#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bns n GLU 2 N 0.00 -1.52 -4.85 0.00 1.02 -1.26 -5.10 120.64 108.93 2bns n GLU 2 Ca 0.00 -0.45 -0.29 0.00 -0.02 0.00 0.00 57.16 56.40 2bns n GLU 2 Cb 0.00 -1.33 -0.15 0.00 -0.02 0.00 0.00 31.44 29.94 2bns n GLU 2 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 2bns s TYR 3 N -2.06 2.17 -1.50 -0.32 5.04 -1.26 -5.09 117.35 114.34 2bns s TYR 3 Ca 0.29 -0.40 0.18 0.00 -2.44 0.00 0.00 57.07 54.69 2bns s TYR 3 Cb -0.04 -1.30 -0.04 0.00 0.35 0.00 0.00 41.96 40.93 2bns s TYR 3 CO 0.30 0.11 0.89 1.04 -1.34 0.00 0.00 175.55 176.55 2bns n GLN 4 N 1.83 1.51 -2.66 4.97 1.13 -1.26 -4.99 117.38 117.91 2bns n GLN 4 Ca -0.17 -0.71 -0.18 0.00 -1.94 0.00 0.00 57.00 54.00 2bns n GLN 4 Cb 0.52 -1.33 0.01 0.00 0.11 0.00 0.00 30.24 29.56 2bns n GLN 4 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 2bns n ASN 5 N -0.33 -5.29 -0.05 1.08 5.15 -1.26 -4.89 115.26 109.66 2bns n ASN 5 Ca 0.07 -0.15 -0.22 0.00 -0.60 0.00 0.00 54.58 53.68 2bns n ASN 5 Cb 0.36 -4.23 -0.13 0.00 -0.53 0.00 0.00 39.78 35.25 2bns n ASN 5 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 2bns n ILE 6 N -4.19 1.65 -4.71 -1.44 2.08 -1.26 -4.91 119.36 106.58 2bns n ILE 6 Ca -0.14 -0.34 -0.30 0.00 0.56 0.00 0.00 62.75 62.53 2bns n ILE 6 Cb 0.63 -1.88 -0.14 0.00 -0.75 0.00 0.00 39.64 37.49 2bns n ILE 6 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 2bns s PHE 7 N -2.46 2.32 0.39 1.39 0.08 -1.26 -4.79 117.98 113.65 2bns s PHE 7 Ca -0.26 -0.40 -0.24 0.00 0.12 0.00 0.00 56.93 56.15 2bns s PHE 7 Cb 0.07 -1.34 -0.09 0.00 -0.57 0.00 0.00 43.02 41.08 2bns s PHE 7 CO 0.67 0.21 1.02 -1.12 -0.10 0.00 0.00 175.22 175.90 2bns s SER 8 N -1.55 6.87 -0.14 1.36 0.01 0.05 -4.94 113.70 115.35 2bns s SER 8 Ca 0.13 1.96 -0.26 0.00 1.31 0.00 0.00 55.95 59.09 2bns s SER 8 Cb -0.10 -2.58 -0.26 0.00 0.21 0.00 0.00 66.02 63.30 2bns s SER 8 CO 0.04 -0.41 0.69 1.56 0.41 0.00 0.00 173.24 175.52 2bns h GLN 9 N 2.53 0.05 -4.28 12.44 4.20 -1.97 -3.45 115.11 124.63 2bns h GLN 9 Ca -0.48 -0.08 -0.55 0.00 0.06 0.00 0.00 58.65 57.60 2bns h GLN 9 Cb 1.21 0.03 -0.37 0.00 0.30 0.00 0.00 27.48 28.65 2bns h GLN 9 CO 0.63 1.04 -0.80 0.54 -0.67 0.00 0.00 178.83 179.56 2bns s VAL 10 N -2.28 1.15 0.44 -0.54 0.11 -1.26 -5.13 120.40 112.89 2bns s VAL 10 Ca -0.20 -0.47 -0.21 0.00 -2.93 0.00 0.00 61.98 58.17 2bns s VAL 10 Cb -0.01 -1.20 -0.10 0.00 -1.53 0.00 0.00 36.38 33.54 2bns s VAL 10 CO 0.69 0.30 0.97 -1.10 -3.33 0.00 0.00 175.10 172.64 2bns s GLN 11 N 1.64 4.15 -0.02 1.54 -0.21 -1.26 -5.07 119.66 120.43 2bns s GLN 11 Ca 0.03 1.19 0.01 0.00 0.02 0.00 0.00 55.36 56.62 2bns s GLN 11 Cb -0.14 -2.20 0.01 0.00 1.00 0.00 0.00 33.01 31.68 2bns s GLN 11 CO -0.08 -0.10 -0.05 0.08 -2.12 0.00 0.00 175.29 173.01 2bns s VAL 12 N -2.09 0.48 -0.02 1.09 1.01 -1.26 -5.15 120.40 114.46 2bns s VAL 12 Ca 0.62 -0.18 0.01 0.00 0.00 0.00 0.00 61.98 62.44 2bns s VAL 12 Cb -0.11 -0.46 0.01 0.00 0.00 0.00 0.00 36.38 35.81 2bns s VAL 12 CO 0.15 0.18 -0.04 -0.60 0.00 0.00 0.00 175.10 174.79 2bns s ARG 13 N 0.39 0.46 0.00 2.72 3.52 -1.26 -5.01 118.95 119.77 2bns s ARG 13 Ca -0.05 -0.10 0.00 0.00 -0.13 0.00 0.00 55.73 55.45 2bns s ARG 13 Cb -0.09 -0.50 0.00 0.00 -1.56 0.00 0.00 34.95 32.81 2bns s ARG 13 CO -0.00 0.01 0.00 0.41 -0.81 0.00 0.00 175.30 174.91 2bns n GLY 14 N 3.46 3.90 3.64 8.12 0.00 -1.26 -5.11 105.19 117.94 2bns n GLY 14 Ca -0.19 -1.56 -0.46 0.00 0.00 0.00 0.00 46.02 43.81 2bns n GLY 14 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2bns n PRO 15 N 0.00 1.79 -1.67 1.61 -0.02 -1.26 -4.88 135.00 130.58 2bns n PRO 15 Ca 0.00 0.64 -0.45 0.00 -2.02 0.00 0.00 63.50 61.67 2bns n PRO 15 Cb 0.00 -2.27 -0.02 0.00 -0.02 0.00 0.00 33.50 31.18 2bns n PRO 15 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bns n ALA 16 N 2.08 0.96 -2.55 3.55 0.00 -1.26 -4.95 120.51 118.34 2bns n ALA 16 Ca 0.14 0.40 -0.43 0.00 0.00 0.00 0.00 53.44 53.55 2bns n ALA 16 Cb 0.29 -2.24 -0.02 0.00 0.00 0.00 0.00 19.45 17.47 2bns n ALA 16 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2bns s ASP 17 N 0.11 6.97 0.05 0.00 -1.08 -1.26 -4.91 116.67 116.55 2bns s ASP 17 Ca 0.65 1.41 0.27 0.00 -0.52 0.00 0.00 52.55 54.36 2bns s ASP 17 Cb -0.65 -2.54 0.94 0.00 -1.46 0.00 0.00 42.92 39.21 2bns s ASP 17 CO 0.53 -0.79 1.75 0.18 0.52 0.00 0.00 175.17 177.36 2bns n LEU 18 N 6.67 0.32 0.00 -1.34 4.77 -1.26 -4.73 117.00 121.42 2bns n LEU 18 Ca 0.13 0.40 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 2bns n LEU 18 Cb 0.46 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2bns n LEU 18 CO 0.56 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 2bns n GLY 19 N 1.45 0.54 3.78 -0.72 0.00 -1.26 -4.89 105.19 104.08 2bns n GLY 19 Ca 0.06 -1.91 -0.37 0.00 0.00 0.00 0.00 46.02 43.80 2bns n GLY 19 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2bns s MET 20 N -1.81 4.31 -0.14 1.61 -1.94 -1.26 -5.01 119.30 115.06 2bns s MET 20 Ca 0.00 1.44 -0.12 0.00 -1.71 0.00 0.00 55.69 55.30 2bns s MET 20 Cb 0.00 -2.62 -0.04 0.00 2.01 0.00 0.00 34.83 34.18 2bns s MET 20 CO 0.00 0.01 -0.23 2.41 -0.01 0.00 0.00 175.02 177.19 2bns n THR 21 N 0.13 1.29 0.00 2.05 -1.04 -1.26 -4.88 114.28 110.56 2bns n THR 21 Ca 0.04 0.22 0.00 0.00 -2.04 0.00 0.00 64.05 62.27 2bns n THR 21 Cb 0.50 -2.27 0.00 0.00 -1.82 0.00 0.00 70.33 66.74 2bns n THR 21 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 2bns n GLU 22 N -4.28 0.00 -0.47 -2.82 4.07 -1.26 -0.40 120.64 115.48 2bns n GLU 22 Ca -0.09 0.00 0.08 0.00 -0.06 0.00 0.00 57.16 57.09 2bns n GLU 22 Cb 0.35 0.00 0.29 0.00 -0.06 0.00 0.00 31.44 32.02 2bns n GLU 22 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 2bns n ASP 23 N 4.05 4.13 -4.72 4.31 8.00 -0.47 -4.97 116.55 126.89 2bns n ASP 23 Ca 0.00 -2.44 -0.42 0.00 0.71 0.00 0.00 54.79 52.64 2bns n ASP 23 Cb 0.00 -0.49 -0.03 0.00 -0.02 0.00 0.00 41.12 40.58 2bns n ASP 23 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2bns s VAL 24 N -1.81 2.28 -0.69 2.53 1.01 0.47 -4.88 120.40 119.30 2bns s VAL 24 Ca 0.43 0.20 -0.27 0.00 0.00 0.00 0.00 61.98 62.33 2bns s VAL 24 Cb 0.28 -3.13 0.01 0.00 0.00 0.00 0.00 36.38 33.54 2bns s VAL 24 CO 0.20 0.01 1.52 0.21 0.00 0.00 0.00 175.10 177.05 2bns s ASN 25 N 1.19 5.79 0.51 3.32 2.47 -1.26 -4.91 114.94 122.05 2bns s ASN 25 Ca 0.73 -0.15 0.35 0.00 0.42 0.00 0.00 52.86 54.21 2bns s ASN 25 Cb -0.47 -2.55 1.81 0.00 -1.45 0.00 0.00 41.25 38.59 2bns s ASN 25 CO 0.32 -2.06 2.05 -0.07 -3.72 0.00 0.00 177.10 173.62 2bns h LEU 26 N 14.45 0.00 -2.09 3.21 4.07 -1.94 -2.58 115.31 130.43 2bns h LEU 26 Ca -0.26 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.69 2bns h LEU 26 Cb 1.09 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.83 2bns h LEU 26 CO 1.26 0.00 -0.05 0.00 -1.08 0.00 0.00 178.44 178.57 2bns h ALA 27 N 2.02 1.69 -0.66 1.53 0.00 -2.01 -2.26 119.26 119.58 2bns h ALA 27 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2bns h ALA 27 Cb 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2bns h ALA 27 CO 0.00 0.06 0.00 0.09 0.00 0.00 0.00 179.25 179.40 2bns n ASN 28 N -4.15 3.55 -4.72 0.00 3.02 -0.97 -4.88 115.26 107.11 2bns n ASN 28 Ca -0.03 -2.00 -0.35 0.00 -0.03 0.00 0.00 54.58 52.17 2bns n ASN 28 Cb 0.13 -0.44 -0.09 0.00 -0.61 0.00 0.00 39.78 38.78 2bns n ASN 28 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2bns s ARG 29 N -1.13 3.58 0.89 3.52 3.52 -0.85 -1.18 118.95 127.31 2bns s ARG 29 Ca 0.44 -0.30 -0.13 0.00 -0.13 0.00 0.00 55.73 55.62 2bns s ARG 29 Cb 0.23 -3.10 0.17 0.00 -1.56 0.00 0.00 34.95 30.68 2bns s ARG 29 CO 0.30 0.52 1.24 -1.54 -0.81 0.00 0.00 175.30 175.01 2bns s SER 30 N -0.34 3.55 0.83 -2.12 1.04 -0.40 -4.99 113.70 111.27 2bns s SER 30 Ca 0.09 0.22 -0.11 0.00 0.48 0.00 0.00 55.95 56.63 2bns s SER 30 Cb -0.12 -0.40 0.09 0.00 0.10 0.00 0.00 66.02 65.70 2bns s SER 30 CO 0.02 -2.45 1.09 -0.83 0.98 0.00 0.00 173.24 172.05 2bns s GLY 31 N -4.82 1.65 0.28 7.32 0.00 -1.26 -4.67 107.32 105.82 2bns s GLY 31 Ca 0.71 0.09 -0.29 0.00 0.00 0.00 0.00 44.72 45.23 2bns s GLY 31 CO 0.51 0.51 1.04 0.14 0.00 0.00 0.00 173.10 175.30 2bns s VAL 32 N -2.93 3.71 0.39 1.40 1.01 -1.26 -4.43 120.40 118.29 2bns s VAL 32 Ca 0.62 1.67 -0.06 0.00 0.00 0.00 0.00 61.98 64.21 2bns s VAL 32 Cb -0.17 -4.04 0.09 0.00 0.00 0.00 0.00 36.38 32.25 2bns s VAL 32 CO 0.56 0.36 0.53 0.61 0.00 0.00 0.00 175.10 177.16 2bns n GLY 33 N 1.17 -1.09 3.88 4.51 0.00 -0.20 -4.97 105.19 108.50 2bns n GLY 33 Ca -0.01 -1.72 -0.30 0.00 0.00 0.00 0.00 46.02 43.99 2bns n GLY 33 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bns s PRO 34 N -4.12 3.25 -0.03 1.61 0.04 -1.26 -4.59 135.00 129.90 2bns s PRO 34 Ca 0.30 0.60 -0.18 0.00 0.04 0.00 0.00 61.00 61.76 2bns s PRO 34 Cb -0.01 -2.06 -0.05 0.00 0.04 0.00 0.00 34.50 32.42 2bns s PRO 34 CO 0.21 -0.78 0.51 -0.06 0.04 0.00 0.00 177.00 176.93 2bns s PHE 35 N -3.25 3.65 -0.39 0.56 0.40 -1.26 -2.69 117.98 115.00 2bns s PHE 35 Ca 0.56 1.06 -0.08 0.00 -0.60 0.00 0.00 56.93 57.87 2bns s PHE 35 Cb -0.11 -2.51 0.06 0.00 0.51 0.00 0.00 43.02 40.97 2bns s PHE 35 CO 0.53 0.38 0.20 0.45 0.70 0.00 0.00 175.22 177.47 2bns s SER 36 N -0.20 5.51 0.28 1.36 0.15 -0.23 -4.96 113.70 115.61 2bns s SER 36 Ca 0.28 -1.37 -0.03 0.00 0.70 0.00 0.00 55.95 55.53 2bns s SER 36 Cb -0.17 -1.94 0.41 0.00 -1.71 0.00 0.00 66.02 62.61 2bns s SER 36 CO 0.14 -0.45 1.94 0.74 1.20 0.00 0.00 173.24 176.81 2bns h THR 37 N 6.11 1.18 -0.32 6.45 2.02 -1.97 -0.96 112.91 125.43 2bns h THR 37 Ca -0.22 -0.40 0.06 0.00 0.77 0.00 0.00 66.41 66.61 2bns h THR 37 Cb 1.08 -0.10 -0.05 0.00 -1.74 0.00 0.00 68.15 67.33 2bns h THR 37 CO 0.69 0.22 -0.03 0.25 0.37 0.00 0.00 175.52 177.01 2bns h LEU 38 N 1.18 -0.20 -0.92 2.58 5.85 -1.98 -2.19 115.31 119.63 2bns h LEU 38 Ca 0.36 0.08 -0.10 0.00 0.84 0.00 0.00 57.88 59.06 2bns h LEU 38 Cb -0.03 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2bns h LEU 38 CO -0.10 -0.06 -0.27 -0.07 -0.34 0.00 0.00 178.44 177.60 2bns h LEU 39 N 0.05 0.48 -0.91 2.25 3.38 -1.77 -3.17 115.31 115.62 2bns h LEU 39 Ca 0.15 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2bns h LEU 39 Cb 0.22 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2bns h LEU 39 CO -0.29 0.74 0.00 0.61 0.09 0.00 0.00 178.44 179.59 2bns n GLY 40 N -0.34 -0.98 0.15 0.83 0.00 -0.41 -0.75 105.19 103.69 2bns n GLY 40 Ca -0.01 0.12 0.02 0.00 0.00 0.00 0.00 46.02 46.15 2bns n GLY 40 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2bns h TRP 41 N 0.00 0.00 0.00 1.61 4.06 -1.49 -3.39 115.95 116.74 2bns h TRP 41 Ca 0.00 0.00 -0.19 0.00 2.06 0.00 0.00 58.89 60.76 2bns h TRP 41 Cb 0.15 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.27 2bns h TRP 41 CO 0.00 0.54 -1.71 0.34 -3.56 0.00 0.00 178.44 174.04 2bns n PHE 42 N -3.58 0.00 -2.16 0.49 7.35 -0.65 -0.77 117.46 118.14 2bns n PHE 42 Ca -0.00 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2bns n PHE 42 Cb 0.61 -0.49 0.00 0.00 0.35 0.00 0.00 39.48 39.95 2bns n PHE 42 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2bns n GLY 43 N 2.73 5.03 3.77 7.13 0.00 0.07 -4.94 105.19 118.98 2bns n GLY 43 Ca -0.21 -1.13 -0.39 0.00 0.00 0.00 0.00 46.02 44.29 2bns n GLY 43 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bns s ASN 44 N 1.16 6.76 0.44 1.61 0.01 -1.26 -3.85 114.94 119.80 2bns s ASN 44 Ca 0.00 2.42 0.24 0.00 -0.71 0.00 0.00 52.86 54.81 2bns s ASN 44 Cb 0.00 -2.63 0.49 0.00 0.41 0.00 0.00 41.25 39.52 2bns s ASN 44 CO 0.00 -0.52 1.66 0.00 -1.51 0.00 0.00 177.10 176.73 2bns h ALA 45 N 3.10 0.96 -2.69 0.60 0.00 -1.83 -3.38 119.26 116.02 2bns h ALA 45 Ca -0.48 -0.07 -0.52 0.00 0.00 0.00 0.00 54.91 53.84 2bns h ALA 45 Cb 1.23 -0.01 0.03 0.00 0.00 0.00 0.00 17.79 19.03 2bns h ALA 45 CO 0.64 0.09 0.61 -1.14 0.00 0.00 0.00 179.25 179.46 2bns s GLN 46 N -3.27 4.43 -0.09 0.00 0.74 -1.26 -1.07 119.66 119.15 2bns s GLN 46 Ca 0.05 1.99 -0.01 0.00 0.05 0.00 0.00 55.36 57.45 2bns s GLN 46 Cb 0.06 -3.20 -0.03 0.00 1.10 0.00 0.00 33.01 30.94 2bns s GLN 46 CO 0.66 -0.17 -0.04 -0.51 -0.55 0.00 0.00 175.29 174.68 2bns s LEU 47 N -0.34 3.32 0.00 3.68 1.02 -1.09 -4.93 118.68 120.34 2bns s LEU 47 Ca 0.54 0.02 0.00 0.00 0.02 0.00 0.00 54.13 54.71 2bns s LEU 47 Cb -0.35 -1.75 0.00 0.00 0.02 0.00 0.00 46.19 44.11 2bns s LEU 47 CO 0.39 0.34 0.00 0.61 0.02 0.00 0.00 176.35 177.71 2bns n GLY 48 N 2.39 -2.01 3.75 -3.19 0.00 -1.26 -1.03 105.19 103.84 2bns n GLY 48 Ca -0.18 -1.36 -0.29 0.00 0.00 0.00 0.00 46.02 44.19 2bns n GLY 48 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2bns s PRO 49 N -1.15 0.70 0.10 1.61 0.02 -1.26 -4.68 135.00 130.35 2bns s PRO 49 Ca 0.00 0.27 0.07 0.00 0.02 0.00 0.00 61.00 61.36 2bns s PRO 49 Cb 0.00 -1.79 -0.03 0.00 0.02 0.00 0.00 34.50 32.70 2bns s PRO 49 CO 0.00 -2.49 -0.19 -1.50 -0.33 0.00 0.00 177.00 172.49 2bns s ILE 50 N -3.21 1.58 -0.16 2.83 2.07 -1.26 -4.94 121.20 118.10 2bns s ILE 50 Ca 0.65 -1.54 -0.06 0.00 -1.41 0.00 0.00 60.65 58.30 2bns s ILE 50 Cb -0.15 -1.48 -0.04 0.00 0.13 0.00 0.00 42.46 40.93 2bns s ILE 50 CO 0.55 -0.14 0.03 -0.47 -1.91 0.00 0.00 174.94 172.99 2bns s TYR 51 N -1.32 3.18 -0.16 3.50 6.14 -1.26 -1.28 117.35 126.15 2bns s TYR 51 Ca 0.06 -0.03 -0.01 0.00 0.64 0.00 0.00 57.07 57.73 2bns s TYR 51 Cb -0.09 -2.01 0.04 0.00 0.42 0.00 0.00 41.96 40.31 2bns s TYR 51 CO 0.04 0.13 -0.05 -0.51 0.64 0.00 0.00 175.55 175.80 2bns s LEU 52 N 0.24 1.51 0.00 6.97 1.43 -0.33 -5.01 118.68 123.49 2bns s LEU 52 Ca 0.02 -0.61 0.00 0.00 -1.03 0.00 0.00 54.13 52.51 2bns s LEU 52 Cb -0.13 -0.87 0.00 0.00 0.03 0.00 0.00 46.19 45.22 2bns s LEU 52 CO 0.01 -0.18 0.00 0.61 0.23 0.00 0.00 176.35 177.02 2bns n GLY 53 N 4.90 3.81 0.22 -3.19 0.00 -1.26 -4.73 105.19 104.93 2bns n GLY 53 Ca -0.12 -2.09 -0.00 0.00 0.00 0.00 0.00 46.02 43.81 2bns n GLY 53 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2bns h SER 54 N 0.00 -0.12 0.73 1.61 0.02 -2.00 -2.48 113.55 111.32 2bns h SER 54 Ca 0.00 0.12 -0.20 0.00 -0.84 0.00 0.00 61.79 60.87 2bns h SER 54 Cb 0.00 0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 2bns h SER 54 CO 0.00 -0.04 -0.91 0.25 -1.14 0.00 0.00 176.83 175.00 2bns h LEU 55 N 0.18 0.14 -0.24 5.07 5.85 -1.95 -2.46 115.31 121.91 2bns h LEU 55 Ca 0.29 -0.12 -0.13 0.00 0.84 0.00 0.00 57.88 58.76 2bns h LEU 55 Cb 0.44 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.42 2bns h LEU 55 CO -0.42 0.97 -0.34 1.23 -0.34 0.00 0.00 178.44 179.53 2bns h GLY 56 N 2.21 0.71 0.98 3.75 0.00 -1.81 -0.26 103.07 108.66 2bns h GLY 56 Ca -0.03 -0.79 -0.01 0.00 0.00 0.00 0.00 47.33 46.50 2bns h GLY 56 CO 0.13 0.71 0.28 -2.08 0.00 0.00 0.00 176.54 175.58 2bns h VAL 57 N 0.36 1.17 -0.68 4.60 2.07 -1.51 0.74 116.25 123.00 2bns h VAL 57 Ca 0.02 -0.43 0.05 0.00 0.82 0.00 0.00 66.70 67.16 2bns h VAL 57 Cb 0.93 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 31.18 2bns h VAL 57 CO 0.08 0.18 0.40 0.25 0.02 0.00 0.00 177.57 178.51 2bns h LEU 58 N 0.68 0.63 -0.29 2.57 5.85 -1.39 0.11 115.31 123.47 2bns h LEU 58 Ca 0.18 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.87 2bns h LEU 58 Cb 0.04 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 2bns h LEU 58 CO -0.03 0.42 0.02 -1.28 -0.34 0.00 0.00 178.44 177.23 2bns h SER 59 N 0.77 0.50 -0.45 1.25 0.87 -0.58 -0.80 113.55 115.10 2bns h SER 59 Ca 0.29 -0.29 -0.06 0.00 -1.23 0.00 0.00 61.79 60.50 2bns h SER 59 Cb 0.11 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 61.91 2bns h SER 59 CO -0.15 0.67 0.09 -0.07 -0.53 0.00 0.00 176.83 176.84 2bns h LEU 60 N 0.31 0.76 -0.10 2.23 3.38 -0.70 -0.74 115.31 120.44 2bns h LEU 60 Ca 0.09 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 2bns h LEU 60 Cb 0.40 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 2bns h LEU 60 CO 0.01 0.77 -0.06 0.15 0.09 0.00 0.00 178.44 179.40 2bns h PHE 61 N 0.77 0.26 -0.24 1.13 3.57 -0.35 -0.67 116.94 121.41 2bns h PHE 61 Ca 0.16 -0.07 -0.07 0.00 3.53 0.00 0.00 57.97 61.53 2bns h PHE 61 Cb 0.34 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.00 2bns h PHE 61 CO 0.02 0.59 -0.15 0.77 -2.23 0.00 0.00 178.31 177.31 2bns h SER 62 N -0.15 0.40 0.07 0.41 0.02 -1.07 -1.57 113.55 111.66 2bns h SER 62 Ca 0.02 -0.10 -0.16 0.00 -0.84 0.00 0.00 61.79 60.71 2bns h SER 62 Cb 0.52 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 2bns h SER 62 CO 0.02 0.57 -0.54 1.23 -1.14 0.00 0.00 176.83 176.97 2bns h GLY 63 N 0.90 0.55 1.70 -3.77 0.00 -1.01 -0.85 103.07 100.59 2bns h GLY 63 Ca 0.07 -0.64 -0.14 0.00 0.00 0.00 0.00 47.33 46.62 2bns h GLY 63 CO 0.03 0.57 -0.53 1.41 0.00 0.00 0.00 176.54 178.02 2bns h LEU 64 N 0.39 0.36 -0.80 3.11 3.38 -0.91 -2.27 115.31 118.57 2bns h LEU 64 Ca 0.01 -0.18 -0.12 0.00 0.09 0.00 0.00 57.88 57.67 2bns h LEU 64 Cb 1.07 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 2bns h LEU 64 CO 0.10 0.82 -0.58 0.24 0.09 0.00 0.00 178.44 179.11 2bns h MET 65 N 0.25 0.00 -0.03 1.13 2.86 -1.11 0.72 114.93 118.76 2bns h MET 65 Ca 0.01 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 2bns h MET 65 Cb 1.02 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.68 2bns h MET 65 CO 0.09 0.58 -0.00 2.35 1.06 0.00 0.00 176.91 180.99 2bns h TRP 66 N 0.00 0.06 -0.41 -0.22 7.01 -1.05 -1.50 115.95 119.83 2bns h TRP 66 Ca -0.01 -0.01 -0.09 0.00 2.11 0.00 0.00 58.89 60.90 2bns h TRP 66 Cb 1.06 -0.01 -0.02 0.00 -2.10 0.00 0.00 29.16 28.09 2bns h TRP 66 CO 0.00 0.38 -0.10 0.35 -2.79 0.00 0.00 178.44 176.28 2bns h PHE 67 N -0.28 0.78 -0.14 2.65 3.57 -1.27 -2.17 116.94 120.08 2bns h PHE 67 Ca 0.01 -0.13 -0.17 0.00 3.53 0.00 0.00 57.97 61.21 2bns h PHE 67 Cb 0.36 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 2bns h PHE 67 CO 0.04 0.79 -0.61 0.35 -2.23 0.00 0.00 178.31 176.65 2bns h PHE 68 N 0.66 0.61 -0.21 0.41 3.57 -0.87 -0.40 116.94 120.71 2bns h PHE 68 Ca 0.12 -0.23 -0.06 0.00 3.53 0.00 0.00 57.97 61.33 2bns h PHE 68 Cb 0.55 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 2bns h PHE 68 CO 0.03 0.96 -0.09 1.15 -2.23 0.00 0.00 178.31 178.13 2bns h THR 69 N 0.35 1.30 -0.43 4.41 2.02 -1.04 0.80 112.91 120.33 2bns h THR 69 Ca -0.01 -1.14 -0.01 0.00 0.77 0.00 0.00 66.41 66.02 2bns h THR 69 Cb 1.16 1.62 -0.02 0.00 -1.74 0.00 0.00 68.15 69.16 2bns h THR 69 CO 0.11 0.34 0.21 0.40 0.37 0.00 0.00 175.52 176.96 2bns h ILE 70 N 0.13 1.17 -0.18 3.11 2.04 -1.41 -2.46 117.51 119.91 2bns h ILE 70 Ca 0.05 -0.48 0.01 0.00 1.00 0.00 0.00 64.86 65.44 2bns h ILE 70 Cb 0.57 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.34 2bns h ILE 70 CO 0.03 0.19 0.07 1.23 0.00 0.00 0.00 178.15 179.67 2bns h GLY 71 N 0.55 0.23 1.53 5.37 0.00 -0.95 0.78 103.07 110.58 2bns h GLY 71 Ca 0.15 -0.05 -0.08 0.00 0.00 0.00 0.00 47.33 47.35 2bns h GLY 71 CO -0.02 0.04 -0.12 1.19 0.00 0.00 0.00 176.54 177.63 2bns h ILE 72 N 0.17 1.24 -0.28 2.60 2.10 -0.85 -1.29 117.51 121.19 2bns h ILE 72 Ca 0.08 -1.06 -0.10 0.00 1.08 0.00 0.00 64.86 64.86 2bns h ILE 72 Cb 0.04 1.12 -0.01 0.00 -1.09 0.00 0.00 36.82 36.87 2bns h ILE 72 CO -0.07 0.35 -0.26 -0.25 -1.08 0.00 0.00 178.15 176.84 2bns h TRP 73 N 0.52 0.62 -0.31 2.19 2.91 -1.08 -2.29 115.95 118.51 2bns h TRP 73 Ca 0.09 -0.14 -0.16 0.00 1.13 0.00 0.00 58.89 59.81 2bns h TRP 73 Cb 0.52 -0.15 -0.00 0.00 -0.51 0.00 0.00 29.16 29.01 2bns h TRP 73 CO 0.02 0.76 -0.44 0.74 -1.03 0.00 0.00 178.44 178.49 2bns h PHE 74 N 0.48 1.05 -0.79 2.65 -1.00 -0.16 -1.94 116.94 117.22 2bns h PHE 74 Ca 0.07 -0.35 -0.03 0.00 2.81 0.00 0.00 57.97 60.47 2bns h PHE 74 Cb 0.71 -0.21 -0.04 0.00 3.61 0.00 0.00 35.95 40.02 2bns h PHE 74 CO 0.03 1.16 0.37 -1.49 -1.61 0.00 0.00 178.31 176.77 2bns h TRP 75 N 0.63 1.13 -0.73 -0.55 4.06 -1.22 -1.80 115.95 117.47 2bns h TRP 75 Ca 0.03 -0.05 -0.05 0.00 2.06 0.00 0.00 58.89 60.88 2bns h TRP 75 Cb 1.04 -0.35 -0.03 0.00 -1.00 0.00 0.00 29.16 28.82 2bns h TRP 75 CO 0.07 0.82 0.24 -0.92 -3.56 0.00 0.00 178.44 175.10 2bns h TYR 76 N 1.12 1.16 0.00 0.49 3.20 -1.20 -1.09 116.97 120.64 2bns h TYR 76 Ca 0.27 -0.11 -0.04 0.00 3.14 0.00 0.00 58.73 62.00 2bns h TYR 76 Cb 0.12 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.05 2bns h TYR 76 CO 0.01 0.91 -0.17 1.96 -1.64 0.00 0.00 178.16 179.23 2bns h GLN 77 N 1.08 0.00 -0.01 1.82 4.20 -1.00 -2.75 115.11 118.46 2bns h GLN 77 Ca 0.24 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.95 2bns h GLN 77 Cb 0.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.06 2bns h GLN 77 CO -0.01 0.17 -0.18 0.00 -0.67 0.00 0.00 178.83 178.14 2bns n ALA 78 N -2.20 2.91 -2.69 3.87 0.00 -0.71 -4.94 120.51 116.76 2bns n ALA 78 Ca 0.00 -0.36 -0.19 0.00 0.00 0.00 0.00 53.44 52.89 2bns n ALA 78 Cb 0.39 -1.21 0.02 0.00 0.00 0.00 0.00 19.45 18.65 2bns n ALA 78 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bns n GLY 79 N 1.30 -0.37 2.46 0.00 0.00 -0.80 -2.91 105.19 104.87 2bns n GLY 79 Ca 0.14 -0.04 -0.17 0.00 0.00 0.00 0.00 46.02 45.95 2bns n GLY 79 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2bns n TRP 80 N -4.22 -0.10 -3.50 1.61 7.02 -0.48 -4.96 117.44 112.81 2bns n TRP 80 Ca -0.15 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 55.91 2bns n TRP 80 Cb 0.63 -2.93 -0.10 0.00 -2.42 0.00 0.00 31.31 26.49 2bns n TRP 80 CO 0.00 0.00 0.00 1.21 -2.02 0.00 0.00 177.69 176.88 2bns s ASN 81 N -2.76 6.00 0.31 -0.99 3.84 -1.15 -4.98 114.94 115.21 2bns s ASN 81 Ca 0.00 -0.91 0.05 0.00 0.21 0.00 0.00 52.86 52.21 2bns s ASN 81 Cb 0.00 -2.12 0.69 0.00 -0.55 0.00 0.00 41.25 39.28 2bns s ASN 81 CO 0.00 -0.42 1.82 -0.65 -2.79 0.00 0.00 177.10 175.05 2bns h PRO 82 N 8.57 0.81 -0.12 0.43 0.11 -1.93 -0.98 132.00 138.89 2bns h PRO 82 Ca -0.27 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 65.80 2bns h PRO 82 Cb 1.12 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.03 2bns h PRO 82 CO 0.71 0.53 0.05 0.00 -0.21 0.00 0.00 178.00 179.08 2bns h ALA 83 N 1.59 0.13 -0.25 -0.75 0.00 -1.96 -2.61 119.26 115.42 2bns h ALA 83 Ca 0.52 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.37 2bns h ALA 83 Cb 0.72 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 2bns h ALA 83 CO -0.30 -0.41 -0.17 0.28 0.00 0.00 0.00 179.25 178.66 2bns h VAL 84 N 0.11 1.23 -0.51 0.00 2.07 -1.68 -2.49 116.25 114.98 2bns h VAL 84 Ca 0.05 -1.06 -0.03 0.00 0.82 0.00 0.00 66.70 66.48 2bns h VAL 84 Cb 0.02 1.24 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 2bns h VAL 84 CO -0.05 0.34 0.22 0.15 0.02 0.00 0.00 177.57 178.25 2bns h PHE 85 N 0.39 0.77 -0.23 1.57 3.57 -1.00 -1.82 116.94 120.19 2bns h PHE 85 Ca 0.07 -0.05 -0.19 0.00 3.53 0.00 0.00 57.97 61.32 2bns h PHE 85 Cb 0.53 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.04 2bns h PHE 85 CO 0.01 0.63 -0.62 -0.07 -2.23 0.00 0.00 178.31 176.04 2bns h LEU 86 N 0.69 0.93 -0.71 0.59 3.38 -1.31 -1.96 115.31 116.93 2bns h LEU 86 Ca 0.17 -0.57 -0.14 0.00 0.09 0.00 0.00 57.88 57.43 2bns h LEU 86 Cb 0.17 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2bns h LEU 86 CO -0.02 1.34 -0.64 0.08 0.09 0.00 0.00 178.44 179.29 2bns h ARG 87 N 0.57 0.00 -0.18 1.13 0.11 -1.27 -3.16 114.38 111.59 2bns h ARG 87 Ca -0.01 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.07 2bns h ARG 87 Cb 1.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.32 2bns h ARG 87 CO 0.13 0.64 0.00 -0.25 0.10 0.00 0.00 179.97 180.60 2bns n ASP 88 N -3.77 3.35 -0.29 0.08 8.00 -0.70 -4.70 116.55 118.52 2bns n ASP 88 Ca -0.01 -3.00 0.10 0.00 0.71 0.00 0.00 54.79 52.59 2bns n ASP 88 Cb 0.64 -0.49 0.26 0.00 -0.02 0.00 0.00 41.12 41.50 2bns n ASP 88 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2bns h LEU 89 N 1.22 0.26 0.00 0.64 5.85 -1.31 -1.50 115.31 120.46 2bns h LEU 89 Ca 0.00 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.86 2bns h LEU 89 Cb 1.27 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.44 2bns h LEU 89 CO 0.14 0.02 -0.59 -0.26 -0.34 0.00 0.00 178.44 177.41 2bns h PHE 90 N 0.39 0.00 0.00 1.25 -1.00 -1.86 -3.28 116.94 112.44 2bns h PHE 90 Ca 0.50 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.28 2bns h PHE 90 Cb 0.89 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.45 2bns h PHE 90 CO -0.17 0.00 -0.85 1.19 -1.61 0.00 0.00 178.31 176.86 2bns n PHE 91 N -2.56 0.45 -2.04 -0.55 3.01 -0.65 -2.02 117.46 113.11 2bns n PHE 91 Ca 0.02 0.13 -0.38 0.00 1.01 0.00 0.00 57.45 58.23 2bns n PHE 91 Cb 0.50 -0.58 0.01 0.00 -0.01 0.00 0.00 39.48 39.40 2bns n PHE 91 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 2bns s PHE 92 N -3.20 2.69 -0.11 1.38 0.08 -0.70 -4.84 117.98 113.29 2bns s PHE 92 Ca 0.04 1.43 -0.05 0.00 0.12 0.00 0.00 56.93 58.48 2bns s PHE 92 Cb 0.14 -3.62 0.05 0.00 -0.57 0.00 0.00 43.02 39.01 2bns s PHE 92 CO 0.76 -2.14 0.24 0.45 -0.10 0.00 0.00 175.22 174.44 2bns s SER 93 N -0.97 -0.11 -0.61 1.36 0.15 -1.26 -4.37 113.70 107.89 2bns s SER 93 Ca 0.63 0.51 -0.17 0.00 0.70 0.00 0.00 55.95 57.62 2bns s SER 93 Cb -0.36 0.44 0.13 0.00 -1.71 0.00 0.00 66.02 64.52 2bns s SER 93 CO 0.45 -0.18 0.63 -0.22 1.20 0.00 0.00 173.24 175.11 2bns s LEU 94 N 1.49 5.94 0.34 3.45 0.20 -0.86 -4.95 118.68 124.30 2bns s LEU 94 Ca -0.07 -1.78 -0.09 0.00 0.69 0.00 0.00 54.13 52.88 2bns s LEU 94 Cb -0.11 -2.25 -0.06 0.00 -0.43 0.00 0.00 46.19 43.34 2bns s LEU 94 CO -0.08 -0.92 0.67 -1.61 -0.29 0.00 0.00 176.35 174.12 2bns s GLU 95 N 1.85 3.75 1.03 1.98 0.41 -1.26 -1.61 118.70 124.85 2bns s GLU 95 Ca 0.09 0.31 -0.13 0.00 -0.41 0.00 0.00 54.97 54.82 2bns s GLU 95 Cb -0.25 -2.50 0.21 0.00 -1.78 0.00 0.00 34.13 29.81 2bns s GLU 95 CO 0.02 0.10 1.09 -1.25 -0.49 0.00 0.00 175.26 174.73 2bns s PRO 96 N -3.59 0.14 0.84 0.39 0.04 -1.26 -4.39 135.00 127.17 2bns s PRO 96 Ca 0.49 0.42 -0.13 0.00 0.04 0.00 0.00 61.00 61.82 2bns s PRO 96 Cb -0.10 -1.71 0.09 0.00 0.04 0.00 0.00 34.50 32.82 2bns s PRO 96 CO 0.29 -2.90 1.15 -2.30 0.04 0.00 0.00 177.00 173.27 2bns n PRO 97 N -4.28 0.03 -0.99 0.56 -0.02 -1.26 -4.64 135.00 124.41 2bns n PRO 97 Ca 0.06 0.09 -0.31 0.00 -2.02 0.00 0.00 63.50 61.32 2bns n PRO 97 Cb 0.58 -2.39 0.13 0.00 -0.02 0.00 0.00 33.50 31.80 2bns n PRO 97 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bns s ALA 98 N -2.24 1.74 0.49 3.55 0.00 -1.26 -3.20 121.76 120.85 2bns s ALA 98 Ca 0.71 0.36 0.18 0.00 0.00 0.00 0.00 51.96 53.21 2bns s ALA 98 Cb -0.28 -3.34 1.21 0.00 0.00 0.00 0.00 23.12 20.72 2bns s ALA 98 CO 0.53 -2.33 2.04 -1.35 0.00 0.00 0.00 175.76 174.65 2bns h PRO 99 N -1.55 0.15 -1.09 0.00 0.11 -1.93 -2.38 132.00 125.31 2bns h PRO 99 Ca -0.45 -0.01 0.30 0.00 0.11 0.00 0.00 66.00 65.95 2bns h PRO 99 Cb 1.26 -0.03 -0.10 0.00 0.11 0.00 0.00 31.00 32.23 2bns h PRO 99 CO 0.47 0.10 0.71 1.05 -0.21 0.00 0.00 178.00 180.12 2bns h GLU 100 N 0.16 0.31 -0.00 1.05 4.11 -2.00 -2.12 114.58 116.09 2bns h GLU 100 Ca 0.17 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.59 2bns h GLU 100 Cb 0.49 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2bns h GLU 100 CO -0.02 0.20 -0.00 0.66 0.07 0.00 0.00 179.01 179.92 2bns n TYR 101 N -4.62 0.00 -1.72 2.06 4.01 -0.90 -5.01 117.16 110.98 2bns n TYR 101 Ca 0.27 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.01 2bns n TYR 101 Cb 0.99 -0.48 0.00 0.00 -0.31 0.00 0.00 39.34 39.54 2bns n TYR 101 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2bns n GLY 102 N 1.48 3.06 1.71 2.72 0.00 -0.80 -1.81 105.19 111.56 2bns n GLY 102 Ca 0.08 -0.19 0.08 0.00 0.00 0.00 0.00 46.02 45.99 2bns n GLY 102 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2bns n LEU 103 N 0.00 5.19 -4.77 0.99 4.77 -1.22 -2.26 117.00 119.70 2bns n LEU 103 Ca 0.00 -2.67 -0.37 0.00 -0.03 0.00 0.00 56.01 52.94 2bns n LEU 103 Cb 0.00 -0.63 0.01 0.00 -2.33 0.00 0.00 43.42 40.47 2bns n LEU 103 CO 0.00 0.73 0.86 -0.55 -1.33 0.00 0.00 177.39 177.10 2bns s SER 104 N -0.89 5.86 -0.08 -1.43 0.15 -0.75 -4.93 113.70 111.63 2bns s SER 104 Ca 0.53 2.39 0.14 0.00 0.70 0.00 0.00 55.95 59.71 2bns s SER 104 Cb 0.37 -2.61 0.56 0.00 -1.71 0.00 0.00 66.02 62.63 2bns s SER 104 CO 0.21 -1.14 1.43 0.49 1.20 0.00 0.00 173.24 175.43 2bns n PHE 105 N -0.77 1.13 -1.51 3.44 3.72 -1.26 -4.46 117.46 117.74 2bns n PHE 105 Ca 0.09 -0.46 -0.23 0.00 -0.05 0.00 0.00 57.45 56.80 2bns n PHE 105 Cb 0.48 -0.19 0.11 0.00 -0.94 0.00 0.00 39.48 38.94 2bns n PHE 105 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2bns n ALA 106 N 0.85 5.41 -2.06 4.37 0.00 -1.26 -4.95 120.51 122.87 2bns n ALA 106 Ca 0.20 -3.38 -0.40 0.00 0.00 0.00 0.00 53.44 49.86 2bns n ALA 106 Cb 0.70 -1.12 -0.06 0.00 0.00 0.00 0.00 19.45 18.98 2bns n ALA 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bns s ALA 107 N -3.55 3.40 0.67 0.00 0.00 -1.26 -5.05 121.76 115.97 2bns s ALA 107 Ca 0.55 0.40 -0.17 0.00 0.00 0.00 0.00 51.96 52.75 2bns s ALA 107 Cb 0.46 -3.03 -0.01 0.00 0.00 0.00 0.00 23.12 20.53 2bns s ALA 107 CO 0.02 0.20 1.08 -2.30 0.00 0.00 0.00 175.76 174.76 2bns n PRO 108 N 1.95 0.78 -0.31 0.00 -0.02 -1.26 -3.78 135.00 132.36 2bns n PRO 108 Ca -0.04 0.32 0.12 0.00 -2.02 0.00 0.00 63.50 61.88 2bns n PRO 108 Cb 0.49 -2.32 0.29 0.00 -0.02 0.00 0.00 33.50 31.94 2bns n PRO 108 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2bns h LEU 109 N 0.16 0.44 -1.49 2.45 3.38 -1.94 -1.00 115.31 117.31 2bns h LEU 109 Ca -0.49 0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.61 2bns h LEU 109 Cb 1.34 0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.17 2bns h LEU 109 CO 0.50 0.09 0.00 0.29 0.09 0.00 0.00 178.44 179.40 2bns n LYS 110 N -4.97 1.94 -1.76 1.13 5.02 -1.26 -2.54 118.16 115.73 2bns n LYS 110 Ca 0.21 -1.45 0.01 0.00 -2.02 0.00 0.00 58.31 55.06 2bns n LYS 110 Cb 0.60 -1.33 0.06 0.00 -0.02 0.00 0.00 35.03 34.33 2bns n LYS 110 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2bns n GLU 111 N 0.68 1.02 0.00 1.97 1.02 -0.47 -4.97 120.64 119.89 2bns n GLU 111 Ca 0.14 -2.80 0.00 0.00 -0.02 0.00 0.00 57.16 54.49 2bns n GLU 111 Cb 0.35 -0.88 0.00 0.00 -0.02 0.00 0.00 31.44 30.89 2bns n GLU 111 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bns n GLY 112 N -0.15 0.98 0.28 0.62 0.00 -1.19 -4.25 105.19 101.47 2bns n GLY 112 Ca 0.12 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.18 2bns n GLY 112 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2bns h GLY 113 N 0.00 1.15 1.50 -0.02 0.00 -1.40 -1.40 103.07 102.90 2bns h GLY 113 Ca 0.00 -0.19 -0.09 0.00 0.00 0.00 0.00 47.33 47.05 2bns h GLY 113 CO 0.00 -0.04 -0.19 -2.00 0.00 0.00 0.00 176.54 174.31 2bns h LEU 114 N 0.52 0.58 -0.61 3.11 5.85 -1.71 -2.03 115.31 121.02 2bns h LEU 114 Ca 0.40 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.95 2bns h LEU 114 Cb 0.54 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 2bns h LEU 114 CO -0.35 0.78 0.39 -0.25 -0.34 0.00 0.00 178.44 178.67 2bns h TRP 115 N 0.52 0.73 -0.23 1.25 7.01 -1.53 0.31 115.95 124.01 2bns h TRP 115 Ca 0.08 0.02 -0.06 0.00 2.11 0.00 0.00 58.89 61.04 2bns h TRP 115 Cb 0.63 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 27.43 2bns h TRP 115 CO 0.02 0.43 -0.12 -0.07 -2.79 0.00 0.00 178.44 175.91 2bns h LEU 116 N 0.77 0.37 -0.00 0.65 3.38 -1.05 0.12 115.31 119.54 2bns h LEU 116 Ca 0.24 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 2bns h LEU 116 Cb -0.02 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.63 2bns h LEU 116 CO -0.08 0.52 -0.00 0.40 0.09 0.00 0.00 178.44 179.37 2bns h ILE 117 N 0.36 1.51 -0.75 1.22 2.04 -0.90 -1.42 117.51 119.57 2bns h ILE 117 Ca 0.07 -1.51 0.11 0.00 1.00 0.00 0.00 64.86 64.54 2bns h ILE 117 Cb 0.44 2.53 -0.08 0.00 -0.74 0.00 0.00 36.82 38.97 2bns h ILE 117 CO 0.03 0.39 0.37 0.00 0.00 0.00 0.00 178.15 178.93 2bns h ALA 118 N 0.36 1.06 -0.62 1.87 0.00 -0.75 -1.91 119.26 119.28 2bns h ALA 118 Ca -0.00 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2bns h ALA 118 Cb 0.64 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 2bns h ALA 118 CO 0.00 -0.07 0.24 0.77 0.00 0.00 0.00 179.25 180.19 2bns h SER 119 N 0.59 0.86 -0.33 0.00 0.02 -0.71 -0.15 113.55 113.83 2bns h SER 119 Ca 0.38 -0.17 0.06 0.00 -0.84 0.00 0.00 61.79 61.22 2bns h SER 119 Cb 0.46 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 62.73 2bns h SER 119 CO -0.31 0.80 -0.00 0.15 -1.14 0.00 0.00 176.83 176.33 2bns h PHE 120 N 0.86 -0.02 -0.54 3.45 3.57 -0.52 -0.16 116.94 123.58 2bns h PHE 120 Ca 0.21 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.62 2bns h PHE 120 Cb 0.21 0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 2bns h PHE 120 CO 0.01 -0.06 -0.09 0.74 -2.23 0.00 0.00 178.31 176.68 2bns h PHE 121 N 0.09 1.13 -0.69 0.41 0.04 -0.89 -1.84 116.94 115.19 2bns h PHE 121 Ca 0.16 -0.23 -0.05 0.00 2.80 0.00 0.00 57.97 60.65 2bns h PHE 121 Cb 0.22 -0.28 -0.03 0.00 2.20 0.00 0.00 35.95 38.06 2bns h PHE 121 CO -0.24 1.05 0.23 1.98 -0.60 0.00 0.00 178.31 180.73 2bns h MET 122 N 0.89 1.06 -0.58 1.51 4.05 -0.77 -1.19 114.93 119.91 2bns h MET 122 Ca 0.14 -0.21 -0.03 0.00 -0.28 0.00 0.00 59.70 59.32 2bns h MET 122 Cb 0.66 -0.16 -0.03 0.00 -0.80 0.00 0.00 31.60 31.27 2bns h MET 122 CO 0.05 0.89 0.23 0.35 0.23 0.00 0.00 176.91 178.66 2bns h PHE 123 N 1.02 0.88 -0.33 1.39 3.57 -0.59 -1.53 116.94 121.35 2bns h PHE 123 Ca 0.23 -0.07 -0.15 0.00 3.53 0.00 0.00 57.97 61.52 2bns h PHE 123 Cb 0.27 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 2bns h PHE 123 CO 0.02 0.71 -0.38 0.28 -2.23 0.00 0.00 178.31 176.71 2bns h VAL 124 N 0.79 1.28 -0.68 1.41 2.07 -1.23 -2.67 116.25 117.22 2bns h VAL 124 Ca 0.19 -1.55 -0.08 0.00 0.82 0.00 0.00 66.70 66.09 2bns h VAL 124 Cb 0.20 1.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 2bns h VAL 124 CO -0.02 0.51 0.12 0.00 0.02 0.00 0.00 177.57 178.20 2bns h ALA 125 N 0.93 0.92 0.04 1.67 0.00 -0.83 -0.41 119.26 121.57 2bns h ALA 125 Ca 0.06 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 2bns h ALA 125 Cb 0.93 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.47 2bns h ALA 125 CO 0.09 0.67 -0.39 0.28 0.00 0.00 0.00 179.25 179.90 2bns h VAL 126 N 1.05 1.57 -0.01 0.00 2.07 -1.30 -1.99 116.25 117.65 2bns h VAL 126 Ca 0.21 -2.20 -0.06 0.00 0.82 0.00 0.00 66.70 65.47 2bns h VAL 126 Cb 0.43 2.99 -0.01 0.00 -1.52 0.00 0.00 31.29 33.18 2bns h VAL 126 CO 0.01 0.61 -0.26 -0.50 0.02 0.00 0.00 177.57 177.45 2bns h TRP 127 N -0.52 0.03 -0.10 1.57 4.06 -1.53 0.05 115.95 119.50 2bns h TRP 127 Ca -0.06 -0.00 -0.03 0.00 2.06 0.00 0.00 58.89 60.86 2bns h TRP 127 Cb 1.21 -0.01 -0.00 0.00 -1.00 0.00 0.00 29.16 29.36 2bns h TRP 127 CO 0.20 0.28 -0.05 0.77 -3.56 0.00 0.00 178.44 176.09 2bns h SER 128 N 0.02 0.22 -0.70 -3.49 0.02 -1.09 -2.18 113.55 106.35 2bns h SER 128 Ca 0.00 -0.41 0.05 0.00 -0.84 0.00 0.00 61.79 60.59 2bns h SER 128 Cb 0.47 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.91 2bns h SER 128 CO 0.03 0.58 0.46 -0.25 -1.14 0.00 0.00 176.83 176.51 2bns h TRP 129 N -0.14 0.78 0.00 3.45 2.91 -1.16 -1.58 115.95 120.22 2bns h TRP 129 Ca 0.02 0.02 -0.00 0.00 1.13 0.00 0.00 58.89 60.06 2bns h TRP 129 Cb 0.49 -0.26 0.00 0.00 -0.51 0.00 0.00 29.16 28.88 2bns h TRP 129 CO 0.06 0.44 -0.00 2.35 -1.03 0.00 0.00 178.44 180.26 2bns h TRP 130 N 0.79 -0.00 -0.85 2.65 7.01 -0.86 -0.17 115.95 124.52 2bns h TRP 130 Ca 0.29 -0.00 0.18 0.00 2.11 0.00 0.00 58.89 61.47 2bns h TRP 130 Cb 0.15 0.00 -0.06 0.00 -2.10 0.00 0.00 29.16 27.15 2bns h TRP 130 CO -0.00 0.36 0.56 0.78 -2.79 0.00 0.00 178.44 177.35 2bns h GLY 131 N -0.37 0.84 1.02 2.65 0.00 -1.27 -2.12 103.07 103.82 2bns h GLY 131 Ca -0.00 -0.19 -0.12 0.00 0.00 0.00 0.00 47.33 47.02 2bns h GLY 131 CO 0.00 0.03 -0.21 -0.09 0.00 0.00 0.00 176.54 176.27 2bns h ARG 132 N 0.43 0.82 -0.42 4.80 2.43 -0.53 -1.37 114.38 120.55 2bns h ARG 132 Ca 0.43 -0.37 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2bns h ARG 132 Cb 1.02 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.53 2bns h ARG 132 CO -0.16 1.00 0.15 1.79 -1.51 0.00 0.00 179.97 181.25 2bns h THR 133 N 0.62 1.16 0.00 0.20 1.35 -0.41 -0.44 112.91 115.39 2bns h THR 133 Ca 0.08 -0.53 -0.00 0.00 -0.55 0.00 0.00 66.41 65.41 2bns h THR 133 Cb 0.77 0.68 0.00 0.00 -1.73 0.00 0.00 68.15 67.87 2bns h THR 133 CO 0.06 0.20 -0.00 0.22 -0.25 0.00 0.00 175.52 175.75 2bns h TYR 134 N 0.59 -0.00 -0.46 4.73 3.20 -1.31 -3.00 116.97 120.73 2bns h TYR 134 Ca 0.14 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.96 2bns h TYR 134 Cb 0.14 0.00 -0.02 0.00 1.54 0.00 0.00 36.73 38.39 2bns h TYR 134 CO 0.01 0.30 0.09 -0.07 -1.64 0.00 0.00 178.16 176.85 2bns h LEU 135 N -0.31 0.71 -0.85 2.82 3.38 -0.90 -0.47 115.31 119.69 2bns h LEU 135 Ca -0.00 -0.25 0.05 0.00 0.09 0.00 0.00 57.88 57.77 2bns h LEU 135 Cb 0.31 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 2bns h LEU 135 CO 0.00 0.78 0.54 0.03 0.09 0.00 0.00 178.44 179.88 2bns h ARG 136 N 0.62 0.99 -0.35 1.13 2.47 -1.18 -1.16 114.38 116.90 2bns h ARG 136 Ca 0.14 -0.06 -0.07 0.00 -1.26 0.00 0.00 59.98 58.73 2bns h ARG 136 Cb 0.36 -0.22 -0.01 0.00 -1.65 0.00 0.00 29.97 28.44 2bns h ARG 136 CO 0.01 0.66 -0.06 0.00 0.56 0.00 0.00 179.97 181.13 2bns h ALA 137 N 1.37 0.48 -1.00 0.04 0.00 -1.33 -2.97 119.26 115.85 2bns h ALA 137 Ca 0.35 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 55.00 2bns h ALA 137 Cb 0.08 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 2bns h ALA 137 CO -0.14 0.30 0.66 0.37 0.00 0.00 0.00 179.25 180.44 2bns h GLN 138 N 0.45 1.29 0.00 0.00 4.15 -0.81 -0.77 115.11 119.42 2bns h GLN 138 Ca 0.09 -0.08 -0.08 0.00 0.77 0.00 0.00 58.65 59.35 2bns h GLN 138 Cb 0.55 -0.29 -0.01 0.00 0.21 0.00 0.00 27.48 27.94 2bns h GLN 138 CO 0.03 0.85 -0.40 0.00 -1.93 0.00 0.00 178.83 177.38 2bns h ALA 139 N 1.38 1.10 -0.01 3.38 0.00 -1.18 -2.06 119.26 121.87 2bns h ALA 139 Ca 0.38 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2bns h ALA 139 Cb -0.10 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2bns h ALA 139 CO -0.10 0.50 -0.22 1.28 0.00 0.00 0.00 179.25 180.71 2bns n LEU 140 N -3.72 1.16 0.00 0.00 4.77 -0.94 -1.37 117.00 116.91 2bns n LEU 140 Ca -0.01 -0.33 0.00 0.00 -0.03 0.00 0.00 56.01 55.64 2bns n LEU 140 Cb 0.48 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 2bns n LEU 140 CO 0.38 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.26 2bns n GLY 141 N 1.32 0.51 3.93 -0.72 0.00 -0.74 -4.90 105.19 104.58 2bns n GLY 141 Ca 0.13 -0.49 -0.25 0.00 0.00 0.00 0.00 46.02 45.41 2bns n GLY 141 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2bns s MET 142 N -0.95 3.43 1.13 1.61 -1.94 -0.37 -5.00 119.30 117.21 2bns s MET 142 Ca 0.00 -0.12 -0.14 0.00 -1.71 0.00 0.00 55.69 53.72 2bns s MET 142 Cb 0.00 -2.51 0.26 0.00 2.01 0.00 0.00 34.83 34.59 2bns s MET 142 CO 0.00 -0.09 1.05 0.20 -0.01 0.00 0.00 175.02 176.17 2bns s GLY 143 N -4.10 1.54 -0.34 -0.03 0.00 -1.26 -4.31 107.32 98.82 2bns s GLY 143 Ca 0.45 -0.42 0.09 0.00 0.00 0.00 0.00 44.72 44.83 2bns s GLY 143 CO 0.40 0.31 1.69 0.28 0.00 0.00 0.00 173.10 175.79 2bns n LYS 144 N -4.69 2.58 0.14 2.90 4.76 -1.26 -4.65 118.16 117.95 2bns n LYS 144 Ca 0.06 -3.07 0.08 0.00 -2.87 0.00 0.00 58.31 52.50 2bns n LYS 144 Cb 0.57 -2.04 0.57 0.00 -1.84 0.00 0.00 35.03 32.29 2bns n LYS 144 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2bns h HIS 145 N 1.52 0.18 -0.09 2.13 3.86 -1.98 -2.16 115.15 118.62 2bns h HIS 145 Ca 0.34 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.45 2bns h HIS 145 Cb 2.18 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 30.60 2bns h HIS 145 CO 1.21 0.11 -0.35 1.15 0.86 0.00 0.00 177.93 180.91 2bns h THR 146 N 0.19 1.40 -0.32 2.45 2.02 -1.93 -1.58 112.91 115.14 2bns h THR 146 Ca 0.08 -1.72 -0.06 0.00 0.77 0.00 0.00 66.41 65.48 2bns h THR 146 Cb 0.08 2.26 -0.02 0.00 -1.74 0.00 0.00 68.15 68.73 2bns h THR 146 CO -0.01 0.50 -0.04 0.00 0.37 0.00 0.00 175.52 176.34 2bns h ALA 147 N 0.45 1.34 -0.41 6.16 0.00 -1.78 -1.04 119.26 123.98 2bns h ALA 147 Ca -0.02 -0.22 -0.15 0.00 0.00 0.00 0.00 54.91 54.52 2bns h ALA 147 Cb 0.99 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2bns h ALA 147 CO 0.07 0.45 -0.34 -1.49 0.00 0.00 0.00 179.25 177.94 2bns h TRP 148 N 0.48 1.14 -0.29 0.00 -0.00 -1.29 -2.06 115.95 113.93 2bns h TRP 148 Ca 0.10 -0.33 -0.13 0.00 -0.00 0.00 0.00 58.89 58.54 2bns h TRP 148 Cb 0.37 -0.25 -0.01 0.00 -0.00 0.00 0.00 29.16 29.28 2bns h TRP 148 CO 0.01 1.16 -0.34 0.00 -0.00 0.00 0.00 178.44 179.27 2bns h ALA 149 N 0.80 0.86 -0.10 1.49 0.00 -1.06 -2.88 119.26 118.36 2bns h ALA 149 Ca 0.07 -0.41 -0.11 0.00 0.00 0.00 0.00 54.91 54.46 2bns h ALA 149 Cb 0.94 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.59 2bns h ALA 149 CO 0.09 0.63 -0.42 0.35 0.00 0.00 0.00 179.25 179.90 2bns h PHE 150 N 0.54 0.28 -0.51 0.00 3.57 -1.10 -2.31 116.94 117.41 2bns h PHE 150 Ca 0.06 -0.08 0.07 0.00 3.53 0.00 0.00 57.97 61.55 2bns h PHE 150 Cb 0.84 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.49 2bns h PHE 150 CO 0.04 0.63 0.34 -0.07 -2.23 0.00 0.00 178.31 177.01 2bns h LEU 151 N 0.20 0.37 -0.66 0.59 3.38 -1.15 -0.41 115.31 117.63 2bns h LEU 151 Ca 0.02 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.88 2bns h LEU 151 Cb 0.83 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 2bns h LEU 151 CO 0.07 0.24 -0.13 -1.28 0.09 0.00 0.00 178.44 177.43 2bns h SER 152 N 0.42 0.91 -0.37 -0.43 0.87 -1.41 0.60 113.55 114.15 2bns h SER 152 Ca 0.22 -0.30 -0.11 0.00 -1.23 0.00 0.00 61.79 60.38 2bns h SER 152 Cb 0.34 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.04 2bns h SER 152 CO -0.06 1.04 -0.20 0.00 -0.53 0.00 0.00 176.83 177.09 2bns h ALA 153 N 1.03 0.52 -0.83 6.23 0.00 -1.41 -3.13 119.26 121.68 2bns h ALA 153 Ca 0.13 -0.37 0.02 0.00 0.00 0.00 0.00 54.91 54.69 2bns h ALA 153 Cb 0.66 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 2bns h ALA 153 CO 0.05 0.48 0.55 0.82 0.00 0.00 0.00 179.25 181.14 2bns h ILE 154 N 0.58 1.19 -0.84 0.00 2.04 -0.86 -2.60 117.51 117.02 2bns h ILE 154 Ca 0.08 -0.38 -0.03 0.00 1.00 0.00 0.00 64.86 65.54 2bns h ILE 154 Cb 0.75 -0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.79 2bns h ILE 154 CO 0.06 0.20 0.43 -0.25 0.00 0.00 0.00 178.15 178.59 2bns h TRP 155 N 1.10 1.20 -0.27 1.37 2.91 -0.83 0.33 115.95 121.76 2bns h TRP 155 Ca 0.31 -0.05 -0.01 0.00 1.13 0.00 0.00 58.89 60.28 2bns h TRP 155 Cb -0.08 -0.37 -0.01 0.00 -0.51 0.00 0.00 29.16 28.18 2bns h TRP 155 CO -0.00 0.85 0.14 1.25 -1.03 0.00 0.00 178.44 179.65 2bns h LEU 156 N 1.19 0.34 -0.96 0.65 6.46 -1.46 -1.30 115.31 120.24 2bns h LEU 156 Ca 0.29 -0.10 -0.06 0.00 -0.12 0.00 0.00 57.88 57.89 2bns h LEU 156 Cb 0.09 -0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 39.91 2bns h LEU 156 CO -0.04 0.34 0.08 -0.25 -0.62 0.00 0.00 178.44 177.95 2bns h TRP 157 N 0.31 0.88 -0.50 1.25 7.01 -1.19 -1.03 115.95 122.68 2bns h TRP 157 Ca 0.09 -0.10 -0.07 0.00 2.11 0.00 0.00 58.89 60.92 2bns h TRP 157 Cb 0.08 -0.25 -0.02 0.00 -2.10 0.00 0.00 29.16 26.87 2bns h TRP 157 CO -0.03 0.76 0.03 0.52 -2.79 0.00 0.00 178.44 176.93 2bns h MET 158 N 0.80 0.87 0.05 2.65 2.86 -0.16 -1.97 114.93 120.02 2bns h MET 158 Ca 0.17 -0.26 -0.00 0.00 -2.06 0.00 0.00 59.70 57.54 2bns h MET 158 Cb 0.37 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.94 2bns h MET 158 CO 0.01 0.89 -0.02 0.28 1.06 0.00 0.00 176.91 179.12 2bns h VAL 159 N 0.73 1.13 -0.66 -2.22 2.07 -0.93 0.66 116.25 117.03 2bns h VAL 159 Ca 0.15 -0.60 0.05 0.00 0.82 0.00 0.00 66.70 67.11 2bns h VAL 159 Cb 0.48 1.52 -0.05 0.00 -1.52 0.00 0.00 31.29 31.72 2bns h VAL 159 CO 0.02 0.15 0.39 -0.07 0.02 0.00 0.00 177.57 178.08 2bns h LEU 160 N -0.34 0.60 0.00 2.57 3.38 -1.16 -2.23 115.31 118.13 2bns h LEU 160 Ca -0.01 0.02 -0.23 0.00 0.09 0.00 0.00 57.88 57.75 2bns h LEU 160 Cb 0.30 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 2bns h LEU 160 CO 0.01 0.40 -1.74 0.61 0.09 0.00 0.00 178.44 177.81 2bns n GLY 161 N -1.28 -1.09 1.90 0.83 0.00 -0.75 -3.99 105.19 100.81 2bns n GLY 161 Ca 0.07 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2bns n GLY 161 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2bns n PHE 162 N -2.86 -2.20 -0.04 1.61 3.72 -0.01 -4.71 117.46 112.97 2bns n PHE 162 Ca -0.16 0.39 -0.12 0.00 -0.05 0.00 0.00 57.45 57.51 2bns n PHE 162 Cb 0.95 0.53 -0.07 0.00 -0.94 0.00 0.00 39.48 39.95 2bns n PHE 162 CO 0.00 0.00 0.00 0.82 -0.05 0.00 0.00 176.76 177.53 2bns h ILE 163 N 0.00 1.27 0.01 4.37 2.04 -1.07 -1.89 117.51 122.24 2bns h ILE 163 Ca 0.00 -0.87 -0.00 0.00 1.00 0.00 0.00 64.86 64.99 2bns h ILE 163 Cb 0.00 1.61 0.00 0.00 -0.74 0.00 0.00 36.82 37.69 2bns h ILE 163 CO 0.00 0.25 -0.01 -0.09 0.00 0.00 0.00 178.15 178.30 2bns h ARG 164 N -0.07 -0.02 -1.00 2.37 2.43 -1.61 -1.57 114.38 114.91 2bns h ARG 164 Ca 0.03 0.00 0.11 0.00 -0.81 0.00 0.00 59.98 59.32 2bns h ARG 164 Cb 0.39 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 29.86 2bns h ARG 164 CO 0.01 0.24 0.63 -1.35 -1.51 0.00 0.00 179.97 177.99 2bns h PRO 165 N -0.28 0.98 -0.34 0.20 0.11 -1.73 -1.00 132.00 129.94 2bns h PRO 165 Ca -0.00 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.02 2bns h PRO 165 Cb 0.27 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.15 2bns h PRO 165 CO 0.00 0.65 0.11 0.82 -0.21 0.00 0.00 178.00 179.37 2bns h ILE 166 N 1.01 1.20 0.00 4.15 2.04 -1.28 -2.21 117.51 122.42 2bns h ILE 166 Ca 0.49 -0.65 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 2bns h ILE 166 Cb 0.46 1.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.53 2bns h ILE 166 CO -0.25 0.22 -0.12 -0.07 0.00 0.00 0.00 178.15 177.93 2bns h LEU 167 N 0.39 0.00 0.00 1.44 3.38 -0.68 -2.46 115.31 117.37 2bns h LEU 167 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2bns h LEU 167 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2bns h LEU 167 CO -0.00 0.12 -0.55 0.23 0.09 0.00 0.00 178.44 178.33 2bns n MET 168 N -3.64 0.03 -0.29 1.13 2.81 -0.43 -4.97 117.12 111.76 2bns n MET 168 Ca -0.02 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.88 2bns n MET 168 Cb 0.25 -1.51 0.00 0.00 -0.71 0.00 0.00 33.22 31.24 2bns n MET 168 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2bns n GLY 169 N 1.49 0.77 3.63 3.03 0.00 -0.93 -5.05 105.19 108.13 2bns n GLY 169 Ca 0.05 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 2bns n GLY 169 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bns s SER 170 N -2.41 -0.68 0.60 1.61 1.04 -0.88 -3.43 113.70 109.56 2bns s SER 170 Ca 0.00 1.29 0.34 0.00 0.48 0.00 0.00 55.95 58.06 2bns s SER 170 Cb 0.00 1.31 1.95 0.00 0.10 0.00 0.00 66.02 69.38 2bns s SER 170 CO 0.00 -0.22 2.26 -0.50 0.98 0.00 0.00 173.24 175.76 2bns h TRP 171 N 4.90 0.00 -0.04 5.02 -0.00 -1.66 -2.85 115.95 121.32 2bns h TRP 171 Ca -0.29 0.00 0.01 0.00 -0.00 0.00 0.00 58.89 58.61 2bns h TRP 171 Cb 1.17 0.00 -0.00 0.00 -0.00 0.00 0.00 29.16 30.33 2bns h TRP 171 CO 0.35 0.01 0.26 0.66 -0.00 0.00 0.00 178.44 179.73 2bns h SER 172 N 0.00 0.00 0.85 -3.49 4.64 -1.79 -0.87 113.55 112.89 2bns h SER 172 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2bns h SER 172 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 2bns h SER 172 CO 0.00 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.34 2bns n GLU 173 N -3.05 0.08 -2.04 4.77 -0.58 -1.08 -4.91 120.64 113.84 2bns n GLU 173 Ca -0.01 0.04 -0.28 0.00 -0.42 0.00 0.00 57.16 56.48 2bns n GLU 173 Cb 0.33 -1.50 0.11 0.00 -0.57 0.00 0.00 31.44 29.81 2bns n GLU 173 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2bns s ALA 174 N -2.92 2.75 0.01 0.62 0.00 -0.33 -4.82 121.76 117.08 2bns s ALA 174 Ca 0.16 -0.95 -0.29 0.00 0.00 0.00 0.00 51.96 50.88 2bns s ALA 174 Cb 0.18 -2.74 -0.04 0.00 0.00 0.00 0.00 23.12 20.52 2bns s ALA 174 CO 0.48 -1.77 0.92 0.08 0.00 0.00 0.00 175.76 175.48 2bns s VAL 175 N -3.54 4.82 0.66 0.00 1.01 -1.26 -4.85 120.40 117.25 2bns s VAL 175 Ca 0.65 1.95 -0.13 0.00 0.00 0.00 0.00 61.98 64.45 2bns s VAL 175 Cb -0.09 -4.27 -0.00 0.00 0.00 0.00 0.00 36.38 32.02 2bns s VAL 175 CO 0.49 0.21 1.08 -2.16 0.00 0.00 0.00 175.10 174.71 2bns s PRO 176 N 0.75 2.92 -0.97 2.72 0.04 -1.26 -4.80 135.00 134.40 2bns s PRO 176 Ca 0.48 1.18 -0.16 0.00 0.04 0.00 0.00 61.00 62.55 2bns s PRO 176 Cb -0.21 -1.98 0.17 0.00 0.04 0.00 0.00 34.50 32.53 2bns s PRO 176 CO 0.27 -1.13 1.08 0.71 0.04 0.00 0.00 177.00 177.97 2bns s TYR 177 N -2.64 3.46 0.04 0.56 2.02 -0.63 -4.51 117.35 115.65 2bns s TYR 177 Ca 0.63 -1.80 -0.24 0.00 -0.37 0.00 0.00 57.07 55.28 2bns s TYR 177 Cb -0.17 -4.12 0.06 0.00 -0.40 0.00 0.00 41.96 37.33 2bns s TYR 177 CO 0.46 -1.29 0.57 0.20 -1.57 0.00 0.00 175.55 173.92 2bns s GLY 178 N 2.89 -0.49 0.01 0.71 0.00 -1.26 -2.02 107.32 107.15 2bns s GLY 178 Ca 0.30 0.75 -0.04 0.00 0.00 0.00 0.00 44.72 45.73 2bns s GLY 178 CO -0.08 0.43 1.07 -2.22 0.00 0.00 0.00 173.10 172.30 2bns h ILE 179 N 2.71 0.00 -0.37 0.90 1.08 -1.77 -2.54 117.51 117.52 2bns h ILE 179 Ca -0.30 0.00 -0.14 0.00 -0.39 0.00 0.00 64.86 64.02 2bns h ILE 179 Cb 1.21 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.95 2bns h ILE 179 CO 0.40 0.00 -0.33 -0.26 -0.69 0.00 0.00 178.15 177.27 2bns h PHE 180 N -0.15 0.99 -0.14 1.37 0.04 -1.72 -3.08 116.94 114.25 2bns h PHE 180 Ca -0.01 -0.27 -0.03 0.00 2.80 0.00 0.00 57.97 60.45 2bns h PHE 180 Cb 0.12 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 38.04 2bns h PHE 180 CO 0.10 1.05 -0.05 0.66 -0.60 0.00 0.00 178.31 179.47 2bns h SER 181 N 0.70 0.19 0.43 2.17 4.64 -1.77 -0.97 113.55 118.94 2bns h SER 181 Ca 0.07 -0.03 -0.16 0.00 -0.47 0.00 0.00 61.79 61.21 2bns h SER 181 Cb 0.89 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.92 2bns h SER 181 CO 0.08 0.28 -0.67 1.12 -0.87 0.00 0.00 176.83 176.77 2bns h HIS 182 N 0.20 0.29 -0.61 4.77 2.07 -1.36 -1.24 115.15 119.27 2bns h HIS 182 Ca 0.05 -0.12 -0.09 0.00 -2.85 0.00 0.00 60.37 57.35 2bns h HIS 182 Cb 0.23 -0.05 -0.02 0.00 2.57 0.00 0.00 27.41 30.14 2bns h HIS 182 CO 0.00 0.82 0.02 -0.07 -3.07 0.00 0.00 177.93 175.64 2bns h LEU 183 N 0.15 1.03 -0.75 6.12 3.38 -1.32 -2.17 115.31 121.75 2bns h LEU 183 Ca -0.02 -0.30 -0.13 0.00 0.09 0.00 0.00 57.88 57.53 2bns h LEU 183 Cb 1.21 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 2bns h LEU 183 CO 0.10 1.08 -0.50 0.44 0.09 0.00 0.00 178.44 179.65 2bns h ASP 184 N 0.96 0.34 -0.44 -0.43 3.32 -0.96 -2.12 116.42 117.09 2bns h ASP 184 Ca 0.17 -0.17 -0.09 0.00 0.02 0.00 0.00 57.03 56.97 2bns h ASP 184 Cb 0.53 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 2bns h ASP 184 CO 0.03 0.79 -0.05 -0.25 -1.72 0.00 0.00 179.24 178.03 2bns h TRP 185 N 0.25 0.95 -0.31 4.55 7.01 -1.04 -0.50 115.95 126.87 2bns h TRP 185 Ca 0.01 -0.16 -0.13 0.00 2.11 0.00 0.00 58.89 60.72 2bns h TRP 185 Cb 0.97 -0.25 -0.00 0.00 -2.10 0.00 0.00 29.16 27.77 2bns h TRP 185 CO 0.02 0.89 -0.31 1.15 -2.79 0.00 0.00 178.44 177.40 2bns h THR 186 N 0.80 1.29 -0.27 2.65 2.02 -1.02 0.25 112.91 118.63 2bns h THR 186 Ca 0.14 -1.48 -0.10 0.00 0.77 0.00 0.00 66.41 65.74 2bns h THR 186 Cb 0.55 1.53 -0.00 0.00 -1.74 0.00 0.00 68.15 68.48 2bns h THR 186 CO 0.03 0.48 -0.23 -1.13 0.37 0.00 0.00 175.52 175.04 2bns h ASN 187 N 0.53 0.67 -0.32 4.18 -1.24 -1.30 -2.71 115.58 115.39 2bns h ASN 187 Ca 0.05 -0.46 -0.04 0.00 0.71 0.00 0.00 56.30 56.56 2bns h ASN 187 Cb 0.89 -0.19 -0.02 0.00 0.73 0.00 0.00 38.32 39.73 2bns h ASN 187 CO 0.08 0.99 0.06 -1.13 -1.29 0.00 0.00 177.43 176.14 2bns h ASN 188 N 0.37 0.57 -0.75 1.15 -1.24 -1.02 -1.92 115.58 112.73 2bns h ASN 188 Ca 0.05 -0.10 -0.05 0.00 0.71 0.00 0.00 56.30 56.91 2bns h ASN 188 Cb 0.78 -0.15 -0.03 0.00 0.73 0.00 0.00 38.32 39.65 2bns h ASN 188 CO 0.06 0.60 0.27 0.15 -1.29 0.00 0.00 177.43 177.22 2bns h PHE 189 N 0.59 1.17 -0.35 0.67 3.04 -0.83 -0.14 116.94 121.10 2bns h PHE 189 Ca 0.13 -0.10 -0.16 0.00 3.98 0.00 0.00 57.97 61.82 2bns h PHE 189 Cb 0.28 -0.35 -0.01 0.00 2.56 0.00 0.00 35.95 38.44 2bns h PHE 189 CO 0.01 0.91 -0.40 1.03 -2.02 0.00 0.00 178.31 177.83 2bns h SER 190 N 1.10 0.92 -0.19 0.41 0.87 -1.22 -2.76 113.55 112.69 2bns h SER 190 Ca 0.25 -0.43 -0.03 0.00 -1.23 0.00 0.00 61.79 60.35 2bns h SER 190 Cb 0.25 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 2bns h SER 190 CO -0.02 1.20 0.01 -0.07 -0.53 0.00 0.00 176.83 177.43 2bns h LEU 191 N 0.70 0.32 -1.69 2.23 4.07 -1.00 -0.58 115.31 119.36 2bns h LEU 191 Ca 0.05 -0.29 -0.04 0.00 0.08 0.00 0.00 57.88 57.68 2bns h LEU 191 Cb 0.98 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 42.63 2bns h LEU 191 CO 0.09 0.53 -0.18 0.58 -1.08 0.00 0.00 178.44 178.38 2bns h VAL 192 N 0.10 0.96 -0.48 1.22 2.07 -1.09 -2.80 116.25 116.22 2bns h VAL 192 Ca 0.06 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 66.90 2bns h VAL 192 Cb 0.36 1.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 2bns h VAL 192 CO 0.01 0.18 0.00 1.41 0.02 0.00 0.00 177.57 179.19 2bns n HIS 193 N -4.07 1.53 -2.66 1.57 8.25 -1.04 -4.88 115.22 113.93 2bns n HIS 193 Ca -0.02 -0.74 -0.08 0.00 -0.26 0.00 0.00 57.72 56.62 2bns n HIS 193 Cb 0.26 -0.37 0.04 0.00 1.12 0.00 0.00 29.99 31.04 2bns n HIS 193 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bns n GLY 194 N 0.36 0.13 1.48 -1.41 0.00 -0.97 -1.36 105.19 103.42 2bns n GLY 194 Ca 0.25 -0.24 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 2bns n GLY 194 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2bns n ASN 195 N -1.72 -3.28 0.05 1.61 4.05 -0.26 -1.69 115.26 114.02 2bns n ASN 195 Ca -0.11 0.45 0.12 0.00 0.45 0.00 0.00 54.58 55.49 2bns n ASN 195 Cb 0.57 -2.12 0.47 0.00 1.23 0.00 0.00 39.78 39.93 2bns n ASN 195 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 177.26 174.10 2bns n LEU 196 N 0.47 0.30 0.26 1.20 7.94 -1.25 -2.52 117.00 123.41 2bns n LEU 196 Ca -0.03 0.55 0.10 0.00 -1.11 0.00 0.00 56.01 55.51 2bns n LEU 196 Cb 0.05 -0.47 0.69 0.00 0.53 0.00 0.00 43.42 44.22 2bns n LEU 196 CO 0.03 -0.21 1.03 -0.26 -1.11 0.00 0.00 177.39 176.87 2bns h PHE 197 N 0.00 0.00 -0.15 1.96 0.04 -1.94 -2.53 116.94 114.32 2bns h PHE 197 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2bns h PHE 197 Cb 0.46 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.61 2bns h PHE 197 CO 0.00 0.07 0.00 0.66 -0.60 0.00 0.00 178.31 178.44 2bns n TYR 198 N -4.17 0.18 -2.65 -0.55 4.01 -1.05 -4.65 117.16 108.29 2bns n TYR 198 Ca -0.03 -0.09 -0.43 0.00 -0.16 0.00 0.00 57.90 57.19 2bns n TYR 198 Cb 0.15 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.16 2bns n TYR 198 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2bns s ASN 199 N -1.69 6.73 0.55 7.72 3.84 -0.95 -4.64 114.94 126.50 2bns s ASN 199 Ca 0.34 0.66 0.30 0.00 0.21 0.00 0.00 52.86 54.37 2bns s ASN 199 Cb 0.19 -2.53 1.60 0.00 -0.55 0.00 0.00 41.25 39.96 2bns s ASN 199 CO 0.29 -1.07 2.13 1.55 -2.79 0.00 0.00 177.10 177.21 2bns h PRO 200 N 8.74 0.00 0.00 0.43 0.13 -1.87 -0.85 132.00 138.57 2bns h PRO 200 Ca -0.22 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.78 2bns h PRO 200 Cb 1.06 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.17 2bns h PRO 200 CO 1.07 0.08 -0.62 0.74 -0.23 0.00 0.00 178.00 179.04 2bns h PHE 201 N 0.00 0.00 -0.57 1.56 0.04 -1.92 -1.19 116.94 114.87 2bns h PHE 201 Ca -0.00 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.68 2bns h PHE 201 Cb 0.26 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.39 2bns h PHE 201 CO 0.00 0.62 -0.00 1.25 -0.60 0.00 0.00 178.31 179.58 2bns h HIS 202 N 0.00 1.09 -0.20 -0.55 2.76 -1.44 -1.62 115.15 115.19 2bns h HIS 202 Ca -0.01 -0.19 -0.06 0.00 -2.20 0.00 0.00 60.37 57.91 2bns h HIS 202 Cb 1.17 -0.28 -0.00 0.00 1.55 0.00 0.00 27.41 29.84 2bns h HIS 202 CO 0.00 0.98 -0.11 0.78 -1.30 0.00 0.00 177.93 178.28 2bns h GLY 203 N 0.89 0.47 0.60 5.26 0.00 -1.30 -0.46 103.07 108.52 2bns h GLY 203 Ca 0.16 -0.43 0.05 0.00 0.00 0.00 0.00 47.33 47.11 2bns h GLY 203 CO 0.03 0.39 0.09 1.41 0.00 0.00 0.00 176.54 178.46 2bns h LEU 204 N 0.13 0.06 -0.91 3.11 3.38 -1.30 -0.52 115.31 119.25 2bns h LEU 204 Ca 0.04 0.05 0.10 0.00 0.09 0.00 0.00 57.88 58.17 2bns h LEU 204 Cb 0.61 0.06 -0.08 0.00 0.09 0.00 0.00 40.66 41.34 2bns h LEU 204 CO 0.03 0.07 0.55 -1.28 0.09 0.00 0.00 178.44 177.90 2bns h SER 205 N 0.23 0.81 -0.29 -0.43 0.87 -0.86 -0.61 113.55 113.26 2bns h SER 205 Ca 0.17 0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 60.71 2bns h SER 205 Cb 0.18 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 2bns h SER 205 CO -0.21 0.46 -0.07 0.40 -0.53 0.00 0.00 176.83 176.88 2bns h ILE 206 N 0.91 1.28 -0.84 2.23 2.04 -0.92 0.13 117.51 122.35 2bns h ILE 206 Ca 0.44 -1.11 0.15 0.00 1.00 0.00 0.00 64.86 65.34 2bns h ILE 206 Cb 0.38 1.40 -0.10 0.00 -0.74 0.00 0.00 36.82 37.76 2bns h ILE 206 CO -0.24 0.35 0.41 0.00 0.00 0.00 0.00 178.15 178.67 2bns h ALA 207 N 0.79 1.26 0.00 1.87 0.00 -0.06 0.20 119.26 123.31 2bns h ALA 207 Ca 0.07 0.10 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 2bns h ALA 207 Cb 0.56 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2bns h ALA 207 CO 0.03 -0.13 -0.85 0.74 0.00 0.00 0.00 179.25 179.04 2bns h PHE 208 N 0.58 0.00 0.26 0.00 0.04 -0.97 0.17 116.94 117.02 2bns h PHE 208 Ca 0.46 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 61.22 2bns h PHE 208 Cb 0.68 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.83 2bns h PHE 208 CO -0.11 0.72 -0.13 1.25 -0.60 0.00 0.00 178.31 179.45 2bns h LEU 209 N 0.00 -0.30 0.01 1.54 5.85 0.01 0.14 115.31 122.57 2bns h LEU 209 Ca -0.04 -0.22 0.03 0.00 0.84 0.00 0.00 57.88 58.49 2bns h LEU 209 Cb 1.58 0.08 -0.05 0.00 0.37 0.00 0.00 40.66 42.65 2bns h LEU 209 CO 0.09 0.10 -0.28 1.88 -0.34 0.00 0.00 178.44 179.89 2bns h TYR 210 N -0.75 -0.76 -0.21 1.25 0.05 -0.72 -2.56 116.97 113.27 2bns h TYR 210 Ca -0.04 0.02 0.06 0.00 0.05 0.00 0.00 58.73 58.83 2bns h TYR 210 Cb 0.50 0.33 -0.01 0.00 1.01 0.00 0.00 36.73 38.56 2bns h TYR 210 CO 0.04 -0.37 0.21 0.78 -1.05 0.00 0.00 178.16 177.77 2bns h GLY 211 N -0.43 0.00 1.58 3.88 0.00 -0.68 0.18 103.07 107.59 2bns h GLY 211 Ca 0.06 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.23 2bns h GLY 211 CO -0.23 0.00 -0.59 1.76 0.00 0.00 0.00 176.54 177.48 2bns h SER 212 N 0.00 0.49 0.35 0.19 0.02 -0.32 -1.02 113.55 113.25 2bns h SER 212 Ca 0.10 -0.28 -0.20 0.00 -0.84 0.00 0.00 61.79 60.58 2bns h SER 212 Cb 0.53 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.92 2bns h SER 212 CO -0.00 0.97 -0.81 0.00 -1.14 0.00 0.00 176.83 175.85 2bns h ALA 213 N 1.03 0.53 -0.01 3.77 0.00 -0.40 -2.06 119.26 122.12 2bns h ALA 213 Ca -0.00 -0.66 -0.00 0.00 0.00 0.00 0.00 54.91 54.25 2bns h ALA 213 Cb 1.12 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 2bns h ALA 213 CO 0.10 0.80 0.01 1.25 0.00 0.00 0.00 179.25 181.41 2bns h LEU 214 N 0.23 0.01 -0.31 0.00 5.85 -1.07 -1.73 115.31 118.29 2bns h LEU 214 Ca -0.05 -0.06 -0.20 0.00 0.84 0.00 0.00 57.88 58.41 2bns h LEU 214 Cb 1.41 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.44 2bns h LEU 214 CO 0.14 0.07 -0.75 0.25 -0.34 0.00 0.00 178.44 177.81 2bns h LEU 215 N -0.05 0.66 -0.57 2.25 5.85 -1.21 -0.47 115.31 121.77 2bns h LEU 215 Ca 0.00 -0.43 -0.16 0.00 0.84 0.00 0.00 57.88 58.13 2bns h LEU 215 Cb 0.06 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 2bns h LEU 215 CO -0.00 1.20 -0.68 0.15 -0.34 0.00 0.00 178.44 178.76 2bns h PHE 216 N 0.38 0.21 -0.44 1.25 3.04 -1.41 -0.11 116.94 119.86 2bns h PHE 216 Ca -0.04 -0.09 -0.04 0.00 3.98 0.00 0.00 57.97 61.78 2bns h PHE 216 Cb 1.35 -0.03 -0.02 0.00 2.56 0.00 0.00 35.95 39.80 2bns h PHE 216 CO 0.06 0.79 0.12 0.00 -2.02 0.00 0.00 178.31 177.26 2bns h ALA 217 N 1.18 0.58 -0.65 2.41 0.00 -1.20 0.14 119.26 121.72 2bns h ALA 217 Ca -0.01 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 2bns h ALA 217 Cb 1.22 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 2bns h ALA 217 CO 0.10 0.24 0.25 0.52 0.00 0.00 0.00 179.25 180.37 2bns h MET 218 N 0.57 0.98 0.22 0.00 2.86 -0.94 -1.78 114.93 116.85 2bns h MET 218 Ca 0.14 -0.18 -0.34 0.00 -2.06 0.00 0.00 59.70 57.26 2bns h MET 218 Cb 0.29 -0.16 0.02 0.00 0.06 0.00 0.00 31.60 31.82 2bns h MET 218 CO -0.00 0.83 -1.58 1.25 1.06 0.00 0.00 176.91 178.46 2bns h HIS 219 N 0.92 0.84 0.29 -0.22 -0.00 -0.97 -2.07 115.15 113.95 2bns h HIS 219 Ca 0.22 -0.62 -0.01 0.00 -0.00 0.00 0.00 60.37 59.96 2bns h HIS 219 Cb 0.22 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 27.59 2bns h HIS 219 CO 0.01 1.61 -0.18 0.78 -0.00 0.00 0.00 177.93 180.15 2bns h GLY 220 N 0.35 -0.47 0.59 5.26 0.00 -0.76 -1.67 103.07 106.37 2bns h GLY 220 Ca -0.30 0.20 0.07 0.00 0.00 0.00 0.00 47.33 47.31 2bns h GLY 220 CO 0.22 -0.19 0.36 0.00 0.00 0.00 0.00 176.54 176.94 2bns h ALA 221 N 0.23 0.93 0.15 3.60 0.00 -1.43 -1.96 119.26 120.78 2bns h ALA 221 Ca -0.03 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2bns h ALA 221 Cb 0.38 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2bns h ALA 221 CO 0.03 0.01 -0.07 1.15 0.00 0.00 0.00 179.25 180.36 2bns h THR 222 N 0.65 0.89 -0.50 0.00 2.02 -1.20 0.17 112.91 114.93 2bns h THR 222 Ca 0.32 -0.14 -0.08 0.00 0.77 0.00 0.00 66.41 67.28 2bns h THR 222 Cb 0.26 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 2bns h THR 222 CO -0.22 0.03 -0.03 0.40 0.37 0.00 0.00 175.52 176.08 2bns h ILE 223 N -0.26 1.25 -0.43 3.11 1.08 -1.15 -1.56 117.51 119.55 2bns h ILE 223 Ca -0.02 -1.08 -0.10 0.00 -0.39 0.00 0.00 64.86 63.27 2bns h ILE 223 Cb 0.21 0.90 -0.01 0.00 -3.07 0.00 0.00 36.82 34.84 2bns h ILE 223 CO 0.03 0.38 -0.11 -0.07 -0.69 0.00 0.00 178.15 177.70 2bns h LEU 224 N 0.79 0.83 -2.29 1.44 3.38 -1.15 -0.91 115.31 117.40 2bns h LEU 224 Ca 0.15 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.75 2bns h LEU 224 Cb 0.51 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 2bns h LEU 224 CO 0.03 1.01 0.01 0.00 0.09 0.00 0.00 178.44 179.57 2bns h ALA 225 N 0.86 1.71 -0.44 1.53 0.00 0.00 -1.28 119.26 121.64 2bns h ALA 225 Ca 0.11 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2bns h ALA 225 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2bns h ALA 225 CO 0.04 -0.01 0.00 1.33 0.00 0.00 0.00 179.25 180.61 2bns n VAL 226 N -4.10 1.54 0.26 0.00 0.24 -0.65 -4.54 118.33 111.08 2bns n VAL 226 Ca -0.03 -1.27 0.12 0.00 -2.04 0.00 0.00 64.34 61.12 2bns n VAL 226 Cb 0.09 0.22 0.69 0.00 -1.47 0.00 0.00 33.84 33.36 2bns n VAL 226 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 2bns h SER 227 N 2.69 0.00 0.22 -1.34 4.64 0.07 -0.98 113.55 118.85 2bns h SER 227 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2bns h SER 227 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 2bns h SER 227 CO 0.12 0.14 0.00 0.08 -0.87 0.00 0.00 176.83 176.29 2bns h ARG 228 N 0.00 0.00 -0.18 4.77 0.11 -1.80 -0.97 114.38 116.31 2bns h ARG 228 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2bns h ARG 228 Cb 0.39 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.47 2bns h ARG 228 CO 0.02 0.00 0.00 1.19 0.10 0.00 0.00 179.97 181.28 2bns n PHE 229 N -2.37 0.63 -1.99 4.08 3.72 -0.43 -4.99 117.46 116.11 2bns n PHE 229 Ca -0.01 -0.90 -0.08 0.00 -0.05 0.00 0.00 57.45 56.41 2bns n PHE 229 Cb 0.10 -0.25 -0.01 0.00 -0.94 0.00 0.00 39.48 38.37 2bns n PHE 229 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2bns n GLY 230 N -0.77 0.21 0.27 1.37 0.00 -0.37 -4.43 105.19 101.47 2bns n GLY 230 Ca 0.19 -0.55 0.13 0.00 0.00 0.00 0.00 46.02 45.78 2bns n GLY 230 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2bns h GLY 231 N 0.00 0.00 2.00 -0.02 0.00 -1.59 -2.59 103.07 100.88 2bns h GLY 231 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.13 2bns h GLY 231 CO 0.24 0.00 0.00 1.05 0.00 0.00 0.00 176.54 177.83 2bns h GLU 232 N 0.00 0.00 -4.13 4.80 9.09 -1.84 -3.31 114.58 119.20 2bns h GLU 232 Ca -0.00 0.00 -0.71 0.00 0.05 0.00 0.00 59.36 58.70 2bns h GLU 232 Cb 0.29 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.35 2bns h GLU 232 CO 0.01 0.00 3.06 0.54 0.05 0.00 0.00 179.01 182.67 2bns n ARG 233 N -2.33 2.83 -0.22 1.06 1.74 -0.98 -4.76 116.66 114.01 2bns n ARG 233 Ca 0.02 -2.62 -0.09 0.00 -0.77 0.00 0.00 57.85 54.40 2bns n ARG 233 Cb 0.24 -3.29 0.03 0.00 -1.02 0.00 0.00 32.46 28.41 2bns n ARG 233 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 2bns h GLU 234 N 6.16 1.04 -0.70 5.56 5.08 -1.86 -2.77 114.58 127.09 2bns h GLU 234 Ca 0.56 -0.30 -0.02 0.00 -1.00 0.00 0.00 59.36 58.59 2bns h GLU 234 Cb 0.65 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 2bns h GLU 234 CO 1.87 0.99 0.35 -0.07 -1.00 0.00 0.00 179.01 181.14 2bns h LEU 235 N 0.94 0.88 -0.29 1.33 3.38 -1.92 -0.63 115.31 119.00 2bns h LEU 235 Ca 0.18 -0.09 -0.19 0.00 0.09 0.00 0.00 57.88 57.88 2bns h LEU 235 Cb 0.49 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2bns h LEU 235 CO 0.02 0.74 -0.87 -0.33 0.09 0.00 0.00 178.44 178.09 2bns h GLU 236 N 0.98 0.08 0.00 1.13 4.39 -1.89 -2.74 114.58 116.53 2bns h GLU 236 Ca 0.24 -0.10 -0.06 0.00 0.34 0.00 0.00 59.36 59.78 2bns h GLU 236 Cb 0.08 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.75 2bns h GLU 236 CO -0.03 0.90 -0.29 1.96 -1.16 0.00 0.00 179.01 180.38 2bns h GLN 237 N 0.04 0.00 -0.24 2.33 1.08 -1.16 -0.91 115.11 116.25 2bns h GLN 237 Ca -0.03 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 56.98 2bns h GLN 237 Cb 1.51 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.94 2bns h GLN 237 CO 0.12 0.29 -0.62 0.82 -0.95 0.00 0.00 178.83 178.50 2bns h ILE 238 N 0.00 1.28 0.00 2.54 2.04 -0.94 -2.66 117.51 119.76 2bns h ILE 238 Ca -0.00 -1.81 -0.13 0.00 1.00 0.00 0.00 64.86 63.92 2bns h ILE 238 Cb 0.59 1.74 -0.02 0.00 -0.74 0.00 0.00 36.82 38.39 2bns h ILE 238 CO 0.04 0.58 -0.62 0.00 0.00 0.00 0.00 178.15 178.15 2bns h ALA 239 N 0.67 0.64 -1.17 1.87 0.00 -1.31 -3.41 119.26 116.55 2bns h ALA 239 Ca -0.01 -0.57 -0.17 0.00 0.00 0.00 0.00 54.91 54.17 2bns h ALA 239 Cb 1.23 -0.10 -0.20 0.00 0.00 0.00 0.00 17.79 18.72 2bns h ALA 239 CO 0.13 0.78 -0.53 0.34 0.00 0.00 0.00 179.25 179.98 2bns s ASP 240 N -6.54 -1.06 -0.03 0.00 2.15 -0.36 -5.11 116.67 105.72 2bns s ASP 240 Ca 0.02 -1.46 -0.38 0.00 0.43 0.00 0.00 52.55 51.17 2bns s ASP 240 Cb 0.09 1.65 -0.16 0.00 -0.30 0.00 0.00 42.92 44.20 2bns s ASP 240 CO 0.76 -0.12 1.49 -1.14 -0.17 0.00 0.00 175.17 175.99 2bns n ARG 241 N 3.60 1.22 -3.64 4.34 0.63 -1.00 -4.31 116.66 117.50 2bns n ARG 241 Ca 0.16 0.44 -0.23 0.00 -0.92 0.00 0.00 57.85 57.30 2bns n ARG 241 Cb 0.55 -2.11 -0.01 0.00 0.45 0.00 0.00 32.46 31.34 2bns n ARG 241 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2bns s GLY 242 N 1.55 2.19 0.58 5.14 0.00 -1.26 -5.01 107.32 110.51 2bns s GLY 242 Ca 0.89 -1.67 0.34 0.00 0.00 0.00 0.00 44.72 44.27 2bns s GLY 242 CO 0.52 -1.80 2.18 0.00 0.00 0.00 0.00 173.10 174.00 2bns h THR 243 N 0.81 0.31 0.14 0.90 1.03 -1.94 -2.02 112.91 112.13 2bns h THR 243 Ca -0.38 -0.29 0.02 0.00 -0.01 0.00 0.00 66.41 65.75 2bns h THR 243 Cb 1.28 1.21 -0.03 0.00 -1.07 0.00 0.00 68.15 69.54 2bns h THR 243 CO 0.55 0.05 -0.26 0.00 -0.01 0.00 0.00 175.52 175.85 2bns h ALA 244 N 1.95 -0.45 -0.51 0.00 0.00 -1.89 -1.21 119.26 117.16 2bns h ALA 244 Ca -0.00 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 2bns h ALA 244 Cb 0.21 0.41 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2bns h ALA 244 CO 0.01 -0.80 0.11 0.00 0.00 0.00 0.00 179.25 178.57 2bns h ALA 245 N 0.25 1.24 -0.11 0.00 0.00 -1.74 -1.92 119.26 116.98 2bns h ALA 245 Ca 0.03 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 2bns h ALA 245 Cb 0.49 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2bns h ALA 245 CO -0.14 0.52 -0.09 0.93 0.00 0.00 0.00 179.25 180.47 2bns h GLU 246 N 0.75 0.26 -0.69 0.00 5.08 -1.38 -1.90 114.58 116.70 2bns h GLU 246 Ca 0.17 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 2bns h GLU 246 Cb 0.29 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 2bns h GLU 246 CO -0.00 0.65 0.29 0.00 -1.00 0.00 0.00 179.01 178.96 2bns h ARG 247 N -0.12 1.00 -0.17 2.33 3.08 -1.16 -0.33 114.38 119.00 2bns h ARG 247 Ca 0.02 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 59.90 2bns h ARG 247 Cb 0.60 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.46 2bns h ARG 247 CO 0.02 0.80 0.07 0.00 -1.07 0.00 0.00 179.97 179.79 2bns h ALA 248 N 1.34 0.22 -0.36 0.04 0.00 -1.30 0.64 119.26 119.83 2bns h ALA 248 Ca 0.23 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2bns h ALA 248 Cb 0.16 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2bns h ALA 248 CO -0.02 -0.19 0.17 0.00 0.00 0.00 0.00 179.25 179.21 2bns h ALA 249 N 0.91 0.46 -0.17 0.00 0.00 -1.23 -2.84 119.26 116.39 2bns h ALA 249 Ca 0.06 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.77 2bns h ALA 249 Cb 0.17 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2bns h ALA 249 CO -0.00 0.03 -0.30 -0.07 0.00 0.00 0.00 179.25 178.90 2bns h LEU 250 N 0.44 0.34 -0.43 0.00 3.38 -0.93 0.00 115.31 118.11 2bns h LEU 250 Ca 0.12 -0.12 0.07 0.00 0.09 0.00 0.00 57.88 58.05 2bns h LEU 250 Cb 0.12 -0.09 -0.06 0.00 0.09 0.00 0.00 40.66 40.72 2bns h LEU 250 CO -0.02 0.63 0.06 0.15 0.09 0.00 0.00 178.44 179.36 2bns h PHE 251 N 0.29 0.09 0.05 1.13 3.57 -0.64 -1.51 116.94 119.93 2bns h PHE 251 Ca 0.04 0.03 -0.25 0.00 3.53 0.00 0.00 57.97 61.31 2bns h PHE 251 Cb 0.68 0.02 0.01 0.00 2.79 0.00 0.00 35.95 39.46 2bns h PHE 251 CO 0.02 -0.02 -1.07 -1.49 -2.23 0.00 0.00 178.31 173.52 2bns h TRP 252 N 0.19 0.72 -0.39 0.41 4.06 -1.22 -2.22 115.95 117.50 2bns h TRP 252 Ca 0.21 -0.43 0.03 0.00 2.06 0.00 0.00 58.89 60.77 2bns h TRP 252 Cb 0.28 -0.07 -0.03 0.00 -1.00 0.00 0.00 29.16 28.34 2bns h TRP 252 CO -0.23 1.27 0.19 -0.09 -3.56 0.00 0.00 178.44 176.01 2bns h ARG 253 N 0.23 0.37 0.00 0.49 2.43 -0.90 0.84 114.38 117.84 2bns h ARG 253 Ca -0.12 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.01 2bns h ARG 253 Cb 1.73 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 31.19 2bns h ARG 253 CO 0.19 0.24 -0.11 -1.49 -1.51 0.00 0.00 179.97 177.29 2bns h TRP 254 N 0.38 0.00 0.00 2.20 6.55 -1.30 0.27 115.95 124.05 2bns h TRP 254 Ca 0.17 0.00 -0.16 0.00 0.95 0.00 0.00 58.89 59.85 2bns h TRP 254 Cb 0.08 0.00 -0.02 0.00 -0.86 0.00 0.00 29.16 28.36 2bns h TRP 254 CO -0.11 0.11 -0.94 1.15 -1.05 0.00 0.00 178.44 177.60 2bns h THR 255 N 0.00 0.80 -0.01 1.49 2.02 -0.89 -3.43 112.91 112.90 2bns h THR 255 Ca -0.00 -1.93 0.00 0.00 0.77 0.00 0.00 66.41 65.25 2bns h THR 255 Cb 0.68 1.84 0.00 0.00 -1.74 0.00 0.00 68.15 68.93 2bns h THR 255 CO 0.01 0.27 0.00 1.15 0.37 0.00 0.00 175.52 177.33 2bns n MET 256 N -4.50 0.74 -0.34 6.66 0.00 0.24 -5.02 117.12 114.91 2bns n MET 256 Ca -0.24 -0.95 0.00 0.00 0.00 0.00 0.00 57.70 56.51 2bns n MET 256 Cb 0.56 -1.01 0.00 0.00 0.00 0.00 0.00 33.22 32.77 2bns n MET 256 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2bns n GLY 257 N -0.18 1.03 3.67 3.17 0.00 0.95 -5.00 105.19 108.84 2bns n GLY 257 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 2bns n GLY 257 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2bns s PHE 258 N -2.86 0.29 0.34 1.61 -0.71 -1.25 -4.91 117.98 110.49 2bns s PHE 258 Ca 0.00 -0.70 -0.12 0.00 -1.04 0.00 0.00 56.93 55.07 2bns s PHE 258 Cb 0.00 0.37 0.03 0.00 -1.21 0.00 0.00 43.02 42.21 2bns s PHE 258 CO 0.00 -1.15 0.65 0.54 -1.34 0.00 0.00 175.22 173.91 2bns s ASN 259 N -3.03 0.23 0.40 1.98 4.22 -1.26 -3.01 114.94 114.46 2bns s ASN 259 Ca 0.20 -1.15 0.02 0.00 -2.14 0.00 0.00 52.86 49.79 2bns s ASN 259 Cb -0.03 0.75 0.02 0.00 1.28 0.00 0.00 41.25 43.27 2bns s ASN 259 CO 0.10 -1.46 0.14 0.00 -2.04 0.00 0.00 177.10 173.85 2bns n ALA 260 N -0.51 0.47 -2.56 3.54 0.00 -1.26 -5.05 120.51 115.14 2bns n ALA 260 Ca -0.04 -1.70 -0.23 0.00 0.00 0.00 0.00 53.44 51.46 2bns n ALA 260 Cb 0.61 0.83 -0.07 0.00 0.00 0.00 0.00 19.45 20.82 2bns n ALA 260 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2bns s THR 261 N -2.24 3.15 0.34 0.00 -4.23 -1.26 -4.74 115.64 106.66 2bns s THR 261 Ca 0.11 -1.77 0.12 0.00 -1.18 0.00 0.00 61.69 58.98 2bns s THR 261 Cb -0.01 -2.94 0.33 0.00 1.34 0.00 0.00 72.50 71.22 2bns s THR 261 CO 0.07 -0.24 1.72 -0.03 -0.54 0.00 0.00 174.62 175.60 2bns h MET 262 N 1.66 0.48 0.08 3.99 4.05 -1.91 -1.55 114.93 121.72 2bns h MET 262 Ca -0.44 -0.03 -0.16 0.00 -0.28 0.00 0.00 59.70 58.80 2bns h MET 262 Cb 1.25 -0.11 0.02 0.00 -0.80 0.00 0.00 31.60 31.96 2bns h MET 262 CO 0.63 0.32 -0.66 1.49 0.23 0.00 0.00 176.91 178.92 2bns h GLU 263 N 0.49 0.31 0.00 0.39 4.81 -1.94 -3.38 114.58 115.26 2bns h GLU 263 Ca 0.66 -0.44 -0.09 0.00 -0.13 0.00 0.00 59.36 59.36 2bns h GLU 263 Cb 1.39 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.90 2bns h GLU 263 CO -0.47 1.16 -0.45 0.78 -0.73 0.00 0.00 179.01 179.31 2bns h GLY 264 N -0.34 0.00 1.95 1.92 0.00 -1.83 -2.06 103.07 102.71 2bns h GLY 264 Ca -0.11 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.21 2bns h GLY 264 CO 0.13 0.00 -0.03 1.19 0.00 0.00 0.00 176.54 177.83 2bns h ILE 265 N 0.00 1.05 0.00 2.60 6.09 -1.47 -1.19 117.51 124.60 2bns h ILE 265 Ca -0.00 -0.22 0.00 0.00 -1.37 0.00 0.00 64.86 63.27 2bns h ILE 265 Cb 0.95 1.05 0.00 0.00 0.47 0.00 0.00 36.82 39.28 2bns h ILE 265 CO 0.06 0.07 0.00 0.45 -3.07 0.00 0.00 178.15 175.66 2bns h HIS 266 N 0.07 0.00 -0.01 2.19 3.86 -1.55 -1.30 115.15 118.40 2bns h HIS 266 Ca 0.02 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.13 2bns h HIS 266 Cb 0.09 0.00 0.01 0.00 1.06 0.00 0.00 27.41 28.57 2bns h HIS 266 CO 0.00 0.00 -0.38 0.00 0.86 0.00 0.00 177.93 178.41 2bns h ARG 267 N 0.00 0.27 -0.87 2.45 3.08 -1.26 -1.84 114.38 116.21 2bns h ARG 267 Ca 0.00 -0.28 0.21 0.00 0.07 0.00 0.00 59.98 59.98 2bns h ARG 267 Cb 0.86 0.08 -0.13 0.00 0.08 0.00 0.00 29.97 30.86 2bns h ARG 267 CO 0.00 0.98 0.32 -1.49 -1.07 0.00 0.00 179.97 178.71 2bns h TRP 268 N -0.34 0.51 0.01 3.04 4.06 -1.28 -2.17 115.95 119.78 2bns h TRP 268 Ca -0.05 0.04 -0.00 0.00 2.06 0.00 0.00 58.89 60.95 2bns h TRP 268 Cb 1.11 -0.09 0.00 0.00 -1.00 0.00 0.00 29.16 29.18 2bns h TRP 268 CO 0.16 -0.10 -0.00 0.00 -3.56 0.00 0.00 178.44 174.94 2bns h ALA 269 N 1.71 -0.01 -0.43 1.49 0.00 -1.20 0.14 119.26 120.95 2bns h ALA 269 Ca 0.53 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 55.19 2bns h ALA 269 Cb 1.02 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 2bns h ALA 269 CO -0.56 -0.32 -0.00 0.97 0.00 0.00 0.00 179.25 179.34 2bns h ILE 270 N -0.40 1.23 0.02 0.00 2.10 -1.08 -2.49 117.51 116.89 2bns h ILE 270 Ca -0.00 -0.94 -0.24 0.00 1.08 0.00 0.00 64.86 64.76 2bns h ILE 270 Cb 0.39 0.90 0.02 0.00 -1.09 0.00 0.00 36.82 37.04 2bns h ILE 270 CO 0.00 0.33 -0.94 -0.50 -1.08 0.00 0.00 178.15 175.96 2bns h TRP 271 N 0.66 0.91 -0.24 2.19 4.06 -1.38 -1.17 115.95 120.97 2bns h TRP 271 Ca 0.13 -0.51 0.06 0.00 2.06 0.00 0.00 58.89 60.63 2bns h TRP 271 Cb 0.41 -0.10 -0.07 0.00 -1.00 0.00 0.00 29.16 28.41 2bns h TRP 271 CO 0.02 1.34 -0.26 1.98 -3.56 0.00 0.00 178.44 177.97 2bns h MET 272 N 0.21 -0.26 -0.09 0.49 4.05 -0.77 -0.95 114.93 117.62 2bns h MET 272 Ca -0.12 0.02 -0.02 0.00 -0.28 0.00 0.00 59.70 59.30 2bns h MET 272 Cb 1.62 0.06 -0.00 0.00 -0.80 0.00 0.00 31.60 32.48 2bns h MET 272 CO 0.18 -0.17 -0.01 0.00 0.23 0.00 0.00 176.91 177.15 2bns h ALA 273 N 0.75 0.12 -0.55 0.39 0.00 -1.51 -3.19 119.26 115.27 2bns h ALA 273 Ca 0.13 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.90 2bns h ALA 273 Cb 0.48 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 2bns h ALA 273 CO -0.39 -0.18 0.36 0.28 0.00 0.00 0.00 179.25 179.32 2bns h VAL 274 N -0.14 1.01 0.00 0.00 2.07 -1.04 -2.04 116.25 116.12 2bns h VAL 274 Ca 0.02 -0.19 -0.08 0.00 0.82 0.00 0.00 66.70 67.28 2bns h VAL 274 Cb 0.38 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 2bns h VAL 274 CO 0.01 0.10 -0.38 -0.07 0.02 0.00 0.00 177.57 177.25 2bns h LEU 275 N 0.55 0.00 -0.10 2.57 3.38 -1.16 -2.17 115.31 118.37 2bns h LEU 275 Ca 0.23 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.23 2bns h LEU 275 Cb 0.22 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.91 2bns h LEU 275 CO -0.06 0.38 -0.49 0.58 0.09 0.00 0.00 178.44 178.93 2bns h VAL 276 N 0.00 0.06 0.00 1.22 2.07 -1.40 -1.14 116.25 117.05 2bns h VAL 276 Ca -0.00 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.47 2bns h VAL 276 Cb 0.70 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 2bns h VAL 276 CO 0.05 0.00 -0.52 0.71 0.02 0.00 0.00 177.57 177.83 2bns h THR 277 N -0.57 0.25 0.10 2.57 1.35 -1.67 -2.36 112.91 112.59 2bns h THR 277 Ca 0.05 -1.38 -0.00 0.00 -0.55 0.00 0.00 66.41 64.52 2bns h THR 277 Cb 0.67 1.97 0.00 0.00 -1.73 0.00 0.00 68.15 69.07 2bns h THR 277 CO -0.41 0.14 -0.05 0.25 -0.25 0.00 0.00 175.52 175.21 2bns h LEU 278 N 0.00 -0.11 -0.28 3.87 5.85 -1.20 -0.94 115.31 122.49 2bns h LEU 278 Ca -0.02 -0.39 -0.02 0.00 0.84 0.00 0.00 57.88 58.29 2bns h LEU 278 Cb 1.15 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 2bns h LEU 278 CO 0.02 0.36 0.09 0.71 -0.34 0.00 0.00 178.44 179.28 2bns h THR 279 N -0.62 1.20 -0.76 1.05 1.35 -1.32 -2.69 112.91 111.11 2bns h THR 279 Ca -0.01 -0.65 0.02 0.00 -0.55 0.00 0.00 66.41 65.22 2bns h THR 279 Cb 0.50 1.09 -0.04 0.00 -1.73 0.00 0.00 68.15 67.97 2bns h THR 279 CO 0.02 0.21 0.51 1.23 -0.25 0.00 0.00 175.52 177.24 2bns h GLY 280 N 0.30 1.07 1.14 5.82 0.00 -1.45 -1.67 103.07 108.28 2bns h GLY 280 Ca 0.09 -0.38 -0.07 0.00 0.00 0.00 0.00 47.33 46.96 2bns h GLY 280 CO -0.00 0.35 0.10 -1.33 0.00 0.00 0.00 176.54 175.66 2bns h GLY 281 N 0.98 1.13 1.02 4.60 0.00 -1.05 -2.05 103.07 107.69 2bns h GLY 281 Ca 0.29 -0.74 -0.04 0.00 0.00 0.00 0.00 47.33 46.84 2bns h GLY 281 CO -0.08 0.68 0.24 -2.22 0.00 0.00 0.00 176.54 175.16 2bns h ILE 282 N 0.99 1.24 -0.48 2.60 2.04 -1.00 -1.03 117.51 121.86 2bns h ILE 282 Ca 0.20 -0.80 -0.08 0.00 1.00 0.00 0.00 64.86 65.18 2bns h ILE 282 Cb 0.42 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 2bns h ILE 282 CO 0.01 0.31 -0.03 1.23 0.00 0.00 0.00 178.15 179.67 2bns h GLY 283 N 0.93 0.89 0.84 5.37 0.00 -1.03 -1.54 103.07 108.54 2bns h GLY 283 Ca 0.21 -0.62 -0.15 0.00 0.00 0.00 0.00 47.33 46.77 2bns h GLY 283 CO -0.01 0.57 -0.56 -2.22 0.00 0.00 0.00 176.54 174.32 2bns h ILE 284 N 0.76 1.39 -0.94 2.60 1.08 -1.34 -2.89 117.51 118.17 2bns h ILE 284 Ca 0.14 -1.95 0.18 0.00 -0.39 0.00 0.00 64.86 62.83 2bns h ILE 284 Cb 0.50 2.39 -0.10 0.00 -3.07 0.00 0.00 36.82 36.54 2bns h ILE 284 CO 0.03 0.58 0.53 0.25 -0.69 0.00 0.00 178.15 178.84 2bns h LEU 285 N 0.02 0.66 -0.18 1.44 5.85 -0.98 -1.78 115.31 120.33 2bns h LEU 285 Ca -0.06 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.76 2bns h LEU 285 Cb 1.24 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.26 2bns h LEU 285 CO 0.11 0.24 0.00 -0.07 -0.34 0.00 0.00 178.44 178.38 2bns h LEU 286 N 0.69 0.00 -9.12 2.25 3.38 -1.31 -3.40 115.31 107.79 2bns h LEU 286 Ca 0.53 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.94 2bns h LEU 286 Cb 0.82 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.52 2bns h LEU 286 CO -0.39 0.00 0.90 -0.44 0.09 0.00 0.00 178.44 178.61 2bns s SER 287 N -5.92 6.93 0.00 -0.43 0.01 -0.67 -2.21 113.70 111.41 2bns s SER 287 Ca 0.07 1.62 0.00 0.00 1.31 0.00 0.00 55.95 58.94 2bns s SER 287 Cb 0.06 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.76 2bns s SER 287 CO 0.64 -0.79 0.00 0.61 0.41 0.00 0.00 173.24 174.11 2bns n GLY 288 N 3.66 2.24 0.11 3.44 0.00 -0.59 -4.75 105.19 109.31 2bns n GLY 288 Ca 0.14 -0.34 -0.07 0.00 0.00 0.00 0.00 46.02 45.75 2bns n GLY 288 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2bns h THR 289 N 0.00 1.54 0.00 2.61 1.35 -1.77 -3.43 112.91 113.21 2bns h THR 289 Ca 0.00 -2.72 0.00 0.00 -0.55 0.00 0.00 66.41 63.14 2bns h THR 289 Cb 0.00 2.50 0.00 0.00 -1.73 0.00 0.00 68.15 68.92 2bns h THR 289 CO 0.00 0.79 -0.42 0.52 -0.25 0.00 0.00 175.52 176.15 2bns n VAL 290 N -3.61 0.00 -4.23 6.82 0.31 -1.03 -5.05 118.33 111.55 2bns n VAL 290 Ca -0.02 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 63.99 2bns n VAL 290 Cb 0.81 -0.49 -0.16 0.00 -0.91 0.00 0.00 33.84 33.09 2bns n VAL 290 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2bns s VAL 291 N -1.65 1.89 0.09 2.52 1.01 -0.94 -5.01 120.40 118.32 2bns s VAL 291 Ca 0.00 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.15 2bns s VAL 291 Cb 0.00 -1.71 -0.25 0.00 0.00 0.00 0.00 36.38 34.42 2bns s VAL 291 CO 0.00 0.51 1.18 0.44 0.00 0.00 0.00 175.10 177.23 2bns h ASP 292 N 7.81 0.20 -3.06 3.32 3.32 -1.88 -1.57 116.42 124.55 2bns h ASP 292 Ca -0.40 -0.22 -0.43 0.00 0.02 0.00 0.00 57.03 56.00 2bns h ASP 292 Cb 1.15 -0.07 -0.40 0.00 0.22 0.00 0.00 39.33 40.23 2bns h ASP 292 CO 0.58 1.18 -0.74 0.21 -1.72 0.00 0.00 179.24 178.75 2bns s ASN 293 N -6.89 2.01 0.06 6.45 3.84 -1.26 -4.20 114.94 114.96 2bns s ASN 293 Ca -0.02 -0.43 -0.15 0.00 0.21 0.00 0.00 52.86 52.47 2bns s ASN 293 Cb 0.09 -0.16 -0.20 0.00 -0.55 0.00 0.00 41.25 40.42 2bns s ASN 293 CO 0.85 -0.33 1.22 -0.50 -2.79 0.00 0.00 177.10 175.55 2bns h TRP 294 N 8.41 0.92 0.22 0.43 4.06 -1.21 -1.04 115.95 127.74 2bns h TRP 294 Ca -0.15 -0.45 0.00 0.00 2.06 0.00 0.00 58.89 60.36 2bns h TRP 294 Cb 1.14 -0.12 -0.01 0.00 -1.00 0.00 0.00 29.16 29.17 2bns h TRP 294 CO 0.22 1.27 -0.20 -0.92 -3.56 0.00 0.00 178.44 175.25 2bns h TYR 295 N 0.30 -0.52 0.03 0.49 3.20 -1.51 -0.25 116.97 118.72 2bns h TYR 295 Ca -0.08 0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.82 2bns h TYR 295 Cb 1.43 0.20 -0.03 0.00 1.54 0.00 0.00 36.73 39.87 2bns h TYR 295 CO 0.11 -0.30 -0.19 0.28 -1.64 0.00 0.00 178.16 176.42 2bns h VAL 296 N -0.44 0.56 -0.99 1.81 2.07 -1.83 -1.91 116.25 115.52 2bns h VAL 296 Ca -0.01 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.71 2bns h VAL 296 Cb 0.41 0.56 -0.11 0.00 -1.52 0.00 0.00 31.29 30.62 2bns h VAL 296 CO -0.03 0.00 0.59 -0.25 0.02 0.00 0.00 177.57 177.89 2bns h TRP 297 N -0.32 1.03 0.00 1.57 7.01 -1.10 -2.57 115.95 121.56 2bns h TRP 297 Ca 0.05 0.03 -0.05 0.00 2.11 0.00 0.00 58.89 61.03 2bns h TRP 297 Cb 0.38 -0.30 -0.01 0.00 -2.10 0.00 0.00 29.16 27.13 2bns h TRP 297 CO -0.22 0.19 -0.26 0.78 -2.79 0.00 0.00 178.44 176.14 2bns h GLY 298 N 0.71 0.00 1.80 2.65 0.00 -0.25 -2.89 103.07 105.09 2bns h GLY 298 Ca 0.58 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.90 2bns h GLY 298 CO -0.40 0.00 -0.23 1.46 0.00 0.00 0.00 176.54 177.37 2bns h GLN 299 N 0.00 0.00 0.00 4.80 1.08 -1.04 -3.37 115.11 116.58 2bns h GLN 299 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2bns h GLN 299 Cb 0.82 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.25 2bns h GLN 299 CO 0.03 0.03 -0.56 0.09 -0.95 0.00 0.00 178.83 177.47 2bns n ASN 300 N -3.02 1.53 0.00 1.46 5.03 -1.19 -4.95 115.26 114.11 2bns n ASN 300 Ca 0.03 0.46 0.00 0.00 0.87 0.00 0.00 54.58 55.94 2bns n ASN 300 Cb 0.55 -0.77 0.00 0.00 -1.02 0.00 0.00 39.78 38.54 2bns n ASN 300 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 2bns n HIS 301 N -4.17 0.00 0.00 3.10 8.25 -1.10 -5.16 115.22 116.15 2bns n HIS 301 Ca -0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 2bns n HIS 301 Cb 0.29 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.40 2bns n HIS 301 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39