#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dts s GLU 2 N 0.00 2.98 0.13 0.00 2.12 -1.26 -5.08 118.70 117.59 3dts s GLU 2 Ca 0.00 -0.67 -0.30 0.00 0.36 0.00 0.00 54.97 54.36 3dts s GLU 2 Cb 0.00 -2.77 -0.07 0.00 0.26 0.00 0.00 34.13 31.55 3dts s GLU 2 CO 0.00 0.56 1.12 -0.47 -0.54 0.00 0.00 175.26 175.94 3dts s TYR 3 N -1.45 3.55 -1.05 5.30 5.04 -1.26 -4.94 117.35 122.54 3dts s TYR 3 Ca 0.30 1.51 0.17 0.00 -2.44 0.00 0.00 57.07 56.62 3dts s TYR 3 Cb -0.12 -3.31 -0.13 0.00 0.35 0.00 0.00 41.96 38.75 3dts s TYR 3 CO 0.23 -0.78 0.78 1.04 -1.34 0.00 0.00 175.55 175.48 3dts n GLN 4 N 2.99 1.45 -2.96 4.97 1.13 -1.26 -5.01 117.38 118.70 3dts n GLN 4 Ca 0.05 -0.26 -0.22 0.00 -1.94 0.00 0.00 57.00 54.63 3dts n GLN 4 Cb 0.47 -1.31 0.02 0.00 0.11 0.00 0.00 30.24 29.52 3dts n GLN 4 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 3dts n ASN 5 N -1.01 -5.41 0.09 1.08 5.15 -1.26 -4.89 115.26 109.02 3dts n ASN 5 Ca 0.04 -0.23 -0.23 0.00 -0.60 0.00 0.00 54.58 53.57 3dts n ASN 5 Cb 0.30 -4.42 -0.15 0.00 -0.53 0.00 0.00 39.78 34.98 3dts n ASN 5 CO 0.00 0.00 0.00 0.40 1.40 0.00 0.00 177.26 179.06 3dts h ILE 6 N -1.00 1.26 -3.77 -1.44 1.08 -1.97 -3.45 117.51 108.23 3dts h ILE 6 Ca -0.49 -2.58 -0.57 0.00 -0.39 0.00 0.00 64.86 60.84 3dts h ILE 6 Cb 1.34 3.01 -0.32 0.00 -3.07 0.00 0.00 36.82 37.77 3dts h ILE 6 CO 0.55 0.78 -0.84 -0.36 -0.69 0.00 0.00 178.15 177.58 3dts s PHE 7 N -2.53 1.77 0.68 1.37 0.08 -1.26 -4.80 117.98 113.28 3dts s PHE 7 Ca -0.13 -0.56 -0.17 0.00 0.12 0.00 0.00 56.93 56.19 3dts s PHE 7 Cb 0.03 -1.20 0.01 0.00 -0.57 0.00 0.00 43.02 41.29 3dts s PHE 7 CO 0.87 -0.21 1.26 -1.12 -0.10 0.00 0.00 175.22 175.93 3dts s SER 8 N 0.17 4.43 -0.00 1.36 0.01 -0.41 -4.96 113.70 114.30 3dts s SER 8 Ca -0.07 2.54 0.11 0.00 1.31 0.00 0.00 55.95 59.84 3dts s SER 8 Cb -0.13 -2.61 -0.12 0.00 0.21 0.00 0.00 66.02 63.37 3dts s SER 8 CO 0.03 -2.11 0.46 0.00 0.41 0.00 0.00 173.24 172.03 3dts n GLN 9 N -2.20 3.31 -3.68 12.44 10.64 -1.26 -4.92 117.38 131.72 3dts n GLN 9 Ca 0.15 -0.00 -0.14 0.00 -1.83 0.00 0.00 57.00 55.18 3dts n GLN 9 Cb 0.49 -1.02 -0.14 0.00 -0.86 0.00 0.00 30.24 28.71 3dts n GLN 9 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 3dts s VAL 10 N -2.05 -0.29 0.12 -0.39 1.01 -1.26 -5.16 120.40 112.38 3dts s VAL 10 Ca 0.04 0.28 -0.03 0.00 0.00 0.00 0.00 61.98 62.27 3dts s VAL 10 Cb 0.08 -0.38 -0.05 0.00 0.00 0.00 0.00 36.38 36.04 3dts s VAL 10 CO 0.45 0.12 0.32 -1.10 0.00 0.00 0.00 175.10 174.89 3dts s GLN 11 N 2.13 3.55 -0.05 2.72 -0.21 -1.26 -5.10 119.66 121.44 3dts s GLN 11 Ca -0.00 -0.24 0.01 0.00 0.02 0.00 0.00 55.36 55.14 3dts s GLN 11 Cb -0.12 -2.91 0.02 0.00 1.00 0.00 0.00 33.01 31.01 3dts s GLN 11 CO -0.08 0.51 -0.04 0.08 -2.12 0.00 0.00 175.29 173.64 3dts s VAL 12 N -1.64 0.52 -0.01 1.09 1.01 -1.26 -5.15 120.40 114.96 3dts s VAL 12 Ca 0.39 -0.10 0.08 0.00 0.00 0.00 0.00 61.98 62.35 3dts s VAL 12 Cb -0.12 -0.56 -0.02 0.00 0.00 0.00 0.00 36.38 35.67 3dts s VAL 12 CO 0.26 0.23 -0.25 -0.60 0.00 0.00 0.00 175.10 174.74 3dts s ARG 13 N 1.04 2.10 0.25 2.72 3.52 -1.26 -5.03 118.95 122.29 3dts s ARG 13 Ca -0.09 -0.94 0.05 0.00 -0.13 0.00 0.00 55.73 54.63 3dts s ARG 13 Cb -0.14 -2.06 -0.02 0.00 -1.56 0.00 0.00 34.95 31.17 3dts s ARG 13 CO -0.01 0.56 0.20 0.41 -0.81 0.00 0.00 175.30 175.65 3dts n GLY 14 N 2.31 3.23 3.67 8.12 0.00 -1.26 -5.11 105.19 116.15 3dts n GLY 14 Ca -0.16 -1.86 -0.51 0.00 0.00 0.00 0.00 46.02 43.49 3dts n GLY 14 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3dts n PRO 15 N -0.50 1.71 -1.55 1.61 -0.02 -1.26 -4.81 135.00 130.18 3dts n PRO 15 Ca 0.05 0.62 -0.59 0.00 -2.02 0.00 0.00 63.50 61.56 3dts n PRO 15 Cb 0.45 -2.37 -0.08 0.00 -0.02 0.00 0.00 33.50 31.49 3dts n PRO 15 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dts n ALA 16 N 4.69 -2.90 -2.58 3.55 0.00 -1.26 -4.85 120.51 117.16 3dts n ALA 16 Ca 0.21 0.57 -0.43 0.00 0.00 0.00 0.00 53.44 53.80 3dts n ALA 16 Cb 0.23 -1.84 -0.04 0.00 0.00 0.00 0.00 19.45 17.80 3dts n ALA 16 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3dts s ASP 17 N 0.48 6.57 0.00 0.00 -1.08 -1.26 -4.90 116.67 116.48 3dts s ASP 17 Ca 0.92 0.31 0.28 0.00 -0.52 0.00 0.00 52.55 53.54 3dts s ASP 17 Cb -1.24 -2.45 1.07 0.00 -1.46 0.00 0.00 42.92 38.84 3dts s ASP 17 CO 0.58 -0.97 1.80 0.18 0.52 0.00 0.00 175.17 177.29 3dts n LEU 18 N 6.99 0.16 0.00 -1.34 4.77 -1.26 -4.70 117.00 121.63 3dts n LEU 18 Ca 0.06 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 3dts n LEU 18 Cb 0.48 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 3dts n LEU 18 CO 0.61 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.32 3dts n GLY 19 N 1.47 -1.58 3.72 -0.72 0.00 -1.26 -4.95 105.19 101.87 3dts n GLY 19 Ca 0.08 -1.56 -0.35 0.00 0.00 0.00 0.00 46.02 44.19 3dts n GLY 19 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3dts s MET 20 N -2.19 2.15 -0.06 1.61 -1.94 -1.26 -5.02 119.30 112.59 3dts s MET 20 Ca 0.00 1.82 -0.06 0.00 -1.71 0.00 0.00 55.69 55.74 3dts s MET 20 Cb 0.00 -1.83 -0.02 0.00 2.01 0.00 0.00 34.83 34.99 3dts s MET 20 CO 0.00 -1.85 -0.12 2.41 -0.01 0.00 0.00 175.02 175.45 3dts n THR 21 N -2.63 0.60 -3.92 2.05 -1.04 -1.26 -4.99 114.28 103.08 3dts n THR 21 Ca 0.14 0.33 0.00 0.00 -2.04 0.00 0.00 64.05 62.48 3dts n THR 21 Cb 0.50 -1.77 0.00 0.00 -1.82 0.00 0.00 70.33 67.24 3dts n THR 21 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3dts n GLU 22 N -3.24 0.00 -0.13 -2.82 -0.58 -1.26 -2.15 120.64 110.46 3dts n GLU 22 Ca -0.05 0.00 0.01 0.00 -0.42 0.00 0.00 57.16 56.70 3dts n GLU 22 Cb 0.18 0.00 0.06 0.00 -0.57 0.00 0.00 31.44 31.11 3dts n GLU 22 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 3dts n ASP 23 N -0.40 1.74 -4.81 1.62 8.00 -0.81 -4.90 116.55 116.99 3dts n ASP 23 Ca 0.00 -2.14 -0.35 0.00 0.71 0.00 0.00 54.79 53.02 3dts n ASP 23 Cb 0.00 -0.53 -0.06 0.00 -0.02 0.00 0.00 41.12 40.51 3dts n ASP 23 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3dts s VAL 24 N -1.20 4.46 -1.20 2.53 1.01 -0.91 -4.86 120.40 120.22 3dts s VAL 24 Ca 0.08 1.40 -0.13 0.00 0.00 0.00 0.00 61.98 63.33 3dts s VAL 24 Cb 0.06 -3.80 0.19 0.00 0.00 0.00 0.00 36.38 32.83 3dts s VAL 24 CO 0.02 -0.00 1.41 -3.20 0.00 0.00 0.00 175.10 173.33 3dts n ASN 25 N 0.17 5.28 0.08 3.32 5.15 -1.26 -4.85 115.26 123.15 3dts n ASN 25 Ca 0.02 -3.00 0.00 0.00 -0.60 0.00 0.00 54.58 51.00 3dts n ASN 25 Cb 0.52 -1.53 0.00 0.00 -0.53 0.00 0.00 39.78 38.24 3dts n ASN 25 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3dts n LEU 26 N 5.00 0.00 0.20 1.20 4.77 -1.26 0.17 117.00 127.08 3dts n LEU 26 Ca 0.35 0.12 0.07 0.00 -0.03 0.00 0.00 56.01 56.52 3dts n LEU 26 Cb 0.42 0.00 0.38 0.00 -2.33 0.00 0.00 43.42 41.89 3dts n LEU 26 CO 0.61 -0.12 0.72 0.00 -1.33 0.00 0.00 177.39 177.27 3dts h ALA 27 N 0.00 1.01 0.10 -1.18 0.00 -2.02 -3.27 119.26 113.90 3dts h ALA 27 Ca 0.00 -0.29 -0.33 0.00 0.00 0.00 0.00 54.91 54.29 3dts h ALA 27 Cb 1.18 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 3dts h ALA 27 CO 0.00 0.40 -1.81 -0.91 0.00 0.00 0.00 179.25 176.93 3dts h ASN 28 N 0.00 0.32 -2.02 0.00 2.35 -0.70 -3.47 115.58 112.06 3dts h ASN 28 Ca -0.00 -0.62 -0.63 0.00 -0.55 0.00 0.00 56.30 54.50 3dts h ASN 28 Cb 0.84 -0.10 0.04 0.00 0.05 0.00 0.00 38.32 39.14 3dts h ASN 28 CO 0.04 1.55 0.85 0.54 -1.65 0.00 0.00 177.43 178.76 3dts n ARG 29 N -3.37 1.88 0.00 0.81 1.74 -1.24 -3.63 116.66 112.85 3dts n ARG 29 Ca -0.24 0.68 0.00 0.00 -0.77 0.00 0.00 57.85 57.52 3dts n ARG 29 Cb 1.05 -2.45 0.00 0.00 -1.02 0.00 0.00 32.46 30.04 3dts n ARG 29 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3dts n SER 30 N 4.48 -0.65 -4.91 0.55 3.41 -0.71 -4.96 113.62 110.83 3dts n SER 30 Ca 0.20 -0.63 -0.27 0.00 -0.26 0.00 0.00 58.87 57.91 3dts n SER 30 Cb 0.26 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.23 3dts n SER 30 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3dts s GLY 31 N -2.58 1.60 0.26 5.00 0.00 -1.26 -4.61 107.32 105.73 3dts s GLY 31 Ca 0.00 -0.66 -0.30 0.00 0.00 0.00 0.00 44.72 43.76 3dts s GLY 31 CO 0.00 -0.39 1.41 0.14 0.00 0.00 0.00 173.10 174.26 3dts s VAL 32 N -2.98 2.69 0.27 1.40 1.01 -1.26 -4.46 120.40 117.07 3dts s VAL 32 Ca 0.53 0.60 -0.02 0.00 0.00 0.00 0.00 61.98 63.09 3dts s VAL 32 Cb -0.11 -3.38 0.06 0.00 0.00 0.00 0.00 36.38 32.95 3dts s VAL 32 CO 0.45 0.11 0.37 0.61 0.00 0.00 0.00 175.10 176.64 3dts n GLY 33 N 1.92 -0.12 1.86 4.51 0.00 -0.56 -4.97 105.19 107.82 3dts n GLY 33 Ca 0.05 -1.85 -0.16 0.00 0.00 0.00 0.00 46.02 44.06 3dts n GLY 33 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dts n PRO 34 N -1.73 -1.99 -4.95 1.61 -0.04 -1.26 -4.61 135.00 122.02 3dts n PRO 34 Ca 0.05 -0.94 -0.33 0.00 -0.04 0.00 0.00 63.50 62.25 3dts n PRO 34 Cb 0.19 -0.85 -0.15 0.00 -0.04 0.00 0.00 33.50 32.65 3dts n PRO 34 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3dts s PHE 35 N -2.09 2.70 -0.49 0.54 0.40 -1.26 -2.16 117.98 115.62 3dts s PHE 35 Ca 0.38 -0.74 -0.13 0.00 -0.60 0.00 0.00 56.93 55.84 3dts s PHE 35 Cb -0.03 -1.77 0.10 0.00 0.51 0.00 0.00 43.02 41.83 3dts s PHE 35 CO 0.29 -0.25 0.40 0.45 0.70 0.00 0.00 175.22 176.81 3dts s SER 36 N 0.23 5.99 0.40 1.36 0.15 0.04 -4.92 113.70 116.95 3dts s SER 36 Ca -0.11 -1.64 0.12 0.00 0.70 0.00 0.00 55.95 55.02 3dts s SER 36 Cb -0.16 -2.13 0.93 0.00 -1.71 0.00 0.00 66.02 62.96 3dts s SER 36 CO 0.06 -0.71 1.94 0.74 1.20 0.00 0.00 173.24 176.47 3dts h THR 37 N 5.93 0.89 0.39 6.45 2.02 -1.98 0.11 112.91 126.72 3dts h THR 37 Ca -0.27 -0.18 -0.02 0.00 0.77 0.00 0.00 66.41 66.71 3dts h THR 37 Cb 1.09 0.30 -0.00 0.00 -1.74 0.00 0.00 68.15 67.81 3dts h THR 37 CO 0.91 0.10 -0.23 0.25 0.37 0.00 0.00 175.52 176.92 3dts h LEU 38 N 0.54 -0.58 -1.95 2.58 5.85 -1.97 -2.22 115.31 117.55 3dts h LEU 38 Ca 0.34 0.03 0.00 0.00 0.84 0.00 0.00 57.88 59.09 3dts h LEU 38 Cb 0.59 0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.79 3dts h LEU 38 CO -0.12 -0.36 0.06 -0.07 -0.34 0.00 0.00 178.44 177.61 3dts h LEU 39 N -0.58 0.00 0.00 2.25 3.38 -1.82 -2.22 115.31 116.31 3dts h LEU 39 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3dts h LEU 39 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 3dts h LEU 39 CO 0.06 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.20 3dts n GLY 40 N -1.22 -0.88 0.14 0.83 0.00 0.00 -2.49 105.19 101.57 3dts n GLY 40 Ca -0.02 -0.05 -0.22 0.00 0.00 0.00 0.00 46.02 45.74 3dts n GLY 40 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3dts h TRP 41 N 0.00 0.49 0.24 1.61 4.06 -1.48 -3.39 115.95 117.49 3dts h TRP 41 Ca 0.00 -0.36 -0.01 0.00 2.06 0.00 0.00 58.89 60.58 3dts h TRP 41 Cb 0.19 -0.02 0.00 0.00 -1.00 0.00 0.00 29.16 28.34 3dts h TRP 41 CO 0.00 1.72 -0.12 0.35 -3.56 0.00 0.00 178.44 176.83 3dts h PHE 42 N -0.05 -0.30 0.00 0.49 3.57 -1.75 -1.09 116.94 117.81 3dts h PHE 42 Ca -0.39 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.10 3dts h PHE 42 Cb 1.96 0.10 0.00 0.00 2.79 0.00 0.00 35.95 40.80 3dts h PHE 42 CO 0.09 0.07 0.00 0.41 -2.23 0.00 0.00 178.31 176.65 3dts n GLY 43 N 0.13 5.04 3.75 2.40 0.00 -1.04 -4.78 105.19 110.69 3dts n GLY 43 Ca -0.09 -0.66 -0.37 0.00 0.00 0.00 0.00 46.02 44.90 3dts n GLY 43 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3dts s ASN 44 N 1.33 5.36 0.00 1.61 0.02 -1.26 -4.21 114.94 117.79 3dts s ASN 44 Ca 0.00 2.56 0.15 0.00 -1.02 0.00 0.00 52.86 54.56 3dts s ASN 44 Cb 0.00 -2.62 0.28 0.00 0.02 0.00 0.00 41.25 38.93 3dts s ASN 44 CO 0.00 -1.49 1.18 0.00 0.02 0.00 0.00 177.10 176.81 3dts n ALA 45 N -1.15 2.36 -2.59 0.60 0.00 -1.26 -4.29 120.51 114.17 3dts n ALA 45 Ca 0.11 -0.91 -0.41 0.00 0.00 0.00 0.00 53.44 52.23 3dts n ALA 45 Cb 0.47 -0.57 -0.07 0.00 0.00 0.00 0.00 19.45 19.28 3dts n ALA 45 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3dts s GLN 46 N -1.16 3.87 -0.04 0.00 0.74 -1.26 -0.78 119.66 121.02 3dts s GLN 46 Ca 0.26 0.23 -0.12 0.00 0.05 0.00 0.00 55.36 55.77 3dts s GLN 46 Cb 0.15 -3.74 -0.05 0.00 1.10 0.00 0.00 33.01 30.47 3dts s GLN 46 CO 0.21 -0.57 0.32 -0.51 -0.55 0.00 0.00 175.29 174.19 3dts s LEU 47 N 2.56 4.44 0.07 3.68 1.43 -0.92 -4.94 118.68 125.00 3dts s LEU 47 Ca 0.24 0.79 0.00 0.00 -1.03 0.00 0.00 54.13 54.13 3dts s LEU 47 Cb -0.15 -2.42 0.00 0.00 0.03 0.00 0.00 46.19 43.65 3dts s LEU 47 CO 0.12 0.34 0.00 0.61 0.23 0.00 0.00 176.35 177.65 3dts n GLY 48 N 1.95 -2.13 3.92 -3.19 0.00 -1.26 -1.50 105.19 102.98 3dts n GLY 48 Ca -0.16 -1.44 -0.26 0.00 0.00 0.00 0.00 46.02 44.17 3dts n GLY 48 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3dts s PRO 49 N -2.30 3.27 -0.08 1.61 0.04 -1.26 -4.61 135.00 131.66 3dts s PRO 49 Ca 0.00 -0.08 0.05 0.00 0.04 0.00 0.00 61.00 61.01 3dts s PRO 49 Cb 0.00 -2.43 -0.01 0.00 0.04 0.00 0.00 34.50 32.11 3dts s PRO 49 CO 0.00 -0.30 -0.24 -1.50 0.04 0.00 0.00 177.00 175.01 3dts s ILE 50 N -2.71 2.14 -0.47 0.56 2.07 -1.26 -4.90 121.20 116.64 3dts s ILE 50 Ca 0.48 -1.01 -0.29 0.00 -1.41 0.00 0.00 60.65 58.42 3dts s ILE 50 Cb -0.10 -1.80 0.03 0.00 0.13 0.00 0.00 42.46 40.72 3dts s ILE 50 CO 0.42 0.56 1.13 -0.47 -1.91 0.00 0.00 174.94 174.68 3dts s TYR 51 N 0.08 2.84 0.00 3.50 6.14 -1.26 -1.74 117.35 126.91 3dts s TYR 51 Ca -0.11 0.75 0.00 0.00 0.64 0.00 0.00 57.07 58.36 3dts s TYR 51 Cb -0.16 -4.38 0.00 0.00 0.42 0.00 0.00 41.96 37.84 3dts s TYR 51 CO 0.06 -1.23 0.00 1.28 0.64 0.00 0.00 175.55 176.30 3dts n LEU 52 N 7.77 0.00 -0.08 6.97 4.77 -1.24 -4.96 117.00 130.23 3dts n LEU 52 Ca 0.12 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 56.11 3dts n LEU 52 Cb 0.49 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.57 3dts n LEU 52 CO 0.71 0.00 -0.02 0.61 -1.33 0.00 0.00 177.39 177.35 3dts n GLY 53 N 3.29 -1.92 0.08 -0.72 0.00 -1.26 -3.96 105.19 100.70 3dts n GLY 53 Ca 0.00 -1.48 -0.03 0.00 0.00 0.00 0.00 46.02 44.51 3dts n GLY 53 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3dts h SER 54 N -0.08 -0.23 -0.04 1.61 0.02 -2.00 -2.30 113.55 110.53 3dts h SER 54 Ca -0.00 0.02 0.01 0.00 -0.84 0.00 0.00 61.79 60.97 3dts h SER 54 Cb 0.08 0.08 -0.00 0.00 0.14 0.00 0.00 62.40 62.69 3dts h SER 54 CO 0.00 -0.11 0.08 0.25 -1.14 0.00 0.00 176.83 175.91 3dts h LEU 55 N -0.17 0.00 0.01 5.07 5.85 -1.96 -2.14 115.31 121.97 3dts h LEU 55 Ca -0.01 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.62 3dts h LEU 55 Cb 0.15 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.18 3dts h LEU 55 CO -0.01 0.00 -0.34 1.23 -0.34 0.00 0.00 178.44 178.98 3dts h GLY 56 N 0.00 0.25 1.66 3.75 0.00 -1.66 -2.97 103.07 104.09 3dts h GLY 56 Ca 0.02 -0.44 -0.06 0.00 0.00 0.00 0.00 47.33 46.85 3dts h GLY 56 CO -0.00 0.39 -0.09 -2.08 0.00 0.00 0.00 176.54 174.76 3dts h VAL 57 N -0.43 1.20 -0.14 4.60 2.07 -0.96 -1.54 116.25 121.05 3dts h VAL 57 Ca -0.04 -0.87 0.04 0.00 0.82 0.00 0.00 66.70 66.64 3dts h VAL 57 Cb 1.10 1.11 -0.04 0.00 -1.52 0.00 0.00 31.29 31.93 3dts h VAL 57 CO 0.07 0.29 -0.12 0.25 0.02 0.00 0.00 177.57 178.08 3dts h LEU 58 N 0.40 -0.37 0.18 2.57 5.85 -1.43 -0.34 115.31 122.18 3dts h LEU 58 Ca 0.08 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 3dts h LEU 58 Cb 0.41 0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.62 3dts h LEU 58 CO 0.02 -0.15 -0.11 -1.28 -0.34 0.00 0.00 178.44 176.58 3dts h SER 59 N -0.13 -0.27 -0.75 1.25 0.87 -1.27 0.52 113.55 113.78 3dts h SER 59 Ca 0.09 0.02 0.16 0.00 -1.23 0.00 0.00 61.79 60.83 3dts h SER 59 Cb 0.26 0.08 -0.11 0.00 -0.44 0.00 0.00 62.40 62.19 3dts h SER 59 CO -0.22 -0.18 0.21 0.25 -0.53 0.00 0.00 176.83 176.37 3dts h LEU 60 N -0.28 0.08 0.41 2.23 5.85 -0.92 0.46 115.31 123.14 3dts h LEU 60 Ca -0.02 0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 3dts h LEU 60 Cb 0.23 0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.44 3dts h LEU 60 CO 0.02 -0.01 -0.20 0.15 -0.34 0.00 0.00 178.44 178.06 3dts h PHE 61 N 0.31 -0.51 -0.69 1.25 3.57 -0.90 -2.52 116.94 117.45 3dts h PHE 61 Ca 0.42 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 62.04 3dts h PHE 61 Cb 0.71 0.17 -0.04 0.00 2.79 0.00 0.00 35.95 39.58 3dts h PHE 61 CO -0.24 -0.19 0.46 0.77 -2.23 0.00 0.00 178.31 176.89 3dts h SER 62 N -0.93 0.38 0.94 0.41 0.02 -0.50 0.20 113.55 114.07 3dts h SER 62 Ca -0.06 0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 60.85 3dts h SER 62 Cb 0.56 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 3dts h SER 62 CO 0.09 0.21 -0.26 1.23 -1.14 0.00 0.00 176.83 176.96 3dts h GLY 63 N 0.42 0.00 0.98 -3.77 0.00 -0.04 -2.80 103.07 97.85 3dts h GLY 63 Ca 0.33 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 47.32 3dts h GLY 63 CO -0.10 0.00 -1.72 1.41 0.00 0.00 0.00 176.54 176.13 3dts h LEU 64 N 0.00 0.52 -1.67 3.11 3.38 -0.22 -3.23 115.31 117.20 3dts h LEU 64 Ca -0.00 -0.80 -0.04 0.00 0.09 0.00 0.00 57.88 57.13 3dts h LEU 64 Cb 0.81 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 3dts h LEU 64 CO 0.03 1.68 -0.19 0.24 0.09 0.00 0.00 178.44 180.29 3dts h MET 65 N 0.09 0.00 0.15 1.13 2.86 -1.13 0.11 114.93 118.14 3dts h MET 65 Ca -0.32 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.31 3dts h MET 65 Cb 2.07 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.73 3dts h MET 65 CO 0.16 0.19 -0.07 2.35 1.06 0.00 0.00 176.91 180.60 3dts h TRP 66 N 0.00 -0.19 -0.05 -0.22 7.01 -1.60 0.71 115.95 121.63 3dts h TRP 66 Ca -0.00 -0.00 -0.00 0.00 2.11 0.00 0.00 58.89 60.99 3dts h TRP 66 Cb 0.42 0.06 -0.00 0.00 -2.10 0.00 0.00 29.16 27.54 3dts h TRP 66 CO 0.00 0.11 0.02 0.35 -2.79 0.00 0.00 178.44 176.14 3dts h PHE 67 N -0.49 0.06 -0.47 2.65 3.57 -1.48 -2.39 116.94 118.40 3dts h PHE 67 Ca -0.02 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 3dts h PHE 67 Cb 0.38 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.08 3dts h PHE 67 CO 0.02 0.13 0.15 0.35 -2.23 0.00 0.00 178.31 176.73 3dts h PHE 68 N -0.02 0.69 -0.33 0.41 3.04 -0.80 -0.09 116.94 119.85 3dts h PHE 68 Ca 0.02 -0.04 -0.16 0.00 3.98 0.00 0.00 57.97 61.77 3dts h PHE 68 Cb 0.08 -0.21 -0.01 0.00 2.56 0.00 0.00 35.95 38.38 3dts h PHE 68 CO -0.05 0.56 -0.41 1.15 -2.02 0.00 0.00 178.31 177.54 3dts h THR 69 N 0.67 1.28 -0.06 4.41 2.02 -0.65 -1.17 112.91 119.41 3dts h THR 69 Ca 0.16 -1.59 -0.14 0.00 0.77 0.00 0.00 66.41 65.61 3dts h THR 69 Cb 0.19 1.46 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 3dts h THR 69 CO -0.01 0.52 -0.59 0.40 0.37 0.00 0.00 175.52 176.22 3dts h ILE 70 N 0.67 1.39 -0.18 3.11 2.04 -1.26 -3.02 117.51 120.26 3dts h ILE 70 Ca 0.05 -1.95 -0.02 0.00 1.00 0.00 0.00 64.86 63.94 3dts h ILE 70 Cb 0.99 1.99 -0.01 0.00 -0.74 0.00 0.00 36.82 39.05 3dts h ILE 70 CO 0.09 0.57 0.02 1.23 0.00 0.00 0.00 178.15 180.07 3dts h GLY 71 N 1.50 0.33 1.27 5.37 0.00 -0.53 -1.18 103.07 109.83 3dts h GLY 71 Ca -0.00 -0.23 -0.07 0.00 0.00 0.00 0.00 47.33 47.03 3dts h GLY 71 CO 0.09 0.21 0.08 0.16 0.00 0.00 0.00 176.54 177.08 3dts h ILE 72 N 0.09 1.24 -0.48 2.60 3.07 -1.25 -1.20 117.51 121.58 3dts h ILE 72 Ca 0.05 -0.94 -0.08 0.00 1.55 0.00 0.00 64.86 65.44 3dts h ILE 72 Cb 0.33 0.72 -0.02 0.00 -0.27 0.00 0.00 36.82 37.58 3dts h ILE 72 CO 0.01 0.35 -0.01 -0.25 -1.05 0.00 0.00 178.15 177.20 3dts h TRP 73 N 0.85 0.86 -0.62 0.16 2.91 -1.48 0.46 115.95 119.10 3dts h TRP 73 Ca 0.18 -0.12 -0.02 0.00 1.13 0.00 0.00 58.89 60.05 3dts h TRP 73 Cb 0.39 -0.23 -0.03 0.00 -0.51 0.00 0.00 29.16 28.77 3dts h TRP 73 CO 0.02 0.80 0.30 0.74 -1.03 0.00 0.00 178.44 179.28 3dts h PHE 74 N 0.75 0.85 -0.11 2.65 -1.00 -0.75 -2.28 116.94 117.05 3dts h PHE 74 Ca 0.14 -0.02 -0.17 0.00 2.81 0.00 0.00 57.97 60.73 3dts h PHE 74 Cb 0.47 -0.27 -0.01 0.00 3.61 0.00 0.00 35.95 39.75 3dts h PHE 74 CO 0.02 0.62 -0.65 -1.49 -1.61 0.00 0.00 178.31 175.21 3dts h TRP 75 N 0.86 0.55 -0.68 -0.55 4.06 -0.37 -1.81 115.95 118.01 3dts h TRP 75 Ca 0.22 -0.22 -0.02 0.00 2.06 0.00 0.00 58.89 60.93 3dts h TRP 75 Cb 0.08 -0.09 -0.03 0.00 -1.00 0.00 0.00 29.16 28.11 3dts h TRP 75 CO 0.01 0.95 0.35 -0.92 -3.56 0.00 0.00 178.44 175.26 3dts h TYR 76 N 0.30 0.94 0.00 0.49 3.20 -0.45 -0.38 116.97 121.08 3dts h TYR 76 Ca -0.01 -0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.77 3dts h TYR 76 Cb 1.20 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 39.16 3dts h TYR 76 CO 0.04 0.67 -0.27 1.96 -1.64 0.00 0.00 178.16 178.93 3dts h GLN 77 N 0.96 0.00 -0.00 1.82 4.20 -1.26 -2.93 115.11 117.90 3dts h GLN 77 Ca 0.24 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.95 3dts h GLN 77 Cb 0.07 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.85 3dts h GLN 77 CO -0.03 0.27 -0.25 0.00 -0.67 0.00 0.00 178.83 178.15 3dts n ALA 78 N -2.20 2.97 -3.12 3.87 0.00 -0.30 -4.93 120.51 116.81 3dts n ALA 78 Ca 0.01 -0.26 -0.19 0.00 0.00 0.00 0.00 53.44 53.01 3dts n ALA 78 Cb 0.54 -1.28 0.05 0.00 0.00 0.00 0.00 19.45 18.76 3dts n ALA 78 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dts n GLY 79 N 1.44 -0.28 4.39 0.00 0.00 -0.35 -2.79 105.19 107.60 3dts n GLY 79 Ca 0.08 0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 3dts n GLY 79 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3dts n TRP 80 N -4.41 -1.10 -3.83 1.61 7.02 -0.97 -4.91 117.44 110.86 3dts n TRP 80 Ca -0.04 0.65 -0.36 0.00 -1.02 0.00 0.00 57.50 56.73 3dts n TRP 80 Cb 0.57 -1.77 -0.13 0.00 -2.42 0.00 0.00 31.31 27.56 3dts n TRP 80 CO 0.00 0.00 0.00 1.21 -2.02 0.00 0.00 177.69 176.88 3dts s ASN 81 N -3.15 5.11 0.35 -0.99 3.84 -1.12 -5.00 114.94 113.99 3dts s ASN 81 Ca 0.79 -1.31 0.17 0.00 0.21 0.00 0.00 52.86 52.71 3dts s ASN 81 Cb -0.46 -1.79 1.18 0.00 -0.55 0.00 0.00 41.25 39.63 3dts s ASN 81 CO 0.98 -0.32 1.63 -0.65 -2.79 0.00 0.00 177.10 175.94 3dts h PRO 82 N 8.10 0.20 -0.41 0.43 0.11 -1.90 -1.06 132.00 137.47 3dts h PRO 82 Ca -0.21 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.76 3dts h PRO 82 Cb 1.07 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 3dts h PRO 82 CO 0.58 0.14 -0.26 0.00 -0.21 0.00 0.00 178.00 178.25 3dts h ALA 83 N 1.90 0.77 -0.50 -0.75 0.00 -1.95 -3.19 119.26 115.54 3dts h ALA 83 Ca 0.78 -0.40 -0.12 0.00 0.00 0.00 0.00 54.91 55.17 3dts h ALA 83 Cb 1.88 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.50 3dts h ALA 83 CO -0.66 0.66 -0.14 0.28 0.00 0.00 0.00 179.25 179.38 3dts h VAL 84 N 0.74 1.27 -0.19 0.00 2.07 -1.49 -2.95 116.25 115.70 3dts h VAL 84 Ca 0.09 -1.29 0.05 0.00 0.82 0.00 0.00 66.70 66.38 3dts h VAL 84 Cb 0.80 1.03 -0.06 0.00 -1.52 0.00 0.00 31.29 31.54 3dts h VAL 84 CO 0.07 0.45 -0.26 0.15 0.02 0.00 0.00 177.57 178.00 3dts h PHE 85 N 0.85 -0.70 0.00 1.57 3.57 -1.50 -0.95 116.94 119.77 3dts h PHE 85 Ca 0.13 0.04 -0.09 0.00 3.53 0.00 0.00 57.97 61.57 3dts h PHE 85 Cb 0.70 0.34 -0.01 0.00 2.79 0.00 0.00 35.95 39.76 3dts h PHE 85 CO 0.04 -0.34 -0.45 -0.07 -2.23 0.00 0.00 178.31 175.27 3dts h LEU 86 N -0.30 0.00 0.08 0.59 3.38 -1.61 -2.51 115.31 114.95 3dts h LEU 86 Ca 0.12 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 3dts h LEU 86 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 3dts h LEU 86 CO -0.36 0.45 -0.04 -0.09 0.09 0.00 0.00 178.44 178.49 3dts h ARG 87 N 0.00 -0.11 -1.14 1.13 2.43 -1.19 -3.31 114.38 112.19 3dts h ARG 87 Ca -0.00 0.01 -0.23 0.00 -0.81 0.00 0.00 59.98 58.94 3dts h ARG 87 Cb 0.80 0.02 -0.13 0.00 -0.42 0.00 0.00 29.97 30.24 3dts h ARG 87 CO 0.06 -0.07 0.30 -0.25 -1.51 0.00 0.00 179.97 178.49 3dts n ASP 88 N -2.38 4.04 0.16 -3.80 9.92 -0.43 -4.53 116.55 119.52 3dts n ASP 88 Ca -0.01 -2.74 0.06 0.00 -0.53 0.00 0.00 54.79 51.56 3dts n ASP 88 Cb 0.04 -0.74 0.55 0.00 -0.64 0.00 0.00 41.12 40.33 3dts n ASP 88 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 3dts h LEU 89 N 1.38 0.17 0.00 0.64 5.85 -1.54 -2.62 115.31 119.19 3dts h LEU 89 Ca 0.26 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.98 3dts h LEU 89 Cb 1.57 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.56 3dts h LEU 89 CO 0.51 0.14 -1.07 0.49 -0.34 0.00 0.00 178.44 178.17 3dts n PHE 90 N -4.50 0.49 0.06 1.25 3.72 -1.26 -4.30 117.46 112.91 3dts n PHE 90 Ca -0.01 0.14 -0.13 0.00 -0.05 0.00 0.00 57.45 57.41 3dts n PHE 90 Cb 0.09 -0.63 -0.13 0.00 -0.94 0.00 0.00 39.48 37.87 3dts n PHE 90 CO 0.00 0.00 0.00 0.74 -0.05 0.00 0.00 176.76 177.45 3dts h PHE 91 N 0.00 0.28 -2.85 1.38 0.04 -1.81 -0.70 116.94 113.28 3dts h PHE 91 Ca 0.00 -0.20 -0.42 0.00 2.80 0.00 0.00 57.97 60.15 3dts h PHE 91 Cb 0.84 -0.01 0.22 0.00 2.20 0.00 0.00 35.95 39.20 3dts h PHE 91 CO 0.00 1.20 -0.31 1.19 -0.60 0.00 0.00 178.31 179.79 3dts n PHE 92 N -3.40 -1.81 0.00 -0.55 3.72 -1.03 -4.70 117.46 109.70 3dts n PHE 92 Ca -0.10 -0.21 0.00 0.00 -0.05 0.00 0.00 57.45 57.10 3dts n PHE 92 Cb 1.01 -1.59 0.00 0.00 -0.94 0.00 0.00 39.48 37.96 3dts n PHE 92 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3dts n SER 93 N -4.24 0.00 -4.28 4.37 2.88 -1.26 -4.50 113.62 106.59 3dts n SER 93 Ca 0.03 0.00 -0.45 0.00 -1.33 0.00 0.00 58.87 57.13 3dts n SER 93 Cb 0.56 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.98 3dts n SER 93 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 3dts s LEU 94 N 0.00 6.36 0.73 2.46 2.96 -0.96 -4.96 118.68 125.28 3dts s LEU 94 Ca 0.00 -2.60 -0.11 0.00 -0.22 0.00 0.00 54.13 51.20 3dts s LEU 94 Cb 0.00 -2.13 0.03 0.00 0.50 0.00 0.00 46.19 44.59 3dts s LEU 94 CO 0.00 -0.57 1.07 -1.61 -1.32 0.00 0.00 176.35 173.93 3dts s GLU 95 N 0.31 2.64 0.92 1.98 0.41 -1.26 -2.35 118.70 121.35 3dts s GLU 95 Ca 0.16 1.02 -0.13 0.00 -0.41 0.00 0.00 54.97 55.61 3dts s GLU 95 Cb -0.15 -1.95 0.14 0.00 -1.78 0.00 0.00 34.13 30.40 3dts s GLU 95 CO -0.06 -1.33 1.17 -2.14 -0.49 0.00 0.00 175.26 172.41 3dts s PRO 96 N -5.00 1.08 0.66 0.39 0.02 -1.26 -4.71 135.00 126.19 3dts s PRO 96 Ca 0.59 0.14 -0.16 0.00 0.02 0.00 0.00 61.00 61.60 3dts s PRO 96 Cb -0.15 -1.85 0.00 0.00 0.02 0.00 0.00 34.50 32.53 3dts s PRO 96 CO 0.55 -2.21 1.16 -1.25 -0.33 0.00 0.00 177.00 174.92 3dts s PRO 97 N -5.42 2.65 0.68 5.54 0.04 -1.26 -4.75 135.00 132.47 3dts s PRO 97 Ca 0.65 1.59 -0.17 0.00 0.04 0.00 0.00 61.00 63.12 3dts s PRO 97 Cb -0.12 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.48 3dts s PRO 97 CO 0.53 -1.41 0.88 0.00 0.04 0.00 0.00 177.00 177.04 3dts n ALA 98 N -2.31 -0.34 0.33 8.56 0.00 -1.26 -3.80 120.51 121.70 3dts n ALA 98 Ca 0.12 -0.13 0.22 0.00 0.00 0.00 0.00 53.44 53.65 3dts n ALA 98 Cb 0.51 -2.06 1.13 0.00 0.00 0.00 0.00 19.45 19.02 3dts n ALA 98 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3dts h PRO 99 N -0.03 0.00 -0.59 0.00 0.13 -1.94 -2.70 132.00 126.87 3dts h PRO 99 Ca -0.47 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.66 3dts h PRO 99 Cb 1.35 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.45 3dts h PRO 99 CO 0.47 0.00 0.39 0.93 -0.23 0.00 0.00 178.00 179.56 3dts h GLU 100 N 0.00 0.77 0.00 0.86 3.07 -2.00 -2.93 114.58 114.34 3dts h GLU 100 Ca 0.00 -0.05 -0.04 0.00 -0.50 0.00 0.00 59.36 58.77 3dts h GLU 100 Cb 0.09 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 27.82 3dts h GLU 100 CO 0.00 0.51 -0.21 1.88 -1.40 0.00 0.00 179.01 179.79 3dts h TYR 101 N 0.79 0.00 0.00 4.33 0.05 -1.84 -3.48 116.97 116.81 3dts h TYR 101 Ca 0.22 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.00 3dts h TYR 101 Cb -0.09 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.65 3dts h TYR 101 CO -0.03 0.21 0.00 0.41 -1.05 0.00 0.00 178.16 177.70 3dts n GLY 102 N -0.28 2.67 1.96 3.88 0.00 -1.11 -3.25 105.19 109.06 3dts n GLY 102 Ca -0.01 -0.29 -0.19 0.00 0.00 0.00 0.00 46.02 45.52 3dts n GLY 102 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dts n LEU 103 N 0.00 6.04 -5.00 0.99 4.77 -1.23 -2.17 117.00 120.40 3dts n LEU 103 Ca 0.00 -3.21 -0.18 0.00 -0.03 0.00 0.00 56.01 52.59 3dts n LEU 103 Cb 0.00 -0.80 0.01 0.00 -2.33 0.00 0.00 43.42 40.30 3dts n LEU 103 CO 0.00 0.98 0.17 -0.94 -1.33 0.00 0.00 177.39 176.28 3dts s SER 104 N -0.77 5.66 -0.02 -1.43 1.04 -1.20 -5.01 113.70 111.96 3dts s SER 104 Ca 0.44 -0.30 0.07 0.00 0.48 0.00 0.00 55.95 56.64 3dts s SER 104 Cb 0.37 -0.80 0.19 0.00 0.10 0.00 0.00 66.02 65.87 3dts s SER 104 CO 0.07 -0.76 1.15 0.49 0.98 0.00 0.00 173.24 175.16 3dts n PHE 105 N -1.90 0.26 -0.16 5.02 3.72 -1.26 -4.68 117.46 118.47 3dts n PHE 105 Ca 0.07 -0.56 -0.07 0.00 -0.05 0.00 0.00 57.45 56.84 3dts n PHE 105 Cb 0.59 -0.07 0.15 0.00 -0.94 0.00 0.00 39.48 39.21 3dts n PHE 105 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3dts n ALA 106 N -0.14 3.84 -2.19 4.37 0.00 -1.26 -4.93 120.51 120.20 3dts n ALA 106 Ca 0.07 -1.39 -0.32 0.00 0.00 0.00 0.00 53.44 51.80 3dts n ALA 106 Cb 0.40 -1.18 -0.06 0.00 0.00 0.00 0.00 19.45 18.61 3dts n ALA 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dts s ALA 107 N -1.88 3.36 0.59 0.00 0.00 -1.26 -5.05 121.76 117.52 3dts s ALA 107 Ca 0.31 -0.01 -0.18 0.00 0.00 0.00 0.00 51.96 52.08 3dts s ALA 107 Cb 0.25 -2.71 -0.03 0.00 0.00 0.00 0.00 23.12 20.63 3dts s ALA 107 CO 0.07 0.36 1.12 -1.25 0.00 0.00 0.00 175.76 176.07 3dts s PRO 108 N -2.94 3.12 0.47 0.00 0.04 -1.26 -4.07 135.00 130.37 3dts s PRO 108 Ca 0.53 1.52 0.21 0.00 0.04 0.00 0.00 61.00 63.30 3dts s PRO 108 Cb -0.10 -1.98 1.17 0.00 0.04 0.00 0.00 34.50 33.63 3dts s PRO 108 CO 0.18 -1.02 1.99 -0.07 0.04 0.00 0.00 177.00 178.13 3dts h LEU 109 N 0.70 0.00 -1.11 -3.56 3.38 -1.92 0.70 115.31 113.50 3dts h LEU 109 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.48 3dts h LEU 109 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 3dts h LEU 109 CO 0.56 0.19 -0.04 0.29 0.09 0.00 0.00 178.44 179.52 3dts n LYS 110 N -3.89 1.70 -0.31 1.13 5.02 -1.26 -3.74 118.16 116.80 3dts n LYS 110 Ca -0.02 -1.11 0.02 0.00 -2.02 0.00 0.00 58.31 55.17 3dts n LYS 110 Cb 0.28 -1.48 0.02 0.00 -0.02 0.00 0.00 35.03 33.83 3dts n LYS 110 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3dts n GLU 111 N 0.32 0.35 0.00 1.97 1.02 -1.01 -5.01 120.64 118.28 3dts n GLU 111 Ca 0.17 -1.18 0.00 0.00 -0.02 0.00 0.00 57.16 56.13 3dts n GLU 111 Cb 0.41 -0.68 0.00 0.00 -0.02 0.00 0.00 31.44 31.15 3dts n GLU 111 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dts n GLY 112 N -0.25 1.01 0.31 0.62 0.00 -0.70 -4.17 105.19 102.01 3dts n GLY 112 Ca 0.03 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.03 3dts n GLY 112 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3dts h GLY 113 N 0.00 1.19 2.00 -0.02 0.00 0.24 -1.98 103.07 104.50 3dts h GLY 113 Ca 0.00 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 46.92 3dts h GLY 113 CO 0.00 0.33 -0.05 -2.00 0.00 0.00 0.00 176.54 174.83 3dts h LEU 114 N 1.01 0.00 0.23 3.11 5.85 -1.76 -2.09 115.31 121.67 3dts h LEU 114 Ca 0.33 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 59.04 3dts h LEU 114 Cb 0.02 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.05 3dts h LEU 114 CO -0.12 0.05 -0.11 -0.25 -0.34 0.00 0.00 178.44 177.67 3dts h TRP 115 N 0.00 -0.29 -0.99 1.25 7.01 -1.64 -2.89 115.95 118.39 3dts h TRP 115 Ca -0.00 -0.01 0.18 0.00 2.11 0.00 0.00 58.89 61.17 3dts h TRP 115 Cb 0.26 0.10 -0.10 0.00 -2.10 0.00 0.00 29.16 27.31 3dts h TRP 115 CO 0.00 0.09 0.60 -0.07 -2.79 0.00 0.00 178.44 176.27 3dts h LEU 116 N -0.87 0.78 0.93 0.65 3.38 -1.34 0.13 115.31 118.97 3dts h LEU 116 Ca -0.03 0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 3dts h LEU 116 Cb 0.51 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 41.22 3dts h LEU 116 CO 0.05 0.29 -0.44 0.40 0.09 0.00 0.00 178.44 178.83 3dts h ILE 117 N 0.77 0.00 -0.81 1.22 2.04 -1.47 -0.87 117.51 118.39 3dts h ILE 117 Ca 0.56 -0.04 0.20 0.00 1.00 0.00 0.00 64.86 66.58 3dts h ILE 117 Cb 0.85 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.80 3dts h ILE 117 CO -0.37 0.00 0.21 0.00 0.00 0.00 0.00 178.15 177.98 3dts h ALA 118 N -1.38 1.11 -0.39 1.87 0.00 -0.76 -0.85 119.26 118.86 3dts h ALA 118 Ca -0.13 0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 3dts h ALA 118 Cb 0.95 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 3dts h ALA 118 CO 0.21 -0.39 -0.13 0.77 0.00 0.00 0.00 179.25 179.71 3dts h SER 119 N 0.25 0.68 -0.02 0.00 0.02 -0.70 -1.85 113.55 111.93 3dts h SER 119 Ca 0.48 -0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 61.23 3dts h SER 119 Cb 0.90 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.25 3dts h SER 119 CO -0.58 0.84 0.00 0.15 -1.14 0.00 0.00 176.83 176.09 3dts h PHE 120 N 0.63 0.03 -0.02 3.45 3.57 0.18 0.41 116.94 125.19 3dts h PHE 120 Ca 0.11 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.61 3dts h PHE 120 Cb 0.58 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.31 3dts h PHE 120 CO 0.03 0.26 0.02 0.74 -2.23 0.00 0.00 178.31 177.13 3dts h PHE 121 N -0.22 0.00 0.00 0.41 0.04 -1.13 -0.64 116.94 115.40 3dts h PHE 121 Ca 0.00 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.71 3dts h PHE 121 Cb 0.25 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.39 3dts h PHE 121 CO 0.01 0.00 -1.25 -0.12 -0.60 0.00 0.00 178.31 176.35 3dts n MET 122 N -3.73 0.62 -0.07 1.51 1.56 -0.71 -2.66 117.12 113.64 3dts n MET 122 Ca -0.03 0.13 -0.13 0.00 -0.27 0.00 0.00 57.70 57.41 3dts n MET 122 Cb 0.11 -1.79 -0.00 0.00 2.15 0.00 0.00 33.22 33.68 3dts n MET 122 CO 0.00 0.00 0.00 0.35 -0.73 0.00 0.00 175.97 175.59 3dts h PHE 123 N 0.00 0.99 0.34 1.12 3.57 0.57 -2.40 116.94 121.13 3dts h PHE 123 Ca -0.07 -0.33 -0.02 0.00 3.53 0.00 0.00 57.97 61.09 3dts h PHE 123 Cb 1.23 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 39.78 3dts h PHE 123 CO 0.00 1.13 -0.16 0.28 -2.23 0.00 0.00 178.31 177.32 3dts h VAL 124 N 0.63 0.60 -0.82 1.41 2.07 -1.42 -2.97 116.25 115.74 3dts h VAL 124 Ca 0.03 -0.62 0.13 0.00 0.82 0.00 0.00 66.70 67.06 3dts h VAL 124 Cb 1.07 0.88 -0.09 0.00 -1.52 0.00 0.00 31.29 31.63 3dts h VAL 124 CO 0.11 0.11 0.42 0.00 0.02 0.00 0.00 177.57 178.22 3dts h ALA 125 N -0.39 1.21 0.14 1.67 0.00 -1.52 -0.95 119.26 119.43 3dts h ALA 125 Ca -0.05 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3dts h ALA 125 Cb 0.53 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3dts h ALA 125 CO 0.08 -0.08 -0.07 0.28 0.00 0.00 0.00 179.25 179.46 3dts h VAL 126 N 0.62 0.91 -0.59 0.00 2.07 -1.53 -2.90 116.25 114.83 3dts h VAL 126 Ca 0.44 -1.19 0.04 0.00 0.82 0.00 0.00 66.70 66.81 3dts h VAL 126 Cb 0.59 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.86 3dts h VAL 126 CO -0.34 0.24 0.34 -0.50 0.02 0.00 0.00 177.57 177.32 3dts h TRP 127 N -0.85 0.62 -0.42 1.57 4.06 -1.41 0.19 115.95 119.72 3dts h TRP 127 Ca -0.02 0.02 -0.02 0.00 2.06 0.00 0.00 58.89 60.93 3dts h TRP 127 Cb 0.54 -0.19 -0.02 0.00 -1.00 0.00 0.00 29.16 28.48 3dts h TRP 127 CO 0.09 0.33 0.17 0.66 -3.56 0.00 0.00 178.44 176.13 3dts h SER 128 N 0.65 0.54 0.14 -3.49 4.64 -1.30 -1.48 113.55 113.24 3dts h SER 128 Ca 0.25 -0.05 -0.19 0.00 -0.47 0.00 0.00 61.79 61.33 3dts h SER 128 Cb 0.10 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.05 3dts h SER 128 CO -0.14 0.48 -0.74 -0.25 -0.87 0.00 0.00 176.83 175.32 3dts h TRP 129 N 0.59 0.70 -0.15 4.77 2.91 -1.08 -1.92 115.95 121.77 3dts h TRP 129 Ca 0.15 -0.31 0.05 0.00 1.13 0.00 0.00 58.89 59.91 3dts h TRP 129 Cb 0.11 -0.11 -0.05 0.00 -0.51 0.00 0.00 29.16 28.60 3dts h TRP 129 CO 0.01 1.08 -0.20 2.35 -1.03 0.00 0.00 178.44 180.65 3dts h TRP 130 N 0.36 -0.51 -0.61 2.65 7.01 -0.05 -1.15 115.95 123.65 3dts h TRP 130 Ca -0.04 0.03 0.07 0.00 2.11 0.00 0.00 58.89 61.06 3dts h TRP 130 Cb 1.33 0.25 -0.04 0.00 -2.10 0.00 0.00 29.16 28.60 3dts h TRP 130 CO 0.06 -0.27 0.41 0.78 -2.79 0.00 0.00 178.44 176.62 3dts h GLY 131 N -0.24 0.73 1.01 2.65 0.00 -1.10 -1.28 103.07 104.84 3dts h GLY 131 Ca 0.11 -0.23 -0.00 0.00 0.00 0.00 0.00 47.33 47.20 3dts h GLY 131 CO -0.29 0.17 0.46 -0.09 0.00 0.00 0.00 176.54 176.79 3dts h ARG 132 N 0.58 1.00 0.00 4.80 2.43 -0.43 0.31 114.38 123.07 3dts h ARG 132 Ca 0.27 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.34 3dts h ARG 132 Cb 0.31 -0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 29.64 3dts h ARG 132 CO -0.08 0.70 -0.08 1.79 -1.51 0.00 0.00 179.97 180.79 3dts h THR 133 N 1.01 0.25 0.00 0.20 1.35 -0.35 0.20 112.91 115.57 3dts h THR 133 Ca 0.27 -0.60 -0.12 0.00 -0.55 0.00 0.00 66.41 65.40 3dts h THR 133 Cb -0.06 1.48 -0.02 0.00 -1.73 0.00 0.00 68.15 67.82 3dts h THR 133 CO -0.05 0.08 -0.73 0.22 -0.25 0.00 0.00 175.52 174.79 3dts h TYR 134 N 0.00 0.00 -0.61 4.73 3.20 -1.08 -3.33 116.97 119.88 3dts h TYR 134 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3dts h TYR 134 Cb 0.47 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.71 3dts h TYR 134 CO 0.00 1.09 0.40 -0.07 -1.64 0.00 0.00 178.16 177.94 3dts h LEU 135 N -1.00 0.71 -1.86 2.82 3.38 -0.93 -1.94 115.31 116.50 3dts h LEU 135 Ca -0.19 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.75 3dts h LEU 135 Cb 1.05 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.62 3dts h LEU 135 CO -0.11 0.53 0.01 -0.09 0.09 0.00 0.00 178.44 178.87 3dts h ARG 136 N 0.83 0.00 0.00 1.13 9.65 -1.13 -0.81 114.38 124.05 3dts h ARG 136 Ca 0.22 0.00 -0.34 0.00 -1.10 0.00 0.00 59.98 58.77 3dts h ARG 136 Cb -0.07 0.00 -0.06 0.00 -1.39 0.00 0.00 29.97 28.44 3dts h ARG 136 CO -0.05 0.00 -2.16 0.00 2.80 0.00 0.00 179.97 180.56 3dts n ALA 137 N -1.86 1.53 -0.08 2.80 0.00 -0.82 -4.07 120.51 118.01 3dts n ALA 137 Ca -0.02 -1.14 -0.05 0.00 0.00 0.00 0.00 53.44 52.23 3dts n ALA 137 Cb 0.05 -0.40 0.15 0.00 0.00 0.00 0.00 19.45 19.25 3dts n ALA 137 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 3dts h GLN 138 N 0.00 0.74 0.00 0.00 4.15 -0.45 -1.17 115.11 118.38 3dts h GLN 138 Ca -0.46 -0.24 -0.02 0.00 0.77 0.00 0.00 58.65 58.71 3dts h GLN 138 Cb 2.15 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 29.77 3dts h GLN 138 CO 0.04 0.82 -0.10 0.00 -1.93 0.00 0.00 178.83 177.66 3dts h ALA 139 N 1.21 1.04 -0.09 3.38 0.00 -1.52 -2.68 119.26 120.60 3dts h ALA 139 Ca 0.12 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3dts h ALA 139 Cb 0.56 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3dts h ALA 139 CO 0.03 0.13 0.00 1.28 0.00 0.00 0.00 179.25 180.69 3dts n LEU 140 N -3.27 2.57 -0.78 0.00 4.77 -1.04 -1.92 117.00 117.33 3dts n LEU 140 Ca 0.00 -1.14 -0.09 0.00 -0.03 0.00 0.00 56.01 54.75 3dts n LEU 140 Cb 0.34 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.35 3dts n LEU 140 CO 0.30 0.49 -0.09 0.61 -1.33 0.00 0.00 177.39 177.36 3dts n GLY 141 N 0.97 0.80 3.99 -0.72 0.00 -0.77 -5.00 105.19 104.46 3dts n GLY 141 Ca 0.11 -0.60 -0.20 0.00 0.00 0.00 0.00 46.02 45.34 3dts n GLY 141 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3dts s MET 142 N -3.20 2.68 0.59 1.61 -1.94 -0.52 -5.04 119.30 113.49 3dts s MET 142 Ca 0.00 -0.95 -0.17 0.00 -1.71 0.00 0.00 55.69 52.87 3dts s MET 142 Cb 0.00 -2.60 -0.04 0.00 2.01 0.00 0.00 34.83 34.21 3dts s MET 142 CO 0.00 -0.52 1.09 0.20 -0.01 0.00 0.00 175.02 175.78 3dts s GLY 143 N -4.39 2.29 -0.29 -0.03 0.00 -1.26 -4.60 107.32 99.04 3dts s GLY 143 Ca 0.56 0.56 0.01 0.00 0.00 0.00 0.00 44.72 45.85 3dts s GLY 143 CO 0.36 0.90 1.69 0.28 0.00 0.00 0.00 173.10 176.33 3dts n LYS 144 N -1.87 1.79 0.29 2.90 4.01 -1.26 -4.54 118.16 119.48 3dts n LYS 144 Ca 0.10 -1.74 -0.16 0.00 -0.51 0.00 0.00 58.31 55.99 3dts n LYS 144 Cb 0.52 -1.68 -0.08 0.00 -0.51 0.00 0.00 35.03 33.27 3dts n LYS 144 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 3dts h HIS 145 N 0.90 -0.67 -0.89 2.13 3.86 -1.97 -1.79 115.15 116.72 3dts h HIS 145 Ca 0.35 -0.01 0.21 0.00 -1.16 0.00 0.00 60.37 59.76 3dts h HIS 145 Cb 1.66 0.22 -0.06 0.00 1.06 0.00 0.00 27.41 30.29 3dts h HIS 145 CO 0.90 -0.41 0.60 1.15 0.86 0.00 0.00 177.93 181.03 3dts h THR 146 N -0.70 0.66 0.40 2.45 2.02 -1.93 -0.85 112.91 114.96 3dts h THR 146 Ca -0.07 -0.12 -0.02 0.00 0.77 0.00 0.00 66.41 66.97 3dts h THR 146 Cb 0.55 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 3dts h THR 146 CO 0.10 0.06 -0.19 0.00 0.37 0.00 0.00 175.52 175.86 3dts h ALA 147 N 1.61 -0.54 -0.54 6.16 0.00 -1.63 -2.23 119.26 122.08 3dts h ALA 147 Ca 0.46 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 3dts h ALA 147 Cb 1.23 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 3dts h ALA 147 CO -0.16 -0.66 0.29 -1.49 0.00 0.00 0.00 179.25 177.23 3dts h TRP 148 N -0.83 0.75 -0.77 0.00 4.06 -0.49 -2.61 115.95 116.06 3dts h TRP 148 Ca -0.06 -0.02 -0.01 0.00 2.06 0.00 0.00 58.89 60.87 3dts h TRP 148 Cb 0.54 -0.24 -0.04 0.00 -1.00 0.00 0.00 29.16 28.43 3dts h TRP 148 CO 0.01 0.55 0.46 0.00 -3.56 0.00 0.00 178.44 175.90 3dts h ALA 149 N 1.13 1.36 0.00 1.49 0.00 -1.25 -0.33 119.26 121.66 3dts h ALA 149 Ca 0.19 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3dts h ALA 149 Cb 0.06 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 3dts h ALA 149 CO -0.03 0.55 -0.06 0.35 0.00 0.00 0.00 179.25 180.06 3dts h PHE 150 N 1.06 0.00 -0.38 0.00 3.57 -1.11 -2.56 116.94 117.52 3dts h PHE 150 Ca 0.28 0.00 -0.15 0.00 3.53 0.00 0.00 57.97 61.63 3dts h PHE 150 Cb -0.04 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 3dts h PHE 150 CO 0.00 0.06 -0.36 1.25 -2.23 0.00 0.00 178.31 177.04 3dts h LEU 151 N 0.00 0.94 -0.90 0.59 5.85 -0.69 -2.38 115.31 118.71 3dts h LEU 151 Ca -0.00 -0.41 -0.07 0.00 0.84 0.00 0.00 57.88 58.24 3dts h LEU 151 Cb 0.39 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 3dts h LEU 151 CO 0.01 1.19 0.08 0.77 -0.34 0.00 0.00 178.44 180.15 3dts h SER 152 N 0.73 0.85 -0.36 1.25 4.64 -1.29 0.32 113.55 119.69 3dts h SER 152 Ca 0.07 -0.18 -0.04 0.00 -0.47 0.00 0.00 61.79 61.16 3dts h SER 152 Cb 0.93 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.78 3dts h SER 152 CO 0.09 0.86 0.10 0.00 -0.87 0.00 0.00 176.83 177.02 3dts h ALA 153 N 1.24 1.38 -0.38 5.18 0.00 -1.50 -1.39 119.26 123.79 3dts h ALA 153 Ca 0.17 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 3dts h ALA 153 Cb 0.39 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 3dts h ALA 153 CO 0.01 0.45 -0.40 0.82 0.00 0.00 0.00 179.25 180.13 3dts h ILE 154 N 0.63 1.27 -0.84 0.00 2.04 -0.76 -2.82 117.51 117.03 3dts h ILE 154 Ca 0.14 -1.57 0.18 0.00 1.00 0.00 0.00 64.86 64.61 3dts h ILE 154 Cb 0.24 1.40 -0.11 0.00 -0.74 0.00 0.00 36.82 37.61 3dts h ILE 154 CO -0.00 0.53 0.37 -0.25 0.00 0.00 0.00 178.15 178.79 3dts h TRP 155 N 0.75 0.62 0.10 1.37 2.91 0.73 0.89 115.95 123.33 3dts h TRP 155 Ca 0.06 0.04 -0.01 0.00 1.13 0.00 0.00 58.89 60.11 3dts h TRP 155 Cb 0.99 -0.14 0.00 0.00 -0.51 0.00 0.00 29.16 29.50 3dts h TRP 155 CO 0.06 0.03 -0.05 1.25 -1.03 0.00 0.00 178.44 178.71 3dts h LEU 156 N 0.46 -0.12 -0.98 0.65 5.85 -1.41 -2.07 115.31 117.70 3dts h LEU 156 Ca 0.49 -0.38 0.09 0.00 0.84 0.00 0.00 57.88 58.92 3dts h LEU 156 Cb 0.83 0.03 -0.08 0.00 0.37 0.00 0.00 40.66 41.81 3dts h LEU 156 CO -0.46 0.35 0.62 -0.25 -0.34 0.00 0.00 178.44 178.36 3dts h TRP 157 N -0.62 1.13 0.30 1.25 7.01 -0.96 -0.94 115.95 123.13 3dts h TRP 157 Ca -0.01 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 61.00 3dts h TRP 157 Cb 0.49 -0.36 0.00 0.00 -2.10 0.00 0.00 29.16 27.19 3dts h TRP 157 CO 0.08 0.51 -0.15 0.52 -2.79 0.00 0.00 178.44 176.61 3dts h MET 158 N 1.05 -0.39 -0.73 2.65 2.86 0.77 -2.69 114.93 118.45 3dts h MET 158 Ca 0.45 0.03 0.12 0.00 -2.06 0.00 0.00 59.70 58.24 3dts h MET 158 Cb 0.33 0.09 -0.08 0.00 0.06 0.00 0.00 31.60 31.99 3dts h MET 158 CO -0.22 -0.15 0.32 0.28 1.06 0.00 0.00 176.91 178.19 3dts h VAL 159 N -0.58 0.74 -0.91 -2.22 2.07 -0.89 0.68 116.25 115.13 3dts h VAL 159 Ca -0.04 -0.17 0.05 0.00 0.82 0.00 0.00 66.70 67.36 3dts h VAL 159 Cb 0.42 0.19 -0.06 0.00 -1.52 0.00 0.00 31.29 30.33 3dts h VAL 159 CO 0.07 0.09 0.60 -0.07 0.02 0.00 0.00 177.57 178.27 3dts h LEU 160 N 0.50 0.95 -0.78 2.57 3.38 -1.01 -2.53 115.31 118.38 3dts h LEU 160 Ca 0.38 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.35 3dts h LEU 160 Cb 0.51 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3dts h LEU 160 CO -0.35 0.63 0.00 0.61 0.09 0.00 0.00 178.44 179.42 3dts n GLY 161 N -1.39 -0.55 1.08 0.83 0.00 -0.84 -3.94 105.19 100.38 3dts n GLY 161 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3dts n GLY 161 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 3dts n PHE 162 N -0.02 0.00 -0.26 1.61 7.35 0.23 -4.74 117.46 121.62 3dts n PHE 162 Ca 0.00 0.00 0.02 0.00 -0.76 0.00 0.00 57.45 56.71 3dts n PHE 162 Cb 0.10 0.14 0.15 0.00 0.35 0.00 0.00 39.48 40.22 3dts n PHE 162 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 3dts h ILE 163 N 0.00 0.85 0.22 -2.13 2.04 -1.63 -2.79 117.51 114.06 3dts h ILE 163 Ca 0.00 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 3dts h ILE 163 Cb 0.00 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.23 3dts h ILE 163 CO 0.00 0.12 -0.10 -0.09 0.00 0.00 0.00 178.15 178.07 3dts h ARG 164 N 0.64 -0.28 -0.27 2.37 2.43 -1.67 -2.54 114.38 115.05 3dts h ARG 164 Ca 0.37 0.02 0.08 0.00 -0.81 0.00 0.00 59.98 59.64 3dts h ARG 164 Cb 0.39 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 3dts h ARG 164 CO -0.27 0.08 0.43 -1.35 -1.51 0.00 0.00 179.97 177.35 3dts h PRO 165 N -0.92 0.00 0.11 0.20 0.11 -1.76 -0.34 132.00 129.41 3dts h PRO 165 Ca -0.03 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 65.77 3dts h PRO 165 Cb 0.49 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.59 3dts h PRO 165 CO 0.05 0.00 -1.56 0.82 -0.21 0.00 0.00 178.00 177.10 3dts h ILE 166 N 0.00 1.12 0.00 4.15 2.04 -1.55 -2.00 117.51 121.27 3dts h ILE 166 Ca 0.13 -2.77 -0.02 0.00 1.00 0.00 0.00 64.86 63.20 3dts h ILE 166 Cb 0.98 2.73 -0.00 0.00 -0.74 0.00 0.00 36.82 39.79 3dts h ILE 166 CO -0.00 0.81 -0.08 -0.07 0.00 0.00 0.00 178.15 178.81 3dts h LEU 167 N 0.07 0.00 0.13 1.44 3.38 -0.67 -3.23 115.31 116.42 3dts h LEU 167 Ca -0.25 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.38 3dts h LEU 167 Cb 2.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.76 3dts h LEU 167 CO 0.15 0.08 -1.77 0.24 0.09 0.00 0.00 178.44 177.24 3dts h MET 168 N 0.00 0.28 0.00 1.13 2.86 -1.29 -3.50 114.93 114.42 3dts h MET 168 Ca -0.00 -0.48 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 3dts h MET 168 Cb 0.76 0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.60 3dts h MET 168 CO 0.01 1.16 0.00 0.41 1.06 0.00 0.00 176.91 179.55 3dts n GLY 169 N 1.82 1.31 3.52 8.32 0.00 -1.08 -5.12 105.19 113.97 3dts n GLY 169 Ca -0.24 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 3dts n GLY 169 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dts s SER 170 N -1.55 -0.48 0.00 1.61 1.04 -0.77 -3.56 113.70 110.00 3dts s SER 170 Ca 0.00 0.35 0.14 0.00 0.48 0.00 0.00 55.95 56.92 3dts s SER 170 Cb 0.00 0.43 0.83 0.00 0.10 0.00 0.00 66.02 67.37 3dts s SER 170 CO 0.00 -0.57 1.54 0.79 0.98 0.00 0.00 173.24 175.98 3dts n TRP 171 N 0.41 0.02 0.15 5.02 5.03 -0.92 -3.17 117.44 123.97 3dts n TRP 171 Ca -0.13 -0.01 0.04 0.00 3.03 0.00 0.00 57.50 60.43 3dts n TRP 171 Cb 0.59 0.00 0.05 0.00 -1.03 0.00 0.00 31.31 30.92 3dts n TRP 171 CO 0.00 0.00 0.00 0.66 -0.03 0.00 0.00 177.69 178.32 3dts h SER 172 N 0.15 0.00 0.00 -0.99 4.64 -1.84 -3.14 113.55 112.37 3dts h SER 172 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dts h SER 172 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 3dts h SER 172 CO 0.00 0.40 0.00 -0.62 -0.87 0.00 0.00 176.83 175.74 3dts n GLU 173 N -3.18 0.91 -2.17 4.77 -0.58 -1.19 -4.87 120.64 114.33 3dts n GLU 173 Ca 0.02 0.00 -0.26 0.00 -0.42 0.00 0.00 57.16 56.50 3dts n GLU 173 Cb 0.70 -1.33 0.07 0.00 -0.57 0.00 0.00 31.44 30.31 3dts n GLU 173 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3dts s ALA 174 N -2.00 3.10 0.01 0.62 0.00 -1.18 -4.74 121.76 117.57 3dts s ALA 174 Ca 0.28 -0.88 -0.22 0.00 0.00 0.00 0.00 51.96 51.15 3dts s ALA 174 Cb 0.13 -2.65 -0.05 0.00 0.00 0.00 0.00 23.12 20.55 3dts s ALA 174 CO 0.22 -1.33 0.64 0.08 0.00 0.00 0.00 175.76 175.38 3dts s VAL 175 N -3.28 4.85 0.77 0.00 1.01 -1.25 -4.87 120.40 117.62 3dts s VAL 175 Ca 0.60 1.36 -0.11 0.00 0.00 0.00 0.00 61.98 63.83 3dts s VAL 175 Cb -0.11 -3.98 0.06 0.00 0.00 0.00 0.00 36.38 32.35 3dts s VAL 175 CO 0.45 0.41 1.14 -2.16 0.00 0.00 0.00 175.10 174.94 3dts s PRO 176 N -0.20 2.17 -0.63 2.72 0.04 -1.26 -4.83 135.00 133.01 3dts s PRO 176 Ca 0.33 0.12 -0.09 0.00 0.04 0.00 0.00 61.00 61.41 3dts s PRO 176 Cb -0.19 -2.00 0.16 0.00 0.04 0.00 0.00 34.50 32.52 3dts s PRO 176 CO 0.19 -1.44 0.50 0.71 0.04 0.00 0.00 177.00 177.01 3dts s TYR 177 N -3.49 3.51 -0.11 0.56 2.02 -0.99 -4.63 117.35 114.24 3dts s TYR 177 Ca 0.61 -2.17 -0.32 0.00 -0.37 0.00 0.00 57.07 54.82 3dts s TYR 177 Cb -0.11 -3.51 0.12 0.00 -0.40 0.00 0.00 41.96 38.07 3dts s TYR 177 CO 0.49 -0.94 1.08 0.20 -1.57 0.00 0.00 175.55 174.80 3dts s GLY 178 N 1.91 -0.36 -0.00 0.71 0.00 -1.26 -2.25 107.32 106.06 3dts s GLY 178 Ca 0.13 1.32 -0.03 0.00 0.00 0.00 0.00 44.72 46.14 3dts s GLY 178 CO -0.04 0.44 0.65 -2.22 0.00 0.00 0.00 173.10 171.92 3dts h ILE 179 N 2.00 0.00 -0.29 0.90 1.08 -1.79 -3.05 117.51 116.36 3dts h ILE 179 Ca -0.15 -0.05 -0.17 0.00 -0.39 0.00 0.00 64.86 64.11 3dts h ILE 179 Cb 1.20 0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 34.95 3dts h ILE 179 CO 0.26 0.00 -0.47 -0.26 -0.69 0.00 0.00 178.15 176.99 3dts h PHE 180 N -0.14 1.03 -0.93 1.37 0.04 -1.42 -3.23 116.94 113.65 3dts h PHE 180 Ca -0.01 -0.35 0.08 0.00 2.80 0.00 0.00 57.97 60.49 3dts h PHE 180 Cb 0.07 -0.20 -0.07 0.00 2.20 0.00 0.00 35.95 37.95 3dts h PHE 180 CO 0.12 1.16 0.58 0.66 -0.60 0.00 0.00 178.31 180.24 3dts h SER 181 N 0.60 0.89 0.24 2.17 4.64 -1.73 0.12 113.55 120.48 3dts h SER 181 Ca 0.02 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 3dts h SER 181 Cb 1.07 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 3dts h SER 181 CO 0.11 0.54 -0.00 0.00 -0.87 0.00 0.00 176.83 176.60 3dts n HIS 182 N -4.60 0.00 -0.00 4.77 1.44 -1.15 -2.34 115.22 113.33 3dts n HIS 182 Ca 0.15 0.00 -0.08 0.00 -2.01 0.00 0.00 57.72 55.78 3dts n HIS 182 Cb 0.24 -0.12 -0.13 0.00 0.12 0.00 0.00 29.99 30.10 3dts n HIS 182 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 3dts h LEU 183 N 0.02 0.00 0.14 2.39 3.38 -0.81 -3.22 115.31 117.21 3dts h LEU 183 Ca 0.00 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.67 3dts h LEU 183 Cb 0.12 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.91 3dts h LEU 183 CO 0.00 0.99 -1.26 0.44 0.09 0.00 0.00 178.44 178.70 3dts h ASP 184 N 0.00 0.86 -0.56 -0.43 3.32 -1.07 -3.12 116.42 115.42 3dts h ASP 184 Ca -0.23 -0.84 0.09 0.00 0.02 0.00 0.00 57.03 56.07 3dts h ASP 184 Cb 1.95 -0.27 -0.07 0.00 0.22 0.00 0.00 39.33 41.16 3dts h ASP 184 CO 0.09 1.62 0.16 -0.25 -1.72 0.00 0.00 179.24 179.14 3dts h TRP 185 N 0.22 0.28 -0.48 4.55 7.01 -1.60 0.36 115.95 126.29 3dts h TRP 185 Ca -0.20 0.03 0.06 0.00 2.11 0.00 0.00 58.89 60.89 3dts h TRP 185 Cb 1.94 -0.04 -0.05 0.00 -2.10 0.00 0.00 29.16 28.92 3dts h TRP 185 CO 0.12 0.04 0.20 1.15 -2.79 0.00 0.00 178.44 177.16 3dts h THR 186 N 0.32 0.89 0.10 2.65 2.02 -1.60 0.26 112.91 117.54 3dts h THR 186 Ca 0.28 -0.13 -0.00 0.00 0.77 0.00 0.00 66.41 67.32 3dts h THR 186 Cb 0.37 0.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 3dts h THR 186 CO -0.32 0.07 -0.05 -1.13 0.37 0.00 0.00 175.52 174.46 3dts h ASN 187 N 0.39 -0.11 -0.12 4.18 -1.24 -1.27 -3.10 115.58 114.32 3dts h ASN 187 Ca 0.22 -0.29 0.04 0.00 0.71 0.00 0.00 56.30 56.98 3dts h ASN 187 Cb 0.19 0.03 -0.06 0.00 0.73 0.00 0.00 38.32 39.21 3dts h ASN 187 CO -0.20 0.24 -0.40 -1.13 -1.29 0.00 0.00 177.43 174.65 3dts h ASN 188 N -0.47 -1.25 -0.93 1.15 -0.00 -0.10 -1.91 115.58 112.07 3dts h ASN 188 Ca -0.01 0.17 0.26 0.00 -0.00 0.00 0.00 56.30 56.71 3dts h ASN 188 Cb 0.39 0.51 -0.14 0.00 -0.00 0.00 0.00 38.32 39.08 3dts h ASN 188 CO 0.02 -0.42 0.39 0.15 -0.00 0.00 0.00 177.43 177.57 3dts h PHE 189 N -0.48 0.62 0.07 0.67 3.04 -1.02 0.23 116.94 120.07 3dts h PHE 189 Ca 0.08 0.04 -0.00 0.00 3.98 0.00 0.00 57.97 62.07 3dts h PHE 189 Cb 0.61 -0.12 0.00 0.00 2.56 0.00 0.00 35.95 39.00 3dts h PHE 189 CO -0.47 -0.16 -0.03 1.03 -2.02 0.00 0.00 178.31 176.67 3dts h SER 190 N 0.30 -0.08 -0.47 0.41 0.87 -1.29 -3.00 113.55 110.28 3dts h SER 190 Ca 0.61 -0.32 0.10 0.00 -1.23 0.00 0.00 61.79 60.95 3dts h SER 190 Cb 1.28 0.02 -0.09 0.00 -0.44 0.00 0.00 62.40 63.17 3dts h SER 190 CO -0.61 0.29 -0.15 -0.07 -0.53 0.00 0.00 176.83 175.76 3dts h LEU 191 N -0.46 -0.54 -2.34 2.23 3.38 0.01 -0.92 115.31 116.67 3dts h LEU 191 Ca -0.01 0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 3dts h LEU 191 Cb 0.40 0.33 -0.00 0.00 0.09 0.00 0.00 40.66 41.48 3dts h LEU 191 CO 0.02 -0.19 -0.01 0.58 0.09 0.00 0.00 178.44 178.93 3dts h VAL 192 N -0.04 0.62 -0.36 1.22 2.07 -0.80 -2.49 116.25 116.47 3dts h VAL 192 Ca 0.23 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.69 3dts h VAL 192 Cb 0.39 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 3dts h VAL 192 CO -0.51 0.01 0.00 1.41 0.02 0.00 0.00 177.57 178.51 3dts n HIS 193 N -3.95 0.78 -1.91 1.57 8.25 -0.46 -4.85 115.22 114.65 3dts n HIS 193 Ca -0.03 -0.66 0.00 0.00 -0.26 0.00 0.00 57.72 56.77 3dts n HIS 193 Cb 0.10 -0.16 0.00 0.00 1.12 0.00 0.00 29.99 31.04 3dts n HIS 193 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dts n GLY 194 N 0.22 0.45 2.63 -1.41 0.00 -0.76 -0.51 105.19 105.81 3dts n GLY 194 Ca 0.17 -0.46 -0.05 0.00 0.00 0.00 0.00 46.02 45.68 3dts n GLY 194 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3dts n ASN 195 N -0.92 -1.08 0.14 1.61 5.15 -0.56 -3.64 115.26 115.96 3dts n ASN 195 Ca 0.00 1.35 0.18 0.00 -0.60 0.00 0.00 54.58 55.51 3dts n ASN 195 Cb 0.48 -5.02 0.67 0.00 -0.53 0.00 0.00 39.78 35.38 3dts n ASN 195 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 3dts h LEU 196 N 4.22 0.00 -1.94 1.20 5.85 -1.87 -2.24 115.31 120.53 3dts h LEU 196 Ca -0.52 0.00 0.28 0.00 0.84 0.00 0.00 57.88 58.48 3dts h LEU 196 Cb 1.18 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.16 3dts h LEU 196 CO 0.01 0.00 0.70 -0.26 -0.34 0.00 0.00 178.44 178.55 3dts h PHE 197 N 0.00 0.06 -0.00 1.25 0.04 -1.96 0.76 116.94 117.09 3dts h PHE 197 Ca 0.16 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.93 3dts h PHE 197 Cb 1.28 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 39.42 3dts h PHE 197 CO 0.00 0.01 -0.03 0.66 -0.60 0.00 0.00 178.31 178.35 3dts n TYR 198 N -4.27 0.00 -2.63 -0.55 4.01 -0.84 -4.78 117.16 108.09 3dts n TYR 198 Ca 0.21 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.52 3dts n TYR 198 Cb 1.02 -0.07 -0.02 0.00 -0.31 0.00 0.00 39.34 39.96 3dts n TYR 198 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 3dts s ASN 199 N -2.18 6.95 0.39 7.72 3.84 0.27 -4.82 114.94 127.10 3dts s ASN 199 Ca 0.39 1.13 0.07 0.00 0.21 0.00 0.00 52.86 54.66 3dts s ASN 199 Cb 0.21 -2.54 0.81 0.00 -0.55 0.00 0.00 41.25 39.17 3dts s ASN 199 CO 0.40 -0.85 2.00 1.55 -2.79 0.00 0.00 177.10 177.41 3dts h PRO 200 N 8.03 0.64 0.00 0.43 0.13 -1.86 -2.00 132.00 137.37 3dts h PRO 200 Ca -0.21 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 64.89 3dts h PRO 200 Cb 1.06 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.05 3dts h PRO 200 CO 1.02 0.42 -0.00 0.74 -0.23 0.00 0.00 178.00 179.96 3dts h PHE 201 N 0.66 -0.00 -0.93 1.56 0.04 -1.92 -1.44 116.94 114.90 3dts h PHE 201 Ca 0.25 -0.00 0.16 0.00 2.80 0.00 0.00 57.97 61.19 3dts h PHE 201 Cb 0.17 0.00 -0.08 0.00 2.20 0.00 0.00 35.95 38.24 3dts h PHE 201 CO -0.00 0.68 0.60 1.25 -0.60 0.00 0.00 178.31 180.23 3dts h HIS 202 N -0.68 0.86 -0.00 -0.55 2.76 -1.79 1.60 115.15 117.35 3dts h HIS 202 Ca -0.00 0.03 -0.17 0.00 -2.20 0.00 0.00 60.37 58.03 3dts h HIS 202 Cb 0.68 -0.27 -0.02 0.00 1.55 0.00 0.00 27.41 29.35 3dts h HIS 202 CO 0.16 0.27 -0.79 0.78 -1.30 0.00 0.00 177.93 177.06 3dts h GLY 203 N 0.69 0.02 1.75 5.26 0.00 -1.40 -1.98 103.07 107.40 3dts h GLY 203 Ca 0.49 -0.04 -0.20 0.00 0.00 0.00 0.00 47.33 47.58 3dts h GLY 203 CO -0.25 0.03 -0.87 -2.00 0.00 0.00 0.00 176.54 173.45 3dts h LEU 204 N 0.01 0.29 -0.84 3.11 5.85 0.53 -2.91 115.31 121.35 3dts h LEU 204 Ca -0.01 -0.23 -0.06 0.00 0.84 0.00 0.00 57.88 58.42 3dts h LEU 204 Cb 1.40 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 42.31 3dts h LEU 204 CO 0.10 1.03 0.17 -1.28 -0.34 0.00 0.00 178.44 178.12 3dts h SER 205 N 0.13 0.97 0.76 1.25 0.87 0.23 -2.68 113.55 115.08 3dts h SER 205 Ca -0.05 -0.19 -0.14 0.00 -1.23 0.00 0.00 61.79 60.18 3dts h SER 205 Cb 1.50 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 63.18 3dts h SER 205 CO 0.14 0.93 -0.66 0.40 -0.53 0.00 0.00 176.83 177.10 3dts h ILE 206 N 0.99 1.41 -0.53 2.23 2.04 -1.35 -2.48 117.51 119.82 3dts h ILE 206 Ca 0.21 -2.32 0.07 0.00 1.00 0.00 0.00 64.86 63.82 3dts h ILE 206 Cb 0.33 2.27 -0.06 0.00 -0.74 0.00 0.00 36.82 38.63 3dts h ILE 206 CO -0.00 0.65 0.21 0.00 0.00 0.00 0.00 178.15 179.01 3dts h ALA 207 N 1.34 0.66 0.00 1.87 0.00 -1.27 -0.30 119.26 121.56 3dts h ALA 207 Ca -0.01 0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 3dts h ALA 207 Cb 1.22 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.00 3dts h ALA 207 CO 0.09 -0.17 -0.78 0.74 0.00 0.00 0.00 179.25 179.13 3dts h PHE 208 N 0.41 0.00 -0.42 0.00 0.04 -1.47 0.24 116.94 115.73 3dts h PHE 208 Ca 0.25 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.96 3dts h PHE 208 Cb 0.25 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.38 3dts h PHE 208 CO -0.14 0.78 0.05 1.25 -0.60 0.00 0.00 178.31 179.64 3dts h LEU 209 N 0.00 0.69 -0.13 1.54 5.85 -0.90 0.23 115.31 122.59 3dts h LEU 209 Ca -0.01 -0.28 -0.16 0.00 0.84 0.00 0.00 57.88 58.28 3dts h LEU 209 Cb 1.43 -0.18 0.01 0.00 0.37 0.00 0.00 40.66 42.29 3dts h LEU 209 CO 0.10 0.79 -0.53 1.88 -0.34 0.00 0.00 178.44 180.34 3dts h TYR 210 N 0.56 0.78 -0.73 1.25 0.05 -1.12 -3.20 116.97 114.56 3dts h TYR 210 Ca 0.12 -0.33 0.18 0.00 0.05 0.00 0.00 58.73 58.75 3dts h TYR 210 Cb 0.41 -0.12 -0.04 0.00 1.01 0.00 0.00 36.73 37.99 3dts h TYR 210 CO 0.03 1.12 0.51 0.78 -1.05 0.00 0.00 178.16 179.55 3dts h GLY 211 N 0.22 0.36 1.56 3.88 0.00 -0.48 -0.68 103.07 107.93 3dts h GLY 211 Ca -0.03 -0.08 -0.19 0.00 0.00 0.00 0.00 47.33 47.03 3dts h GLY 211 CO 0.11 0.02 -0.73 1.76 0.00 0.00 0.00 176.54 177.70 3dts h SER 212 N 0.19 0.51 0.54 0.19 0.02 -0.56 0.58 113.55 115.02 3dts h SER 212 Ca 0.36 -0.33 -0.11 0.00 -0.84 0.00 0.00 61.79 60.86 3dts h SER 212 Cb 1.13 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 63.51 3dts h SER 212 CO -0.07 1.08 -0.54 0.00 -1.14 0.00 0.00 176.83 176.16 3dts h ALA 213 N 0.91 1.11 0.04 3.77 0.00 -1.20 -0.76 119.26 123.13 3dts h ALA 213 Ca -0.03 -0.49 -0.09 0.00 0.00 0.00 0.00 54.91 54.30 3dts h ALA 213 Cb 1.31 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 19.02 3dts h ALA 213 CO 0.13 0.67 -0.39 1.25 0.00 0.00 0.00 179.25 180.91 3dts h LEU 214 N 0.00 0.27 0.14 0.00 5.85 -1.08 -2.86 115.31 117.63 3dts h LEU 214 Ca -0.01 -0.88 -0.01 0.00 0.84 0.00 0.00 57.88 57.83 3dts h LEU 214 Cb 0.95 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.90 3dts h LEU 214 CO 0.07 1.12 -0.07 0.25 -0.34 0.00 0.00 178.44 179.48 3dts h LEU 215 N -0.54 -0.16 -1.12 2.25 5.85 -0.84 -1.82 115.31 118.93 3dts h LEU 215 Ca -0.06 -0.16 -0.07 0.00 0.84 0.00 0.00 57.88 58.43 3dts h LEU 215 Cb 1.22 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.27 3dts h LEU 215 CO 0.07 0.07 -0.16 0.15 -0.34 0.00 0.00 178.44 178.23 3dts h PHE 216 N -0.38 0.47 -0.20 1.25 3.04 -1.29 0.71 116.94 120.54 3dts h PHE 216 Ca -0.02 -0.07 -0.18 0.00 3.98 0.00 0.00 57.97 61.68 3dts h PHE 216 Cb 0.30 -0.13 -0.00 0.00 2.56 0.00 0.00 35.95 38.69 3dts h PHE 216 CO -0.01 0.58 -0.60 0.00 -2.02 0.00 0.00 178.31 176.26 3dts h ALA 217 N 1.44 0.57 0.41 2.41 0.00 -1.53 -0.73 119.26 121.82 3dts h ALA 217 Ca 0.07 -0.54 -0.02 0.00 0.00 0.00 0.00 54.91 54.43 3dts h ALA 217 Cb 0.51 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3dts h ALA 217 CO 0.03 0.69 -0.20 0.52 0.00 0.00 0.00 179.25 180.30 3dts h MET 218 N 0.50 -0.53 0.80 0.00 2.86 -0.77 -2.03 114.93 115.76 3dts h MET 218 Ca -0.00 0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.63 3dts h MET 218 Cb 1.18 0.12 0.01 0.00 0.06 0.00 0.00 31.60 32.97 3dts h MET 218 CO 0.12 -0.24 -0.39 1.25 1.06 0.00 0.00 176.91 178.71 3dts h HIS 219 N -0.80 -1.00 -0.41 -0.22 6.17 0.41 -1.41 115.15 117.89 3dts h HIS 219 Ca -0.06 -0.02 0.08 0.00 0.71 0.00 0.00 60.37 61.08 3dts h HIS 219 Cb 0.54 0.33 -0.09 0.00 2.52 0.00 0.00 27.41 30.71 3dts h HIS 219 CO 0.00 -0.62 -0.32 0.78 0.71 0.00 0.00 177.93 178.48 3dts h GLY 220 N -1.10 -0.23 1.05 5.26 0.00 -1.24 -0.17 103.07 106.64 3dts h GLY 220 Ca -0.11 0.41 0.01 0.00 0.00 0.00 0.00 47.33 47.64 3dts h GLY 220 CO 0.18 -0.21 0.63 0.00 0.00 0.00 0.00 176.54 177.15 3dts h ALA 221 N 0.78 1.33 -0.31 3.60 0.00 -1.35 0.08 119.26 123.39 3dts h ALA 221 Ca 0.18 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 3dts h ALA 221 Cb 0.54 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3dts h ALA 221 CO -0.54 0.62 0.12 1.15 0.00 0.00 0.00 179.25 180.60 3dts h THR 222 N 1.28 1.18 -0.37 0.00 2.02 -0.72 -1.95 112.91 114.36 3dts h THR 222 Ca 0.35 -0.55 -0.07 0.00 0.77 0.00 0.00 66.41 66.92 3dts h THR 222 Cb -0.13 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 3dts h THR 222 CO -0.08 0.19 -0.06 0.40 0.37 0.00 0.00 175.52 176.34 3dts h ILE 223 N 0.35 1.23 -0.20 3.11 1.08 -0.52 -2.65 117.51 119.91 3dts h ILE 223 Ca 0.10 -0.97 -0.13 0.00 -0.39 0.00 0.00 64.86 63.47 3dts h ILE 223 Cb 0.18 1.01 -0.01 0.00 -3.07 0.00 0.00 36.82 34.93 3dts h ILE 223 CO -0.01 0.33 -0.44 -0.07 -0.69 0.00 0.00 178.15 177.27 3dts h LEU 224 N 0.56 0.54 -1.34 1.44 3.38 -0.83 -1.63 115.31 117.44 3dts h LEU 224 Ca 0.11 -0.25 -0.06 0.00 0.09 0.00 0.00 57.88 57.77 3dts h LEU 224 Cb 0.45 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3dts h LEU 224 CO 0.02 0.91 -0.21 0.00 0.09 0.00 0.00 178.44 179.25 3dts h ALA 225 N 1.12 1.45 -0.32 1.53 0.00 -1.16 -2.98 119.26 118.89 3dts h ALA 225 Ca 0.03 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3dts h ALA 225 Cb 0.93 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3dts h ALA 225 CO 0.08 0.39 0.00 1.33 0.00 0.00 0.00 179.25 181.05 3dts n VAL 226 N -4.22 0.59 0.29 0.00 0.24 -1.02 -4.46 118.33 109.76 3dts n VAL 226 Ca -0.01 -0.80 0.16 0.00 -2.04 0.00 0.00 64.34 61.65 3dts n VAL 226 Cb 0.31 0.85 0.78 0.00 -1.47 0.00 0.00 33.84 34.31 3dts n VAL 226 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 3dts h SER 227 N 3.18 0.00 0.06 -1.34 4.64 -1.13 -1.60 113.55 117.36 3dts h SER 227 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dts h SER 227 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 3dts h SER 227 CO 0.00 0.00 0.00 -2.11 -0.87 0.00 0.00 176.83 173.85 3dts n ARG 228 N -2.66 0.33 0.00 4.77 1.85 -1.26 -1.09 116.66 118.59 3dts n ARG 228 Ca -0.01 0.05 0.00 0.00 -1.00 0.00 0.00 57.85 56.89 3dts n ARG 228 Cb 0.14 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.05 3dts n ARG 228 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 3dts n PHE 229 N -1.08 0.00 -1.19 2.89 3.72 -0.62 -4.99 117.46 116.19 3dts n PHE 229 Ca 0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.48 3dts n PHE 229 Cb 0.06 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.60 3dts n PHE 229 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3dts n GLY 230 N 0.04 0.74 0.11 1.37 0.00 -0.25 -4.59 105.19 102.61 3dts n GLY 230 Ca 0.00 -0.31 -0.13 0.00 0.00 0.00 0.00 46.02 45.58 3dts n GLY 230 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3dts h GLY 231 N 0.00 0.28 1.79 -0.02 0.00 -1.63 -3.13 103.07 100.36 3dts h GLY 231 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.05 3dts h GLY 231 CO 0.00 0.26 0.08 1.05 0.00 0.00 0.00 176.54 177.93 3dts h GLU 232 N -0.15 0.00 -3.39 4.80 9.09 -1.85 -3.13 114.58 119.96 3dts h GLU 232 Ca 0.02 0.00 -0.76 0.00 0.05 0.00 0.00 59.36 58.66 3dts h GLU 232 Cb 0.62 0.00 -0.17 0.00 -1.65 0.00 0.00 28.75 27.55 3dts h GLU 232 CO 0.03 0.00 1.90 1.28 0.05 0.00 0.00 179.01 182.27 3dts n LEU 233 N -2.29 6.70 0.11 3.06 4.77 -1.18 -4.82 117.00 123.33 3dts n LEU 233 Ca -0.01 -4.73 -0.11 0.00 -0.03 0.00 0.00 56.01 51.13 3dts n LEU 233 Cb 0.12 -1.45 -0.07 0.00 -2.33 0.00 0.00 43.42 39.69 3dts n LEU 233 CO 0.10 1.45 0.40 -0.33 -1.33 0.00 0.00 177.39 177.67 3dts h GLU 234 N 5.65 -0.32 -1.00 3.23 5.08 -1.81 -2.12 114.58 123.29 3dts h GLU 234 Ca 0.38 0.02 0.28 0.00 -1.00 0.00 0.00 59.36 59.04 3dts h GLU 234 Cb 0.61 0.07 -0.13 0.00 0.50 0.00 0.00 28.75 29.80 3dts h GLU 234 CO 1.59 0.03 0.58 -0.07 -1.00 0.00 0.00 179.01 180.15 3dts h LEU 235 N -0.90 0.61 -0.17 1.33 3.38 -1.92 0.67 115.31 118.32 3dts h LEU 235 Ca -0.03 0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 3dts h LEU 235 Cb 0.51 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 3dts h LEU 235 CO 0.06 0.01 0.10 -0.33 0.09 0.00 0.00 178.44 178.36 3dts h GLU 236 N 0.48 0.23 0.00 1.13 3.07 -1.93 -1.67 114.58 115.89 3dts h GLU 236 Ca 0.68 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 59.52 3dts h GLU 236 Cb 1.41 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.27 3dts h GLU 236 CO -0.53 0.21 0.00 1.96 -1.40 0.00 0.00 179.01 179.26 3dts h GLN 237 N 0.18 0.00 0.15 2.33 1.08 0.85 -1.60 115.11 118.10 3dts h GLN 237 Ca 0.06 0.00 -0.31 0.00 -1.45 0.00 0.00 58.65 56.95 3dts h GLN 237 Cb 0.05 0.00 0.03 0.00 -0.05 0.00 0.00 27.48 27.51 3dts h GLN 237 CO -0.01 0.00 -1.30 0.82 -0.95 0.00 0.00 178.83 177.39 3dts h ILE 238 N 0.00 1.28 0.00 2.54 2.04 0.52 -2.89 117.51 121.01 3dts h ILE 238 Ca 0.00 -2.51 0.00 0.00 1.00 0.00 0.00 64.86 63.35 3dts h ILE 238 Cb 0.35 2.77 0.00 0.00 -0.74 0.00 0.00 36.82 39.20 3dts h ILE 238 CO 0.00 0.76 -0.52 0.00 0.00 0.00 0.00 178.15 178.39 3dts n ALA 239 N -2.69 2.93 -3.20 1.87 0.00 -0.97 -4.67 120.51 113.78 3dts n ALA 239 Ca -0.15 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.06 3dts n ALA 239 Cb 1.01 -1.21 -0.02 0.00 0.00 0.00 0.00 19.45 19.24 3dts n ALA 239 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3dts s ASP 240 N -4.01 -1.03 0.04 0.00 -1.08 -0.62 -5.12 116.67 104.85 3dts s ASP 240 Ca 0.08 -0.02 -0.30 0.00 -0.52 0.00 0.00 52.55 51.78 3dts s ASP 240 Cb 0.14 1.76 -0.08 0.00 -1.46 0.00 0.00 42.92 43.28 3dts s ASP 240 CO 0.70 -0.31 1.64 -0.60 0.52 0.00 0.00 175.17 177.12 3dts s ARG 241 N 2.71 4.20 0.52 4.34 3.52 -1.09 -4.01 118.95 129.13 3dts s ARG 241 Ca 0.10 2.28 0.04 0.00 -0.13 0.00 0.00 55.73 58.03 3dts s ARG 241 Cb -0.11 -3.69 0.01 0.00 -1.56 0.00 0.00 34.95 29.60 3dts s ARG 241 CO -0.26 -0.75 0.25 0.20 -0.81 0.00 0.00 175.30 173.92 3dts s GLY 242 N 2.62 2.58 0.59 8.12 0.00 -1.26 -5.02 107.32 114.95 3dts s GLY 242 Ca 0.73 -1.07 0.31 0.00 0.00 0.00 0.00 44.72 44.69 3dts s GLY 242 CO 0.32 -2.02 2.24 0.00 0.00 0.00 0.00 173.10 173.63 3dts h THR 243 N 1.03 0.49 -0.31 0.90 1.03 -1.95 -1.38 112.91 112.71 3dts h THR 243 Ca -0.40 -0.09 -0.09 0.00 -0.01 0.00 0.00 66.41 65.82 3dts h THR 243 Cb 1.30 1.06 -0.02 0.00 -1.07 0.00 0.00 68.15 69.42 3dts h THR 243 CO 0.64 0.02 -0.20 0.00 -0.01 0.00 0.00 175.52 175.97 3dts h ALA 244 N 1.98 1.08 0.00 0.00 0.00 -1.87 -1.04 119.26 119.41 3dts h ALA 244 Ca -0.00 -0.33 -0.18 0.00 0.00 0.00 0.00 54.91 54.40 3dts h ALA 244 Cb 0.06 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3dts h ALA 244 CO 0.00 0.56 -0.87 0.00 0.00 0.00 0.00 179.25 178.94 3dts h ALA 245 N 1.27 0.51 0.15 0.00 0.00 -1.64 -2.47 119.26 117.08 3dts h ALA 245 Ca 0.08 -0.79 -0.28 0.00 0.00 0.00 0.00 54.91 53.92 3dts h ALA 245 Cb 0.63 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.29 3dts h ALA 245 CO 0.04 1.09 -1.35 0.93 0.00 0.00 0.00 179.25 179.97 3dts h GLU 246 N 0.00 0.32 -0.28 0.00 5.08 -1.40 -3.10 114.58 115.20 3dts h GLU 246 Ca -0.01 -0.55 -0.11 0.00 -1.00 0.00 0.00 59.36 57.69 3dts h GLU 246 Cb 1.59 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 31.03 3dts h GLU 246 CO 0.11 1.26 -0.29 0.00 -1.00 0.00 0.00 179.01 179.10 3dts h ARG 247 N -0.19 0.56 -0.33 2.33 3.08 -1.31 -0.29 114.38 118.23 3dts h ARG 247 Ca -0.27 -0.23 -0.05 0.00 0.07 0.00 0.00 59.98 59.49 3dts h ARG 247 Cb 1.84 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 31.86 3dts h ARG 247 CO 0.13 0.79 -0.02 0.00 -1.07 0.00 0.00 179.97 179.80 3dts h ALA 248 N 1.20 1.34 0.07 0.04 0.00 -1.55 -1.56 119.26 118.81 3dts h ALA 248 Ca 0.06 -0.21 -0.16 0.00 0.00 0.00 0.00 54.91 54.60 3dts h ALA 248 Cb 0.75 -0.15 0.02 0.00 0.00 0.00 0.00 17.79 18.41 3dts h ALA 248 CO 0.06 0.45 -0.67 0.00 0.00 0.00 0.00 179.25 179.09 3dts h ALA 249 N 1.48 -0.02 -0.69 0.00 0.00 -1.41 -3.32 119.26 115.30 3dts h ALA 249 Ca 0.10 -0.63 0.03 0.00 0.00 0.00 0.00 54.91 54.41 3dts h ALA 249 Cb 0.36 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 3dts h ALA 249 CO 0.01 0.33 0.45 -0.07 0.00 0.00 0.00 179.25 179.98 3dts h LEU 250 N -0.30 0.73 -0.56 0.00 3.38 -0.92 -0.10 115.31 117.54 3dts h LEU 250 Ca -0.10 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.87 3dts h LEU 250 Cb 1.46 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 42.00 3dts h LEU 250 CO 0.13 0.51 0.36 0.15 0.09 0.00 0.00 178.44 179.68 3dts h PHE 251 N 0.85 0.68 0.00 1.13 3.04 -1.39 -1.84 116.94 119.42 3dts h PHE 251 Ca 0.27 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.23 3dts h PHE 251 Cb 0.02 -0.23 0.00 0.00 2.56 0.00 0.00 35.95 38.30 3dts h PHE 251 CO -0.00 0.41 0.00 -1.49 -2.02 0.00 0.00 178.31 175.21 3dts h TRP 252 N 0.73 0.00 0.00 0.41 4.06 -1.51 -2.69 115.95 116.95 3dts h TRP 252 Ca 0.21 0.00 -0.23 0.00 2.06 0.00 0.00 58.89 60.94 3dts h TRP 252 Cb -0.05 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.11 3dts h TRP 252 CO -0.04 0.00 -0.94 -0.09 -3.56 0.00 0.00 178.44 173.80 3dts h ARG 253 N 0.00 0.41 0.00 0.49 2.43 -0.62 -2.17 114.38 114.92 3dts h ARG 253 Ca 0.00 -0.45 0.00 0.00 -0.81 0.00 0.00 59.98 58.72 3dts h ARG 253 Cb 0.98 0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.65 3dts h ARG 253 CO 0.00 1.11 -0.23 0.91 -1.51 0.00 0.00 179.97 180.25 3dts n TRP 254 N -3.75 0.17 -0.10 2.20 8.01 -0.73 -1.98 117.44 121.26 3dts n TRP 254 Ca -0.07 0.05 -0.20 0.00 -1.31 0.00 0.00 57.50 55.97 3dts n TRP 254 Cb 0.84 -0.49 -0.12 0.00 -2.01 0.00 0.00 31.31 29.53 3dts n TRP 254 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.69 179.09 3dts n THR 255 N -1.65 1.56 -2.14 -0.99 -1.04 -1.02 -4.78 114.28 104.22 3dts n THR 255 Ca 0.06 -0.55 0.04 0.00 -2.04 0.00 0.00 64.05 61.56 3dts n THR 255 Cb 0.36 -1.56 0.05 0.00 -1.82 0.00 0.00 70.33 67.36 3dts n THR 255 CO 0.00 0.00 0.00 1.15 -0.64 0.00 0.00 175.07 175.58 3dts n MET 256 N -3.46 0.29 0.00 -2.82 0.00 -0.82 -5.04 117.12 105.27 3dts n MET 256 Ca -0.44 -1.91 0.00 0.00 0.00 0.00 0.00 57.70 55.35 3dts n MET 256 Cb 0.98 -0.46 0.00 0.00 0.00 0.00 0.00 33.22 33.74 3dts n MET 256 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3dts n GLY 257 N 0.01 2.52 3.10 3.17 0.00 -0.84 -4.94 105.19 108.21 3dts n GLY 257 Ca 0.07 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.98 3dts n GLY 257 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3dts s PHE 258 N -0.27 0.68 0.17 1.61 -0.71 -1.26 -4.90 117.98 113.29 3dts s PHE 258 Ca 0.00 -0.81 0.02 0.00 -1.04 0.00 0.00 56.93 55.11 3dts s PHE 258 Cb 0.00 -0.42 -0.01 0.00 -1.21 0.00 0.00 43.02 41.38 3dts s PHE 258 CO 0.00 -0.19 0.09 0.27 -1.34 0.00 0.00 175.22 174.04 3dts n ASN 259 N 0.54 0.57 -3.72 1.98 6.94 -1.26 -3.91 115.26 116.41 3dts n ASN 259 Ca -0.16 -1.97 -0.18 0.00 -0.02 0.00 0.00 54.58 52.25 3dts n ASN 259 Cb 0.59 0.56 -0.09 0.00 -2.36 0.00 0.00 39.78 38.48 3dts n ASN 259 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3dts s ALA 260 N -2.53 1.75 0.36 -2.53 0.00 -1.26 -5.06 121.76 112.48 3dts s ALA 260 Ca 0.12 -1.89 0.07 0.00 0.00 0.00 0.00 51.96 50.27 3dts s ALA 260 Cb 0.01 1.37 -0.02 0.00 0.00 0.00 0.00 23.12 24.48 3dts s ALA 260 CO 0.09 -0.60 0.38 0.95 0.00 0.00 0.00 175.76 176.58 3dts s THR 261 N -3.65 3.42 0.44 0.00 -4.23 -1.26 -4.74 115.64 105.61 3dts s THR 261 Ca 0.39 -1.23 0.16 0.00 -1.18 0.00 0.00 61.69 59.82 3dts s THR 261 Cb 0.04 -3.18 0.35 0.00 1.34 0.00 0.00 72.50 71.05 3dts s THR 261 CO 0.21 -0.11 1.95 -0.03 -0.54 0.00 0.00 174.62 176.10 3dts h MET 262 N 1.05 0.37 0.01 3.99 4.05 -1.92 -1.63 114.93 120.86 3dts h MET 262 Ca -0.44 -0.02 -0.22 0.00 -0.28 0.00 0.00 59.70 58.74 3dts h MET 262 Cb 1.26 -0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 31.95 3dts h MET 262 CO 0.55 0.24 -1.17 1.49 0.23 0.00 0.00 176.91 178.26 3dts h GLU 263 N 0.38 0.03 -0.89 0.39 4.81 -1.95 -3.39 114.58 113.97 3dts h GLU 263 Ca 0.32 -0.05 0.24 0.00 -0.13 0.00 0.00 59.36 59.74 3dts h GLU 263 Cb 0.72 0.02 -0.14 0.00 0.63 0.00 0.00 28.75 29.98 3dts h GLU 263 CO -0.09 1.03 0.26 0.78 -0.73 0.00 0.00 179.01 180.26 3dts h GLY 264 N -0.81 1.42 1.77 1.92 0.00 -1.87 0.45 103.07 105.95 3dts h GLY 264 Ca -0.31 -0.05 0.02 0.00 0.00 0.00 0.00 47.33 46.99 3dts h GLY 264 CO -0.15 -0.38 0.09 1.19 0.00 0.00 0.00 176.54 177.29 3dts h ILE 265 N 0.22 0.47 -0.00 2.60 6.09 -1.49 0.26 117.51 125.66 3dts h ILE 265 Ca 0.57 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 64.06 3dts h ILE 265 Cb 1.16 0.92 0.00 0.00 0.47 0.00 0.00 36.82 39.37 3dts h ILE 265 CO -0.65 0.00 -0.13 1.41 -3.07 0.00 0.00 178.15 175.71 3dts n HIS 266 N -3.78 0.00 -0.03 2.19 8.25 0.16 -0.89 115.22 121.11 3dts n HIS 266 Ca -0.01 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.29 3dts n HIS 266 Cb 0.19 -0.22 -0.14 0.00 1.12 0.00 0.00 29.99 30.94 3dts n HIS 266 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3dts n ARG 267 N -1.06 0.70 0.25 -0.41 1.74 0.88 -2.00 116.66 116.75 3dts n ARG 267 Ca 0.13 0.23 -0.15 0.00 -0.77 0.00 0.00 57.85 57.29 3dts n ARG 267 Cb 0.29 -1.69 -0.08 0.00 -1.02 0.00 0.00 32.46 29.96 3dts n ARG 267 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 3dts h TRP 268 N 0.03 -0.58 -0.38 -1.55 4.06 -1.28 -2.20 115.95 114.05 3dts h TRP 268 Ca -0.42 -0.01 0.04 0.00 2.06 0.00 0.00 58.89 60.56 3dts h TRP 268 Cb 2.03 0.19 -0.06 0.00 -1.00 0.00 0.00 29.16 30.32 3dts h TRP 268 CO 0.04 -0.28 -0.39 0.00 -3.56 0.00 0.00 178.44 174.25 3dts h ALA 269 N -0.40 -0.57 -0.15 1.49 0.00 -1.14 0.69 119.26 119.19 3dts h ALA 269 Ca -0.06 0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.90 3dts h ALA 269 Cb 0.57 1.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.38 3dts h ALA 269 CO 0.11 -0.78 -0.09 0.97 0.00 0.00 0.00 179.25 179.46 3dts h ILE 270 N -0.20 0.73 -0.44 0.00 2.10 -1.49 -2.50 117.51 115.70 3dts h ILE 270 Ca 0.06 0.00 -0.06 0.00 1.08 0.00 0.00 64.86 65.94 3dts h ILE 270 Cb 0.37 0.73 -0.02 0.00 -1.09 0.00 0.00 36.82 36.82 3dts h ILE 270 CO -0.47 0.00 0.04 -0.50 -1.08 0.00 0.00 178.15 176.14 3dts h TRP 271 N -0.09 0.81 -0.64 2.19 4.06 -1.07 -1.88 115.95 119.34 3dts h TRP 271 Ca 0.09 -0.13 0.11 0.00 2.06 0.00 0.00 58.89 61.02 3dts h TRP 271 Cb 0.21 -0.22 -0.08 0.00 -1.00 0.00 0.00 29.16 28.07 3dts h TRP 271 CO -0.22 0.78 0.21 1.98 -3.56 0.00 0.00 178.44 177.63 3dts h MET 272 N 0.61 0.35 0.10 0.49 4.05 0.49 -1.56 114.93 119.46 3dts h MET 272 Ca 0.13 -0.02 -0.29 0.00 -0.28 0.00 0.00 59.70 59.24 3dts h MET 272 Cb 0.43 -0.08 0.02 0.00 -0.80 0.00 0.00 31.60 31.18 3dts h MET 272 CO 0.02 0.23 -1.20 0.00 0.23 0.00 0.00 176.91 176.19 3dts h ALA 273 N 1.47 0.05 -0.65 0.39 0.00 -1.34 -3.30 119.26 115.88 3dts h ALA 273 Ca 0.33 -0.77 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 3dts h ALA 273 Cb 0.47 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 3dts h ALA 273 CO -0.36 0.72 0.24 0.28 0.00 0.00 0.00 179.25 180.13 3dts h VAL 274 N 0.28 1.23 0.00 0.00 2.07 -1.22 -2.27 116.25 116.34 3dts h VAL 274 Ca -0.17 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 66.61 3dts h VAL 274 Cb 1.86 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 3dts h VAL 274 CO 0.23 0.29 0.00 0.18 0.02 0.00 0.00 177.57 178.29 3dts n LEU 275 N -4.30 0.00 -0.04 2.57 4.77 -0.60 -2.33 117.00 117.07 3dts n LEU 275 Ca 0.06 0.13 -0.10 0.00 -0.03 0.00 0.00 56.01 56.07 3dts n LEU 275 Cb 0.18 -0.13 -0.08 0.00 -2.33 0.00 0.00 43.42 41.06 3dts n LEU 275 CO 0.40 -0.10 0.30 0.58 -1.33 0.00 0.00 177.39 177.23 3dts h VAL 276 N 0.00 1.12 0.00 4.08 2.07 -1.56 -3.14 116.25 118.81 3dts h VAL 276 Ca 0.00 -1.71 -0.00 0.00 0.82 0.00 0.00 66.70 65.81 3dts h VAL 276 Cb 0.03 2.06 -0.00 0.00 -1.52 0.00 0.00 31.29 31.86 3dts h VAL 276 CO 0.00 0.36 -0.27 0.71 0.02 0.00 0.00 177.57 178.39 3dts h THR 277 N -0.95 0.03 -0.25 2.57 1.35 -1.67 -2.86 112.91 111.12 3dts h THR 277 Ca -0.00 -1.05 -0.09 0.00 -0.55 0.00 0.00 66.41 64.72 3dts h THR 277 Cb 0.62 1.89 -0.00 0.00 -1.73 0.00 0.00 68.15 68.93 3dts h THR 277 CO 0.01 0.02 -0.20 0.25 -0.25 0.00 0.00 175.52 175.35 3dts h LEU 278 N 0.00 0.61 0.04 3.87 5.85 -1.60 -2.25 115.31 121.84 3dts h LEU 278 Ca -0.00 -0.45 -0.08 0.00 0.84 0.00 0.00 57.88 58.18 3dts h LEU 278 Cb 1.02 -0.17 0.01 0.00 0.37 0.00 0.00 40.66 41.88 3dts h LEU 278 CO 0.00 0.94 -0.34 0.74 -0.34 0.00 0.00 178.44 179.43 3dts h THR 279 N 0.30 1.60 0.00 1.05 2.02 -1.65 -3.15 112.91 113.08 3dts h THR 279 Ca 0.05 -2.21 0.00 0.00 0.77 0.00 0.00 66.41 65.01 3dts h THR 279 Cb 0.74 3.04 0.00 0.00 -1.74 0.00 0.00 68.15 70.19 3dts h THR 279 CO 0.05 0.60 0.00 0.61 0.37 0.00 0.00 175.52 177.16 3dts n GLY 280 N 1.36 -0.68 0.08 2.16 0.00 -1.08 -0.94 105.19 106.09 3dts n GLY 280 Ca -0.11 -0.02 -0.07 0.00 0.00 0.00 0.00 46.02 45.82 3dts n GLY 280 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3dts h GLY 281 N 0.99 0.00 1.50 -0.02 0.00 -1.38 -3.05 103.07 101.10 3dts h GLY 281 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.06 3dts h GLY 281 CO 0.00 0.00 -1.35 -2.22 0.00 0.00 0.00 176.54 172.97 3dts h ILE 282 N 0.00 1.34 -0.40 2.60 2.04 -1.25 -2.54 117.51 119.31 3dts h ILE 282 Ca -0.23 -3.02 -0.07 0.00 1.00 0.00 0.00 64.86 62.54 3dts h ILE 282 Cb 1.92 2.77 -0.01 0.00 -0.74 0.00 0.00 36.82 40.75 3dts h ILE 282 CO 0.08 0.83 -0.04 1.23 0.00 0.00 0.00 178.15 180.25 3dts h GLY 283 N 2.35 0.79 2.00 5.37 0.00 -1.16 -2.08 103.07 110.34 3dts h GLY 283 Ca -0.16 -0.61 -0.06 0.00 0.00 0.00 0.00 47.33 46.50 3dts h GLY 283 CO 0.15 0.56 -0.31 -2.22 0.00 0.00 0.00 176.54 174.72 3dts h ILE 284 N 0.55 0.59 -0.02 2.60 1.08 -1.61 -3.00 117.51 117.71 3dts h ILE 284 Ca 0.11 -1.59 -0.11 0.00 -0.39 0.00 0.00 64.86 62.89 3dts h ILE 284 Cb 0.53 2.10 0.01 0.00 -3.07 0.00 0.00 36.82 36.39 3dts h ILE 284 CO 0.03 0.30 -0.41 0.25 -0.69 0.00 0.00 178.15 177.63 3dts h LEU 285 N 0.00 0.39 0.00 1.44 5.85 -1.32 -3.06 115.31 118.60 3dts h LEU 285 Ca -0.00 -0.74 0.00 0.00 0.84 0.00 0.00 57.88 57.97 3dts h LEU 285 Cb 1.07 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.99 3dts h LEU 285 CO 0.04 1.08 0.00 0.18 -0.34 0.00 0.00 178.44 179.40 3dts n LEU 286 N -4.37 0.00 -4.50 2.25 4.77 -0.79 -4.35 117.00 110.01 3dts n LEU 286 Ca -0.10 0.35 -0.43 0.00 -0.03 0.00 0.00 56.01 55.80 3dts n LEU 286 Cb 0.57 -0.35 -0.07 0.00 -2.33 0.00 0.00 43.42 41.25 3dts n LEU 286 CO 0.43 -0.10 0.39 -0.44 -1.33 0.00 0.00 177.39 176.33 3dts s SER 287 N -2.70 6.30 0.00 -1.43 0.01 -1.13 -1.94 113.70 112.81 3dts s SER 287 Ca 0.17 -0.46 0.00 0.00 1.31 0.00 0.00 55.95 56.97 3dts s SER 287 Cb 0.14 -2.32 0.00 0.00 0.21 0.00 0.00 66.02 64.05 3dts s SER 287 CO 0.34 -0.83 0.00 0.61 0.41 0.00 0.00 173.24 173.77 3dts n GLY 288 N 5.07 1.24 0.20 3.44 0.00 0.86 -4.87 105.19 111.13 3dts n GLY 288 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.85 3dts n GLY 288 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3dts n THR 289 N -1.96 0.98 -0.03 2.61 -2.24 -1.25 -4.80 114.28 107.58 3dts n THR 289 Ca 0.00 -0.33 -0.02 0.00 -2.27 0.00 0.00 64.05 61.43 3dts n THR 289 Cb 0.00 -1.31 -0.06 0.00 -2.10 0.00 0.00 70.33 66.87 3dts n THR 289 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3dts n VAL 290 N -3.26 0.37 -4.59 2.28 0.31 -1.14 -4.98 118.33 107.32 3dts n VAL 290 Ca -0.32 -0.27 -0.27 0.00 -0.01 0.00 0.00 64.34 63.47 3dts n VAL 290 Cb 0.80 -0.54 -0.17 0.00 -0.91 0.00 0.00 33.84 33.02 3dts n VAL 290 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3dts s VAL 291 N -2.26 1.41 -0.11 2.52 1.01 -0.82 -5.02 120.40 117.14 3dts s VAL 291 Ca -0.03 -0.61 0.12 0.00 0.00 0.00 0.00 61.98 61.45 3dts s VAL 291 Cb 0.03 -1.28 -0.24 0.00 0.00 0.00 0.00 36.38 34.89 3dts s VAL 291 CO 0.30 0.42 0.41 -0.67 0.00 0.00 0.00 175.10 175.55 3dts n ASP 292 N 3.99 0.79 -3.72 3.32 -0.08 -1.26 -0.10 116.55 119.49 3dts n ASP 292 Ca -0.20 0.24 -0.15 0.00 -1.51 0.00 0.00 54.79 53.17 3dts n ASP 292 Cb 0.52 0.16 -0.15 0.00 2.34 0.00 0.00 41.12 43.99 3dts n ASP 292 CO 0.00 0.00 0.00 0.21 0.12 0.00 0.00 177.20 177.53 3dts s ASN 293 N -6.02 0.19 0.24 1.67 3.84 -1.26 -4.38 114.94 109.22 3dts s ASN 293 Ca -0.10 0.28 0.13 0.00 0.21 0.00 0.00 52.86 53.38 3dts s ASN 293 Cb 0.07 0.18 0.09 0.00 -0.55 0.00 0.00 41.25 41.04 3dts s ASN 293 CO 0.81 -0.18 1.44 -0.50 -2.79 0.00 0.00 177.10 175.88 3dts h TRP 294 N 7.61 0.00 -0.25 0.43 4.06 -0.98 -2.16 115.95 124.66 3dts h TRP 294 Ca -0.34 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.60 3dts h TRP 294 Cb 1.13 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.28 3dts h TRP 294 CO 0.44 0.66 0.11 -0.92 -3.56 0.00 0.00 178.44 175.17 3dts h TYR 295 N 0.00 0.37 0.78 0.49 3.20 -1.79 -0.24 116.97 119.78 3dts h TYR 295 Ca -0.01 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.81 3dts h TYR 295 Cb 1.42 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 39.58 3dts h TYR 295 CO 0.00 0.36 -0.45 0.28 -1.64 0.00 0.00 178.16 176.71 3dts h VAL 296 N 0.26 0.09 -1.04 1.81 2.07 -1.92 -1.65 116.25 115.88 3dts h VAL 296 Ca 0.08 0.00 0.30 0.00 0.82 0.00 0.00 66.70 67.91 3dts h VAL 296 Cb 0.14 0.09 -0.13 0.00 -1.52 0.00 0.00 31.29 29.87 3dts h VAL 296 CO -0.01 0.00 0.62 -0.25 0.02 0.00 0.00 177.57 177.95 3dts h TRP 297 N -1.15 0.87 -0.23 1.57 7.01 -1.35 -0.03 115.95 122.63 3dts h TRP 297 Ca -0.10 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 60.91 3dts h TRP 297 Cb 0.91 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 27.72 3dts h TRP 297 CO -0.08 -0.07 0.05 0.78 -2.79 0.00 0.00 178.44 176.33 3dts h GLY 298 N 0.39 0.34 2.00 2.65 0.00 -0.08 0.77 103.07 109.14 3dts h GLY 298 Ca 0.69 -0.16 -0.12 0.00 0.00 0.00 0.00 47.33 47.74 3dts h GLY 298 CO -0.50 0.15 -0.57 1.46 0.00 0.00 0.00 176.54 177.09 3dts h GLN 299 N 0.32 0.00 0.00 4.80 1.08 -0.58 -3.40 115.11 117.33 3dts h GLN 299 Ca 0.08 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 3dts h GLN 299 Cb 0.14 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.57 3dts h GLN 299 CO -0.00 0.57 -0.15 0.09 -0.95 0.00 0.00 178.83 178.39 3dts n ASN 300 N -3.34 0.36 -0.84 1.46 5.03 -0.82 -5.01 115.26 112.10 3dts n ASN 300 Ca 0.01 0.06 0.00 0.00 0.87 0.00 0.00 54.58 55.52 3dts n ASN 300 Cb 0.72 -0.41 0.00 0.00 -1.02 0.00 0.00 39.78 39.07 3dts n ASN 300 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 3dts n HIS 301 N -2.86 0.00 0.00 3.10 8.25 0.26 -5.10 115.22 118.87 3dts n HIS 301 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 3dts n HIS 301 Cb 0.08 -1.65 0.00 0.00 1.12 0.00 0.00 29.99 29.53 3dts n HIS 301 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39