0.00 176.91 176.51 3dtr h ALA 273 N 1.51 -0.08 0.00 0.39 0.00 -1.53 -3.30 119.26 116.24 3dtr h ALA 273 Ca 0.22 -0.92 -0.05 0.00 0.00 0.00 0.00 54.91 54.16 3dtr h ALA 273 Cb 0.03 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3dtr h ALA 273 CO -0.03 0.78 -0.26 0.28 0.00 0.00 0.00 179.25 180.01 3dtr h VAL 274 N 0.13 0.85 0.00 0.00 2.07 -1.24 -2.66 116.25 115.40 3dtr h VAL 274 Ca -0.26 -1.03 0.00 0.00 0.82 0.00 0.00 66.70 66.22 3dtr h VAL 274 Cb 2.15 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 33.54 3dtr h VAL 274 CO 0.25 0.26 0.00 -0.07 0.02 0.00 0.00 177.57 178.03 3dtr h LEU 275 N 0.00 0.00 0.35 2.57 3.38 -1.26 -2.83 115.31 117.53 3dtr h LEU 275 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3dtr h LEU 275 Cb 0.60 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 3dtr h LEU 275 CO 0.03 0.00 -0.24 0.58 0.09 0.00 0.00 178.44 178.90 3dtr h VAL 276 N 0.00 0.49 0.00 1.22 2.07 -1.58 -1.68 116.25 116.77 3dtr h VAL 276 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3dtr h VAL 276 Cb 0.80 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 3dtr h VAL 276 CO 0.00 0.00 -0.55 0.35 0.02 0.00 0.00 177.57 177.39 3dtr n THR 277 N -5.37 0.05 0.10 2.57 -2.24 -1.24 -1.88 114.28 106.28 3dtr n THR 277 Ca -0.10 -0.05 -0.09 0.00 -2.27 0.00 0.00 64.05 61.55 3dtr n THR 277 Cb 0.28 0.21 -0.05 0.00 -2.10 0.00 0.00 70.33 68.66 3dtr n THR 277 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3dtr h LEU 278 N 0.00 -0.29 -0.27 3.22 5.85 -1.37 -1.27 115.31 121.18 3dtr h LEU 278 Ca 0.00 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.56 3dtr h LEU 278 Cb 0.54 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 3dtr h LEU 278 CO 0.00 0.21 0.16 0.74 -0.34 0.00 0.00 178.44 179.21 3dtr h THR 279 N -1.01 1.10 -0.36 1.05 2.02 -1.43 -2.93 112.91 111.35 3dtr h THR 279 Ca -0.04 -0.25 0.04 0.00 0.77 0.00 0.00 66.41 66.94 3dtr h THR 279 Cb 0.43 0.78 -0.07 0.00 -1.74 0.00 0.00 68.15 67.55 3dtr h THR 279 CO 0.06 0.10 -0.50 1.23 0.37 0.00 0.00 175.52 176.78 3dtr h GLY 280 N 0.34 -1.12 -0.45 2.16 0.00 -1.45 -0.78 103.07 101.77 3dtr h GLY 280 Ca 0.10 0.73 0.15 0.00 0.00 0.00 0.00 47.33 48.31 3dtr h GLY 280 CO -0.02 -0.19 -0.15 -1.33 0.00 0.00 0.00 176.54 174.85 3dtr h GLY 281 N -0.36 0.59 0.94 4.60 0.00 -1.13 -0.59 103.07 107.11 3dtr h GLY 281 Ca 0.06 0.22 -0.00 0.00 0.00 0.00 0.00 47.33 47.61 3dtr h GLY 281 CO -0.53 -0.28 0.07 -2.22 0.00 0.00 0.00 176.54 173.59 3dtr h ILE 282 N 0.02 1.09 -0.82 2.60 2.04 -1.17 -1.62 117.51 119.65 3dtr h ILE 282 Ca 0.36 -0.26 0.13 0.00 1.00 0.00 0.00 64.86 66.09 3dtr h ILE 282 Cb 0.57 1.02 -0.09 0.00 -0.74 0.00 0.00 36.82 37.59 3dtr h ILE 282 CO -0.74 0.09 0.43 1.23 0.00 0.00 0.00 178.15 179.15 3dtr h GLY 283 N 0.12 1.31 1.51 5.37 0.00 0.30 -1.98 103.07 109.71 3dtr h GLY 283 Ca 0.05 -0.25 -0.21 0.00 0.00 0.00 0.00 47.33 46.92 3dtr h GLY 283 CO -0.01 -0.00 -0.83 -2.22 0.00 0.00 0.00 176.54 173.48 3dtr h ILE 284 N 0.64 1.37 -0.60 2.60 1.08 -1.28 -3.12 117.51 118.20 3dtr h ILE 284 Ca 0.44 -2.25 -0.08 0.00 -0.39 0.00 0.00 64.86 62.57 3dtr h ILE 284 Cb 0.57 2.23 -0.02 0.00 -3.07 0.00 0.00 36.82 36.53 3dtr h ILE 284 CO -0.33 0.68 0.05 0.25 -0.69 0.00 0.00 178.15 178.11 3dtr h LEU 285 N 0.29 0.96 -0.09 1.44 5.85 -0.55 -1.01 115.31 122.21 3dtr h LEU 285 Ca -0.06 -0.24 0.00 0.00 0.84 0.00 0.00 57.88 58.42 3dtr h LEU 285 Cb 1.44 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 42.22 3dtr h LEU 285 CO 0.15 0.99 0.00 0.18 -0.34 0.00 0.00 178.44 179.42 3dtr n LEU 286 N -4.20 0.81 -4.60 2.25 4.77 -0.98 -4.31 117.00 110.74 3dtr n LEU 286 Ca 0.04 0.59 -0.43 0.00 -0.03 0.00 0.00 56.01 56.18 3dtr n LEU 286 Cb 0.31 -0.35 -0.02 0.00 -2.33 0.00 0.00 43.42 41.03 3dtr n LEU 286 CO 0.43 -0.23 1.13 -0.44 -1.33 0.00 0.00 177.39 176.94 3dtr s SER 287 N -4.52 6.47 0.00 -1.43 0.01 -0.38 -1.59 113.70 112.25 3dtr s SER 287 Ca 0.10 0.55 0.00 0.00 1.31 0.00 0.00 55.95 57.91 3dtr s SER 287 Cb 0.12 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.80 3dtr s SER 287 CO 0.57 -1.38 0.00 0.61 0.41 0.00 0.00 173.24 173.46 3dtr n GLY 288 N 4.99 1.10 0.09 3.44 0.00 0.23 -4.85 105.19 110.19 3dtr n GLY 288 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.04 3dtr n GLY 288 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3dtr n THR 289 N -2.00 1.14 0.00 2.61 -2.24 -1.17 -4.77 114.28 107.85 3dtr n THR 289 Ca 0.00 -0.55 0.00 0.00 -2.27 0.00 0.00 64.05 61.23 3dtr n THR 289 Cb 0.00 -0.95 0.00 0.00 -2.10 0.00 0.00 70.33 67.28 3dtr n THR 289 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3dtr n VAL 290 N -2.89 0.00 -4.06 2.28 0.31 -1.12 -5.03 118.33 107.82 3dtr n VAL 290 Ca -0.32 0.00 -0.27 0.00 -0.01 0.00 0.00 64.34 63.74 3dtr n VAL 290 Cb 0.94 -0.59 -0.17 0.00 -0.91 0.00 0.00 33.84 33.12 3dtr n VAL 290 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3dtr s VAL 291 N -1.63 1.12 -0.19 2.52 1.01 -0.62 -5.01 120.40 117.59 3dtr s VAL 291 Ca 0.00 -0.37 0.21 0.00 0.00 0.00 0.00 61.98 61.82 3dtr s VAL 291 Cb 0.00 -1.10 -0.06 0.00 0.00 0.00 0.00 36.38 35.22 3dtr s VAL 291 CO 0.00 0.38 0.94 0.47 0.00 0.00 0.00 175.10 176.88 3dtr n ASP 292 N 4.69 0.78 -3.20 3.32 8.00 -1.26 0.78 116.55 129.65 3dtr n ASP 292 Ca -0.15 0.31 0.03 0.00 0.71 0.00 0.00 54.79 55.69 3dtr n ASP 292 Cb 0.50 0.50 -0.01 0.00 -0.02 0.00 0.00 41.12 42.09 3dtr n ASP 292 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 3dtr s ASN 293 N -5.40 -1.36 0.49 -2.24 3.84 -1.23 -4.31 114.94 104.73 3dtr s ASN 293 Ca -0.02 0.95 0.24 0.00 0.21 0.00 0.00 52.86 54.25 3dtr s ASN 293 Cb 0.10 2.18 1.27 0.00 -0.55 0.00 0.00 41.25 44.25 3dtr s ASN 293 CO 0.81 -0.26 2.01 -0.50 -2.79 0.00 0.00 177.10 176.37 3dtr h TRP 294 N 8.00 0.00 -0.13 0.43 4.06 -0.26 -1.70 115.95 126.35 3dtr h TRP 294 Ca -0.22 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.68 3dtr h TRP 294 Cb 1.15 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.31 3dtr h TRP 294 CO 0.11 0.17 -0.09 -0.92 -3.56 0.00 0.00 178.44 174.15 3dtr h TYR 295 N 0.00 0.34 -0.56 0.49 3.20 -1.78 0.26 116.97 118.93 3dtr h TYR 295 Ca -0.00 -0.09 -0.02 0.00 3.14 0.00 0.00 58.73 61.75 3dtr h TYR 295 Cb 0.43 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.59 3dtr h TYR 295 CO 0.00 0.65 0.25 0.28 -1.64 0.00 0.00 178.16 177.70 3dtr h VAL 296 N -0.06 1.21 -0.94 1.81 2.07 -1.82 -1.21 116.25 117.30 3dtr h VAL 296 Ca 0.03 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.92 3dtr h VAL 296 Cb 0.57 0.59 -0.05 0.00 -1.52 0.00 0.00 31.29 30.89 3dtr h VAL 296 CO 0.02 0.24 0.55 -0.25 0.02 0.00 0.00 177.57 178.16 3dtr h TRP 297 N 0.75 1.25 -0.05 1.57 7.01 -1.28 -2.29 115.95 122.92 3dtr h TRP 297 Ca 0.19 -0.01 -0.03 0.00 2.11 0.00 0.00 58.89 61.15 3dtr h TRP 297 Cb 0.15 -0.41 -0.01 0.00 -2.10 0.00 0.00 29.16 26.80 3dtr h TRP 297 CO 0.00 0.84 -0.09 0.78 -2.79 0.00 0.00 178.44 177.18 3dtr h GLY 298 N 1.30 0.07 1.24 2.65 0.00 0.63 0.57 103.07 109.53 3dtr h GLY 298 Ca 0.34 -0.04 -0.23 0.00 0.00 0.00 0.00 47.33 47.40 3dtr h GLY 298 CO -0.06 0.03 -0.82 1.46 0.00 0.00 0.00 176.54 177.15 3dtr h GLN 299 N 0.07 0.73 0.00 4.80 1.08 -0.68 -3.39 115.11 117.73 3dtr h GLN 299 Ca 0.01 -0.63 -0.31 0.00 -1.45 0.00 0.00 58.65 56.27 3dtr h GLN 299 Cb 0.21 0.14 -0.05 0.00 -0.05 0.00 0.00 27.48 27.73 3dtr h GLN 299 CO 0.01 1.24 -1.91 0.09 -0.95 0.00 0.00 178.83 177.31 3dtr n ASN 300 N -3.91 1.93 -0.21 1.46 3.02 -1.11 -5.04 115.26 111.40 3dtr n ASN 300 Ca -0.08 0.37 0.00 0.00 -0.03 0.00 0.00 54.58 54.85 3dtr n ASN 300 Cb 0.77 -0.84 0.00 0.00 -0.61 0.00 0.00 39.78 39.10 3dtr n ASN 300 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3dtr n HIS 301 N -4.35 0.00 0.00 3.10 8.25 0.20 -5.11 115.22 117.31 3dtr n HIS 301 Ca -0.40 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.06 3dtr n HIS 301 Cb 0.74 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 31.44 3dtr n HIS 301 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39