#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n2b s ASP 2 N 0.00 -0.19 -0.26 7.83 3.84 -1.26 -4.97 116.67 121.66 3n2b s ASP 2 Ca 0.00 -0.74 0.09 0.00 -0.00 0.00 0.00 52.55 51.90 3n2b s ASP 2 Cb 0.00 0.74 0.66 0.00 -1.38 0.00 0.00 42.92 42.94 3n2b s ASP 2 CO 0.00 -1.40 1.64 -1.22 -0.00 0.00 0.00 175.17 174.19 3n2b n TYR 3 N -0.47 2.07 -3.43 2.11 4.01 -1.26 -4.76 117.16 115.44 3n2b n TYR 3 Ca -0.05 -0.97 -0.44 0.00 -0.16 0.00 0.00 57.90 56.29 3n2b n TYR 3 Cb 0.59 -0.59 -0.07 0.00 -0.31 0.00 0.00 39.34 38.97 3n2b n TYR 3 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 3n2b s PHE 4 N -2.61 3.36 0.04 -0.72 0.08 -1.26 -0.30 117.98 116.57 3n2b s PHE 4 Ca 0.47 -1.61 -0.05 0.00 0.12 0.00 0.00 56.93 55.86 3n2b s PHE 4 Cb 0.37 -3.65 -0.01 0.00 -0.57 0.00 0.00 43.02 39.16 3n2b s PHE 4 CO 0.12 -1.00 0.08 -0.80 -0.10 0.00 0.00 175.22 173.52 3n2b s ASN 5 N 3.07 0.21 0.33 1.36 -0.87 -0.83 -4.95 114.94 113.26 3n2b s ASN 5 Ca 0.05 -0.60 -0.26 0.00 -1.57 0.00 0.00 52.86 50.48 3n2b s ASN 5 Cb -0.27 0.23 -0.10 0.00 -0.02 0.00 0.00 41.25 41.09 3n2b s ASN 5 CO 0.01 -0.53 0.99 -0.31 -2.57 0.00 0.00 177.10 174.68 3n2b s TYR 6 N -2.84 3.60 0.44 2.20 2.02 -1.26 -1.26 117.35 120.26 3n2b s TYR 6 Ca -0.03 1.75 0.02 0.00 -0.37 0.00 0.00 57.07 58.45 3n2b s TYR 6 Cb 0.00 -3.02 0.02 0.00 -0.40 0.00 0.00 41.96 38.56 3n2b s TYR 6 CO -0.06 -0.06 0.18 1.04 -1.57 0.00 0.00 175.55 175.09 3n2b n GLN 7 N 0.58 0.89 0.04 -0.62 1.13 -0.74 -4.92 117.38 113.74 3n2b n GLN 7 Ca 0.02 -2.96 0.20 0.00 -1.94 0.00 0.00 57.00 52.33 3n2b n GLN 7 Cb 0.49 0.54 0.73 0.00 0.11 0.00 0.00 30.24 32.11 3n2b n GLN 7 CO 0.00 0.00 0.00 1.05 -1.44 0.00 0.00 177.06 176.67 3n2b h GLU 8 N 0.00 0.00 -0.01 -1.09 4.11 -1.97 -1.47 114.58 114.14 3n2b h GLU 8 Ca -0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.11 3n2b h GLU 8 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 3n2b h GLU 8 CO 0.51 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.19 3n2b n ASP 9 N -4.11 0.16 0.00 3.06 3.85 -1.26 -4.91 116.55 113.33 3n2b n ASP 9 Ca 0.08 -1.32 0.00 0.00 -0.71 0.00 0.00 54.79 52.84 3n2b n ASP 9 Cb 0.59 -0.01 0.00 0.00 -1.35 0.00 0.00 41.12 40.36 3n2b n ASP 9 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3n2b n GLY 10 N 0.88 0.69 3.60 6.12 0.00 -0.55 -5.06 105.19 110.87 3n2b n GLY 10 Ca 0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 3n2b n GLY 10 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3n2b s GLN 11 N -0.27 1.92 -0.06 1.61 -2.07 -1.26 -4.20 119.66 115.33 3n2b s GLN 11 Ca 0.00 -2.00 -0.23 0.00 -1.82 0.00 0.00 55.36 51.30 3n2b s GLN 11 Cb 0.00 -1.70 -0.04 0.00 -1.09 0.00 0.00 33.01 30.18 3n2b s GLN 11 CO 0.00 0.04 0.70 -1.17 -1.32 0.00 0.00 175.29 173.53 3n2b s LEU 12 N -3.68 4.33 0.11 2.60 2.96 0.68 -1.78 118.68 123.90 3n2b s LEU 12 Ca 0.34 1.20 0.11 0.00 -0.22 0.00 0.00 54.13 55.55 3n2b s LEU 12 Cb 0.06 -3.08 -0.04 0.00 0.50 0.00 0.00 46.19 43.63 3n2b s LEU 12 CO 0.18 -0.10 -0.26 0.26 -1.32 0.00 0.00 176.35 175.11 3n2b s TRP 13 N 0.71 2.32 -0.35 5.38 0.52 -0.39 -1.83 118.94 125.31 3n2b s TRP 13 Ca 0.37 -0.38 -0.11 0.00 0.02 0.00 0.00 56.10 56.00 3n2b s TRP 13 Cb -0.18 -1.29 0.01 0.00 -1.15 0.00 0.00 33.47 30.86 3n2b s TRP 13 CO 0.18 0.30 0.20 0.00 0.02 0.00 0.00 176.95 177.65 3n2b s ALA 14 N -1.01 3.33 0.00 0.98 0.00 0.95 -1.97 121.76 124.04 3n2b s ALA 14 Ca 0.14 -1.55 0.00 0.00 0.00 0.00 0.00 51.96 50.55 3n2b s ALA 14 Cb -0.10 -2.55 0.00 0.00 0.00 0.00 0.00 23.12 20.47 3n2b s ALA 14 CO 0.05 -1.15 0.00 0.39 0.00 0.00 0.00 175.76 175.05 3n2b n GLU 15 N 5.02 0.00 -1.17 0.00 1.02 0.59 -1.04 120.64 125.06 3n2b n GLU 15 Ca -0.13 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 56.83 3n2b n GLU 15 Cb 0.48 0.00 0.15 0.00 -0.02 0.00 0.00 31.44 32.05 3n2b n GLU 15 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3n2b n GLN 16 N 14.00 2.30 -4.16 3.49 3.00 0.02 -4.92 117.38 131.11 3n2b n GLN 16 Ca 0.00 -3.26 -0.26 0.00 -0.01 0.00 0.00 57.00 53.46 3n2b n GLN 16 Cb 0.00 -2.06 -0.17 0.00 0.00 0.00 0.00 30.24 28.01 3n2b n GLN 16 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 3n2b s VAL 17 N -3.70 1.13 0.27 5.09 1.01 -0.21 -4.49 120.40 119.50 3n2b s VAL 17 Ca 0.53 -0.40 -0.30 0.00 0.00 0.00 0.00 61.98 61.81 3n2b s VAL 17 Cb 0.45 -1.10 -0.10 0.00 0.00 0.00 0.00 36.38 35.63 3n2b s VAL 17 CO 0.03 0.38 1.48 -2.84 0.00 0.00 0.00 175.10 174.15 3n2b s PRO 18 N 1.31 4.22 0.31 2.72 0.02 -1.26 -0.03 135.00 142.29 3n2b s PRO 18 Ca -0.02 2.38 0.05 0.00 0.02 0.00 0.00 61.00 63.43 3n2b s PRO 18 Cb -0.14 -3.08 0.52 0.00 0.02 0.00 0.00 34.50 31.82 3n2b s PRO 18 CO -0.04 -0.48 1.79 -0.07 -0.33 0.00 0.00 177.00 177.87 3n2b h LEU 19 N 4.91 0.41 -1.27 -5.54 3.38 -1.70 -2.74 115.31 112.78 3n2b h LEU 19 Ca -0.46 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.38 3n2b h LEU 19 Cb 1.22 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.83 3n2b h LEU 19 CO 0.78 0.62 0.34 0.00 0.09 0.00 0.00 178.44 180.27 3n2b h ALA 20 N 1.42 1.44 -0.59 1.53 0.00 -1.91 -0.35 119.26 120.80 3n2b h ALA 20 Ca 0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3n2b h ALA 20 Cb 0.56 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 3n2b h ALA 20 CO 0.04 0.46 0.31 -0.44 0.00 0.00 0.00 179.25 179.62 3n2b h ASP 21 N 0.86 0.75 -0.25 0.00 5.19 -1.87 -1.61 116.42 119.47 3n2b h ASP 21 Ca 0.22 -0.10 -0.02 0.00 -0.62 0.00 0.00 57.03 56.51 3n2b h ASP 21 Cb 0.01 -0.19 -0.01 0.00 0.18 0.00 0.00 39.33 39.32 3n2b h ASP 21 CO -0.04 0.64 0.09 -0.07 -3.12 0.00 0.00 179.24 176.74 3n2b h LEU 22 N 0.80 0.36 -0.70 1.55 3.38 -1.31 0.02 115.31 119.41 3n2b h LEU 22 Ca 0.21 -0.19 0.10 0.00 0.09 0.00 0.00 57.88 58.09 3n2b h LEU 22 Cb 0.06 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 40.65 3n2b h LEU 22 CO -0.03 0.46 0.32 0.00 0.09 0.00 0.00 178.44 179.28 3n2b h ALA 23 N 0.92 0.96 -0.39 1.53 0.00 -0.95 0.22 119.26 121.55 3n2b h ALA 23 Ca 0.08 0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3n2b h ALA 23 Cb 0.22 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3n2b h ALA 23 CO -0.00 -0.10 0.09 -0.97 0.00 0.00 0.00 179.25 178.27 3n2b h ASN 24 N 0.55 0.61 -0.02 0.00 -1.24 -1.08 -0.22 115.58 114.17 3n2b h ASN 24 Ca 0.35 -0.24 -0.24 0.00 0.71 0.00 0.00 56.30 56.88 3n2b h ASN 24 Cb 0.41 -0.16 0.01 0.00 0.73 0.00 0.00 38.32 39.31 3n2b h ASN 24 CO -0.29 0.69 -0.89 -0.61 -1.29 0.00 0.00 177.43 175.03 3n2b h GLN 25 N 0.50 0.70 -0.01 6.67 4.15 -0.48 -3.37 115.11 123.26 3n2b h GLN 25 Ca 0.12 -0.65 0.00 0.00 0.77 0.00 0.00 58.65 58.89 3n2b h GLN 25 Cb 0.32 0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.17 3n2b h GLN 25 CO 0.00 1.25 0.00 0.66 -1.93 0.00 0.00 178.83 178.81 3n2b n TYR 26 N -3.88 0.00 -0.22 3.99 4.01 0.74 -5.09 117.16 116.72 3n2b n TYR 26 Ca -0.08 -0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.68 3n2b n TYR 26 Cb 0.80 -0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.83 3n2b n TYR 26 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3n2b n GLY 27 N 0.60 -1.88 3.32 2.72 0.00 -0.09 -4.86 105.19 105.00 3n2b n GLY 27 Ca 0.06 -1.45 -0.22 0.00 0.00 0.00 0.00 46.02 44.41 3n2b n GLY 27 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3n2b s THR 28 N -1.95 1.79 0.86 2.61 -4.23 -1.26 -4.33 115.64 109.14 3n2b s THR 28 Ca 0.00 -1.85 -0.11 0.00 -1.18 0.00 0.00 61.69 58.55 3n2b s THR 28 Cb 0.00 -1.79 0.11 0.00 1.34 0.00 0.00 72.50 72.16 3n2b s THR 28 CO 0.00 -0.27 1.09 -2.84 -0.54 0.00 0.00 174.62 172.06 3n2b s PRO 29 N -2.64 1.51 -0.17 3.99 0.02 -1.26 -5.00 135.00 131.45 3n2b s PRO 29 Ca 0.14 0.88 -0.11 0.00 0.02 0.00 0.00 61.00 61.93 3n2b s PRO 29 Cb -0.06 -1.83 0.05 0.00 0.02 0.00 0.00 34.50 32.68 3n2b s PRO 29 CO 0.06 -2.08 0.42 -1.17 -0.33 0.00 0.00 177.00 173.90 3n2b s LEU 30 N -6.13 0.02 -0.06 -5.54 2.96 -0.56 -4.41 118.68 104.97 3n2b s LEU 30 Ca 0.63 0.90 -0.18 0.00 -0.22 0.00 0.00 54.13 55.26 3n2b s LEU 30 Cb -0.18 1.41 -0.05 0.00 0.50 0.00 0.00 46.19 47.88 3n2b s LEU 30 CO 0.57 -0.18 0.49 -0.31 -1.32 0.00 0.00 176.35 175.60 3n2b s TYR 31 N 1.05 3.61 -0.11 5.38 2.02 -0.96 -0.46 117.35 127.88 3n2b s TYR 31 Ca -0.07 1.00 0.01 0.00 -0.37 0.00 0.00 57.07 57.64 3n2b s TYR 31 Cb -0.07 -2.51 0.02 0.00 -0.40 0.00 0.00 41.96 39.00 3n2b s TYR 31 CO -0.09 0.33 -0.12 0.08 -1.57 0.00 0.00 175.55 174.18 3n2b s VAL 32 N 0.02 1.29 0.06 0.71 1.01 -0.16 -1.35 120.40 121.98 3n2b s VAL 32 Ca 0.27 -0.50 0.05 0.00 0.00 0.00 0.00 61.98 61.80 3n2b s VAL 32 Cb -0.16 -1.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 3n2b s VAL 32 CO 0.13 0.40 -0.04 -0.31 0.00 0.00 0.00 175.10 175.29 3n2b s TYR 33 N 1.25 2.92 -0.28 5.22 2.02 0.03 -1.29 117.35 127.22 3n2b s TYR 33 Ca -0.02 -0.04 -0.06 0.00 -0.37 0.00 0.00 57.07 56.57 3n2b s TYR 33 Cb -0.14 -1.55 0.01 0.00 -0.40 0.00 0.00 41.96 39.88 3n2b s TYR 33 CO -0.04 0.44 0.06 0.45 -1.57 0.00 0.00 175.55 174.89 3n2b s SER 34 N -2.00 5.01 0.19 2.29 0.15 -0.13 -0.68 113.70 118.53 3n2b s SER 34 Ca 0.22 -0.67 -0.12 0.00 0.70 0.00 0.00 55.95 56.08 3n2b s SER 34 Cb -0.11 -1.86 0.12 0.00 -1.71 0.00 0.00 66.02 62.46 3n2b s SER 34 CO 0.14 -0.16 1.86 -0.09 1.20 0.00 0.00 173.24 176.18 3n2b h ARG 35 N 8.21 0.88 -0.38 5.44 2.43 -1.71 -2.59 114.38 126.65 3n2b h ARG 35 Ca -0.33 -0.06 -0.06 0.00 -0.81 0.00 0.00 59.98 58.73 3n2b h ARG 35 Cb 1.13 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 30.47 3n2b h ARG 35 CO 0.60 0.59 -0.01 0.00 -1.51 0.00 0.00 179.97 179.64 3n2b h ALA 36 N 1.24 1.27 -0.30 2.80 0.00 -1.95 -1.45 119.26 120.87 3n2b h ALA 36 Ca 0.24 -0.23 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 3n2b h ALA 36 Cb -0.09 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3n2b h ALA 36 CO -0.05 0.49 -0.03 1.15 0.00 0.00 0.00 179.25 180.81 3n2b h THR 37 N 0.58 1.27 -0.42 0.00 2.02 -1.89 0.11 112.91 114.58 3n2b h THR 37 Ca 0.12 -1.01 -0.00 0.00 0.77 0.00 0.00 66.41 66.29 3n2b h THR 37 Cb 0.38 1.32 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 3n2b h THR 37 CO 0.01 0.33 0.25 -0.07 0.37 0.00 0.00 175.52 176.41 3n2b h LEU 38 N 0.34 0.50 -0.35 2.58 3.38 -1.07 -1.71 115.31 118.98 3n2b h LEU 38 Ca 0.08 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 3n2b h LEU 38 Cb 0.48 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 3n2b h LEU 38 CO 0.02 0.42 0.07 -0.33 0.09 0.00 0.00 178.44 178.71 3n2b h GLU 39 N 0.55 0.57 -0.08 1.13 5.08 -1.24 -1.61 114.58 118.99 3n2b h GLU 39 Ca 0.15 -0.14 0.03 0.00 -1.00 0.00 0.00 59.36 58.40 3n2b h GLU 39 Cb 0.01 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.15 3n2b h GLU 39 CO -0.03 0.63 -0.13 -0.09 -1.00 0.00 0.00 179.01 178.39 3n2b h ARG 40 N 0.41 -0.18 -0.61 2.33 2.43 -0.81 -1.22 114.38 116.73 3n2b h ARG 40 Ca 0.11 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.25 3n2b h ARG 40 Cb 0.32 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.89 3n2b h ARG 40 CO 0.00 -0.12 0.21 0.45 -1.51 0.00 0.00 179.97 179.00 3n2b h HIS 41 N -0.19 0.97 -0.42 2.20 3.86 -1.31 -1.80 115.15 118.47 3n2b h HIS 41 Ca 0.07 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.18 3n2b h HIS 41 Cb 0.29 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 28.46 3n2b h HIS 41 CO -0.23 0.79 0.23 2.35 0.86 0.00 0.00 177.93 181.94 3n2b h TRP 42 N 0.87 0.57 -0.13 2.45 7.01 -1.00 -2.44 115.95 123.28 3n2b h TRP 42 Ca 0.20 -0.01 -0.07 0.00 2.11 0.00 0.00 58.89 61.12 3n2b h TRP 42 Cb 0.27 -0.18 -0.01 0.00 -2.10 0.00 0.00 29.16 27.13 3n2b h TRP 42 CO 0.02 0.43 -0.23 0.45 -2.79 0.00 0.00 178.44 176.32 3n2b h HIS 43 N 0.55 0.25 -0.29 2.65 3.86 -1.10 0.10 115.15 121.17 3n2b h HIS 43 Ca 0.15 -0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.31 3n2b h HIS 43 Cb 0.05 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.44 3n2b h HIS 43 CO -0.02 0.45 0.16 0.00 0.86 0.00 0.00 177.93 179.37 3n2b h ALA 44 N 1.56 0.38 -0.35 2.45 0.00 -1.01 0.12 119.26 122.40 3n2b h ALA 44 Ca 0.04 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 3n2b h ALA 44 Cb 0.53 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3n2b h ALA 44 CO 0.04 -0.09 0.01 0.74 0.00 0.00 0.00 179.25 179.95 3n2b h PHE 45 N 0.36 0.66 -0.74 0.00 -1.00 -1.06 -1.94 116.94 113.22 3n2b h PHE 45 Ca 0.10 -0.11 -0.06 0.00 2.81 0.00 0.00 57.97 60.71 3n2b h PHE 45 Cb 0.07 -0.17 -0.03 0.00 3.61 0.00 0.00 35.95 39.43 3n2b h PHE 45 CO -0.03 0.70 0.22 0.22 -1.61 0.00 0.00 178.31 177.81 3n2b h ASP 46 N 0.43 1.09 1.42 2.17 3.58 -0.59 -3.20 116.42 121.30 3n2b h ASP 46 Ca 0.10 -0.21 -0.02 0.00 0.42 0.00 0.00 57.03 57.32 3n2b h ASP 46 Cb 0.43 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 41.19 3n2b h ASP 46 CO 0.02 1.01 -0.59 0.11 -2.88 0.00 0.00 179.24 176.91 3n2b h LYS 47 N 1.10 0.00 0.00 0.28 1.57 -0.78 -3.34 116.57 115.40 3n2b h LYS 47 Ca 0.24 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.98 3n2b h LYS 47 Cb 0.33 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.63 3n2b h LYS 47 CO -0.00 0.05 -0.16 0.66 -0.57 0.00 0.00 179.45 179.43 3n2b h SER 48 N 0.00 0.00 1.24 0.86 4.64 -1.34 -2.95 113.55 116.00 3n2b h SER 48 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3n2b h SER 48 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3n2b h SER 48 CO 0.01 0.16 0.00 0.58 -0.87 0.00 0.00 176.83 176.70 3n2b h VAL 49 N 0.00 0.00 0.00 0.95 2.07 -1.69 -3.36 116.25 114.22 3n2b h VAL 49 Ca -0.00 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 66.97 3n2b h VAL 49 Cb 0.37 1.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 3n2b h VAL 49 CO 0.02 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.22 3n2b n GLY 50 N 0.44 -0.23 0.02 2.17 0.00 -1.12 -3.45 105.19 103.03 3n2b n GLY 50 Ca 0.02 -1.06 0.15 0.00 0.00 0.00 0.00 46.02 45.13 3n2b n GLY 50 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3n2b n ASP 51 N 0.81 0.07 -4.73 1.61 9.92 -1.26 -4.88 116.55 118.10 3n2b n ASP 51 Ca 0.00 -0.26 -0.42 0.00 -0.53 0.00 0.00 54.79 53.58 3n2b n ASP 51 Cb 0.00 -0.23 -0.03 0.00 -0.64 0.00 0.00 41.12 40.22 3n2b n ASP 51 CO 0.00 0.00 0.00 -0.47 0.13 0.00 0.00 177.20 176.86 3n2b s TYR 52 N -2.53 2.95 0.18 1.24 5.04 -1.22 -4.87 117.35 118.14 3n2b s TYR 52 Ca 0.30 0.55 -0.33 0.00 -2.44 0.00 0.00 57.07 55.15 3n2b s TYR 52 Cb 0.20 -4.03 -0.13 0.00 0.35 0.00 0.00 41.96 38.35 3n2b s TYR 52 CO 0.46 -3.79 1.68 -0.35 -1.34 0.00 0.00 175.55 172.21 3n2b n PRO 53 N 3.61 2.52 -3.84 4.97 -0.04 -1.26 -4.92 135.00 136.04 3n2b n PRO 53 Ca 0.13 0.91 -0.07 0.00 -0.04 0.00 0.00 63.50 64.43 3n2b n PRO 53 Cb 0.37 -2.73 -0.00 0.00 -0.04 0.00 0.00 33.50 31.10 3n2b n PRO 53 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 3n2b s HIS 54 N 1.20 -0.08 -0.16 0.54 -3.43 -1.26 -1.22 115.29 110.89 3n2b s HIS 54 Ca 0.77 -0.45 -0.07 0.00 -0.80 0.00 0.00 55.06 54.51 3n2b s HIS 54 Cb -0.58 0.75 0.06 0.00 -1.43 0.00 0.00 32.58 31.39 3n2b s HIS 54 CO 0.35 -1.34 0.36 -1.17 -2.00 0.00 0.00 174.74 170.94 3n2b s LEU 55 N -2.98 -0.12 -0.31 5.38 2.96 -0.24 -4.89 118.68 118.47 3n2b s LEU 55 Ca 0.13 0.80 -0.20 0.00 -0.22 0.00 0.00 54.13 54.63 3n2b s LEU 55 Cb -0.05 1.14 -0.01 0.00 0.50 0.00 0.00 46.19 47.77 3n2b s LEU 55 CO 0.08 -0.20 0.63 -0.63 -1.32 0.00 0.00 176.35 174.91 3n2b s ILE 56 N 1.74 4.93 -0.67 6.68 -1.09 -1.26 -2.11 121.20 129.42 3n2b s ILE 56 Ca -0.07 0.82 -0.07 0.00 -2.23 0.00 0.00 60.65 59.11 3n2b s ILE 56 Cb -0.10 -4.01 0.17 0.00 -1.58 0.00 0.00 42.46 36.94 3n2b s ILE 56 CO -0.11 -0.17 0.53 0.00 -1.23 0.00 0.00 174.94 173.95 3n2b n TYR 58 N 3.77 2.65 -2.45 0.00 9.36 -0.65 -3.85 117.16 125.99 3n2b n TYR 58 Ca 0.08 0.19 -0.40 0.00 3.32 0.00 0.00 57.90 61.09 3n2b n TYR 58 Cb 0.41 -2.60 -0.03 0.00 -0.63 0.00 0.00 39.34 36.48 3n2b n TYR 58 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3n2b s ALA 59 N 0.57 2.61 0.34 2.98 0.00 -0.30 -0.50 121.76 127.46 3n2b s ALA 59 Ca 0.71 -1.38 0.08 0.00 0.00 0.00 0.00 51.96 51.37 3n2b s ALA 59 Cb -0.54 -4.32 0.80 0.00 0.00 0.00 0.00 23.12 19.06 3n2b s ALA 59 CO 0.41 -3.49 1.84 0.28 0.00 0.00 0.00 175.76 174.79 3n2b h VAL 60 N 6.32 0.79 -0.17 0.00 2.07 -1.72 -2.18 116.25 121.36 3n2b h VAL 60 Ca -0.20 -0.24 0.05 0.00 0.82 0.00 0.00 66.70 67.13 3n2b h VAL 60 Cb 1.06 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 3n2b h VAL 60 CO 1.29 0.13 0.14 0.07 0.02 0.00 0.00 177.57 179.22 3n2b h LYS 61 N 0.71 0.00 -0.69 1.57 2.10 -1.90 -2.30 116.57 116.07 3n2b h LYS 61 Ca 0.49 0.00 0.06 0.00 -2.00 0.00 0.00 60.65 59.21 3n2b h LYS 61 Cb 0.81 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 32.08 3n2b h LYS 61 CO -0.25 0.00 0.38 0.00 -2.00 0.00 0.00 179.45 177.58 3n2b h ALA 62 N 1.88 0.93 -0.72 0.07 0.00 -1.78 -3.43 119.26 116.21 3n2b h ALA 62 Ca 0.08 0.02 0.15 0.00 0.00 0.00 0.00 54.91 55.16 3n2b h ALA 62 Cb 0.36 -0.13 -0.21 0.00 0.00 0.00 0.00 17.79 17.81 3n2b h ALA 62 CO -0.00 0.06 -0.12 1.21 0.00 0.00 0.00 179.25 180.40 3n2b s ASN 63 N -5.60 -1.02 0.00 0.00 3.84 -0.89 -0.70 114.94 110.57 3n2b s ASN 63 Ca -0.13 0.60 0.18 0.00 0.21 0.00 0.00 52.86 53.72 3n2b s ASN 63 Cb 0.17 1.84 0.45 0.00 -0.55 0.00 0.00 41.25 43.16 3n2b s ASN 63 CO 0.76 -0.19 1.37 -1.20 -2.79 0.00 0.00 177.10 175.05 3n2b n SER 64 N 5.44 3.38 -4.67 -4.21 7.64 -1.07 -4.73 113.62 115.40 3n2b n SER 64 Ca -0.03 -1.96 -0.44 0.00 1.01 0.00 0.00 58.87 57.45 3n2b n SER 64 Cb 0.52 -0.32 -0.02 0.00 -1.01 0.00 0.00 64.21 63.38 3n2b n SER 64 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 3n2b n ASN 65 N 1.17 2.71 -0.06 6.43 2.85 -1.26 -4.75 115.26 122.35 3n2b n ASN 65 Ca 0.18 1.16 0.12 0.00 -0.11 0.00 0.00 54.58 55.93 3n2b n ASN 65 Cb 0.53 -1.44 0.52 0.00 1.24 0.00 0.00 39.78 40.64 3n2b n ASN 65 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 3n2b h LEU 66 N 3.83 0.32 -0.44 1.20 3.38 -1.93 -0.80 115.31 120.87 3n2b h LEU 66 Ca -0.45 0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.42 3n2b h LEU 66 Cb 1.28 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 3n2b h LEU 66 CO 0.73 0.20 -0.15 1.23 0.09 0.00 0.00 178.44 180.54 3n2b h GLY 67 N 0.36 0.96 0.75 0.83 0.00 -1.89 0.11 103.07 104.19 3n2b h GLY 67 Ca 0.27 -0.82 -0.00 0.00 0.00 0.00 0.00 47.33 46.78 3n2b h GLY 67 CO -0.07 0.74 -0.01 -2.08 0.00 0.00 0.00 176.54 175.12 3n2b h VAL 68 N 0.72 1.15 -0.79 4.60 2.07 -1.69 -1.70 116.25 120.61 3n2b h VAL 68 Ca 0.11 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 67.05 3n2b h VAL 68 Cb 0.70 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.97 3n2b h VAL 68 CO 0.05 0.15 0.50 -0.07 0.02 0.00 0.00 177.57 178.22 3n2b h LEU 69 N -0.29 0.94 -0.91 2.57 3.38 -1.12 -2.68 115.31 117.20 3n2b h LEU 69 Ca -0.00 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 3n2b h LEU 69 Cb 0.27 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 3n2b h LEU 69 CO 0.01 0.71 0.46 -1.13 0.09 0.00 0.00 178.44 178.58 3n2b h ASN 70 N 1.08 1.11 -0.29 -0.43 -0.00 -0.74 0.24 115.58 116.56 3n2b h ASN 70 Ca 0.29 -0.11 0.05 0.00 -0.00 0.00 0.00 56.30 56.53 3n2b h ASN 70 Cb -0.07 -0.28 -0.05 0.00 -0.00 0.00 0.00 38.32 37.92 3n2b h ASN 70 CO -0.06 0.91 -0.02 0.74 -0.00 0.00 0.00 177.43 178.99 3n2b h THR 71 N 1.23 0.76 -0.19 -3.57 2.02 -0.98 -1.53 112.91 110.67 3n2b h THR 71 Ca 0.31 -0.02 -0.19 0.00 0.77 0.00 0.00 66.41 67.27 3n2b h THR 71 Cb 0.06 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 3n2b h THR 71 CO -0.05 0.01 -0.66 -0.07 0.37 0.00 0.00 175.52 175.13 3n2b h LEU 72 N 0.06 0.81 -1.44 2.58 3.38 -1.21 -3.20 115.31 116.29 3n2b h LEU 72 Ca 0.14 -0.48 0.03 0.00 0.09 0.00 0.00 57.88 57.66 3n2b h LEU 72 Cb 0.19 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 3n2b h LEU 72 CO -0.25 1.25 0.41 0.00 0.09 0.00 0.00 178.44 179.94 3n2b h ALA 73 N 0.75 1.67 0.00 1.53 0.00 -0.30 -1.08 119.26 121.83 3n2b h ALA 73 Ca -0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3n2b h ALA 73 Cb 1.26 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 3n2b h ALA 73 CO 0.13 0.26 -0.11 0.00 0.00 0.00 0.00 179.25 179.53 3n2b h ARG 74 N 0.73 0.00 -0.00 0.00 3.08 -1.28 -1.16 114.38 115.76 3n2b h ARG 74 Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.30 3n2b h ARG 74 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.14 3n2b h ARG 74 CO -0.07 0.11 -0.17 1.28 -1.07 0.00 0.00 179.97 180.06 3n2b n LEU 75 N -3.31 0.31 0.00 3.04 4.77 -0.44 -4.92 117.00 116.44 3n2b n LEU 75 Ca -0.00 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 3n2b n LEU 75 Cb 0.33 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 3n2b n LEU 75 CO 0.30 0.07 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 3n2b n GLY 76 N 1.41 0.64 3.71 -0.72 0.00 -0.44 -5.05 105.19 104.75 3n2b n GLY 76 Ca 0.10 -0.62 -0.33 0.00 0.00 0.00 0.00 46.02 45.17 3n2b n GLY 76 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3n2b s SER 77 N -2.56 3.90 0.67 1.61 0.15 -0.98 -4.98 113.70 111.50 3n2b s SER 77 Ca 0.00 2.25 0.05 0.00 0.70 0.00 0.00 55.95 58.95 3n2b s SER 77 Cb 0.00 -2.58 0.12 0.00 -1.71 0.00 0.00 66.02 61.85 3n2b s SER 77 CO 0.00 -2.46 0.92 -0.83 1.20 0.00 0.00 173.24 172.07 3n2b s GLY 78 N -2.35 1.73 -0.09 9.45 0.00 0.14 -4.71 107.32 111.49 3n2b s GLY 78 Ca 0.71 -2.01 -0.09 0.00 0.00 0.00 0.00 44.72 43.33 3n2b s GLY 78 CO 0.50 -1.46 0.25 -1.36 0.00 0.00 0.00 173.10 171.03 3n2b s PHE 79 N -2.94 -0.26 -0.25 1.90 0.08 -0.67 -1.64 117.98 114.20 3n2b s PHE 79 Ca 0.65 0.63 -0.07 0.00 0.12 0.00 0.00 56.93 58.26 3n2b s PHE 79 Cb -0.05 0.09 -0.02 0.00 -0.57 0.00 0.00 43.02 42.47 3n2b s PHE 79 CO 0.42 -0.14 0.05 0.34 -0.10 0.00 0.00 175.22 175.79 3n2b s ASP 80 N 0.03 4.96 0.21 1.36 2.15 0.34 -1.29 116.67 124.44 3n2b s ASP 80 Ca -0.01 -0.34 0.09 0.00 0.43 0.00 0.00 52.55 52.73 3n2b s ASP 80 Cb -0.02 -1.88 -0.04 0.00 -0.30 0.00 0.00 42.92 40.68 3n2b s ASP 80 CO 0.01 -0.06 -0.07 0.27 -0.17 0.00 0.00 175.17 175.15 3n2b s ILE 81 N 1.57 3.26 0.00 4.11 -4.36 -0.47 -2.02 121.20 123.28 3n2b s ILE 81 Ca 0.06 -1.77 0.00 0.00 -0.26 0.00 0.00 60.65 58.68 3n2b s ILE 81 Cb -0.15 -2.66 0.00 0.00 1.25 0.00 0.00 42.46 40.89 3n2b s ILE 81 CO 0.02 -0.21 0.80 1.33 0.24 0.00 0.00 174.94 177.12 3n2b n VAL 82 N -0.31 0.64 -3.67 8.37 0.24 -1.26 -0.75 118.33 121.59 3n2b n VAL 82 Ca -0.09 -0.75 -0.09 0.00 -2.04 0.00 0.00 64.34 61.37 3n2b n VAL 82 Cb 0.57 0.72 -0.02 0.00 -1.47 0.00 0.00 33.84 33.63 3n2b n VAL 82 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3n2b s SER 83 N -0.64 -0.39 0.31 -1.34 1.04 -1.26 -4.78 113.70 106.63 3n2b s SER 83 Ca 0.00 -0.34 0.06 0.00 0.48 0.00 0.00 55.95 56.15 3n2b s SER 83 Cb 0.00 0.66 0.50 0.00 0.10 0.00 0.00 66.02 67.28 3n2b s SER 83 CO 0.00 -1.16 1.74 1.62 0.98 0.00 0.00 173.24 176.42 3n2b h VAL 84 N 2.00 1.27 -0.55 5.02 3.04 -1.97 -2.19 116.25 122.87 3n2b h VAL 84 Ca -0.25 -1.31 0.03 0.00 -1.01 0.00 0.00 66.70 64.16 3n2b h VAL 84 Cb 1.27 1.50 -0.04 0.00 -2.01 0.00 0.00 31.29 32.01 3n2b h VAL 84 CO 0.29 0.40 0.31 1.23 -1.01 0.00 0.00 177.57 178.80 3n2b h GLY 85 N 1.07 0.78 1.29 3.17 0.00 -1.99 -0.30 103.07 107.08 3n2b h GLY 85 Ca 0.04 -0.23 -0.09 0.00 0.00 0.00 0.00 47.33 47.05 3n2b h GLY 85 CO 0.05 0.18 -0.05 0.83 0.00 0.00 0.00 176.54 177.55 3n2b h GLU 86 N 0.62 0.85 -0.64 4.80 5.08 -1.86 -0.98 114.58 122.44 3n2b h GLU 86 Ca 0.23 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 3n2b h GLU 86 Cb 0.07 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 3n2b h GLU 86 CO -0.12 0.89 0.34 1.25 -1.00 0.00 0.00 179.01 180.37 3n2b h LEU 87 N 0.78 0.81 -0.97 1.33 5.85 -0.97 -1.17 115.31 120.96 3n2b h LEU 87 Ca 0.14 -0.10 -0.08 0.00 0.84 0.00 0.00 57.88 58.68 3n2b h LEU 87 Cb 0.55 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 3n2b h LEU 87 CO 0.03 0.68 -0.10 -0.33 -0.34 0.00 0.00 178.44 178.38 3n2b h GLU 88 N 0.88 0.64 -0.29 1.25 4.39 -0.53 -1.91 114.58 119.01 3n2b h GLU 88 Ca 0.23 -0.19 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 3n2b h GLU 88 Cb 0.06 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 3n2b h GLU 88 CO -0.03 0.72 0.14 0.00 -1.16 0.00 0.00 179.01 178.68 3n2b h ARG 89 N 0.59 0.42 -0.54 2.33 3.08 -0.93 -0.86 114.38 118.46 3n2b h ARG 89 Ca 0.11 -0.06 0.05 0.00 0.07 0.00 0.00 59.98 60.15 3n2b h ARG 89 Cb 0.51 -0.08 -0.05 0.00 0.08 0.00 0.00 29.97 30.44 3n2b h ARG 89 CO 0.03 0.39 0.27 0.28 -1.07 0.00 0.00 179.97 179.87 3n2b h VAL 90 N 0.34 0.94 -0.27 2.04 2.07 -0.88 -0.74 116.25 119.76 3n2b h VAL 90 Ca 0.10 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 3n2b h VAL 90 Cb 0.11 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 3n2b h VAL 90 CO -0.01 0.10 0.14 -0.07 0.02 0.00 0.00 177.57 177.74 3n2b h LEU 91 N 0.52 0.35 -2.05 2.57 4.07 -1.18 0.85 115.31 120.44 3n2b h LEU 91 Ca 0.24 -0.11 -0.01 0.00 0.08 0.00 0.00 57.88 58.08 3n2b h LEU 91 Cb 0.16 -0.09 -0.00 0.00 1.08 0.00 0.00 40.66 41.81 3n2b h LEU 91 CO -0.17 0.36 -0.06 0.00 -1.08 0.00 0.00 178.44 177.49 3n2b h ALA 92 N 1.00 1.68 -0.21 1.53 0.00 -0.83 -1.66 119.26 120.78 3n2b h ALA 92 Ca 0.09 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3n2b h ALA 92 Cb 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3n2b h ALA 92 CO -0.01 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.31 3n2b n ALA 93 N -2.43 2.50 -0.76 0.00 0.00 -0.31 -4.92 120.51 114.59 3n2b n ALA 93 Ca -0.03 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.85 3n2b n ALA 93 Cb 0.14 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.54 3n2b n ALA 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3n2b n GLY 94 N 1.13 0.56 3.82 0.00 0.00 -0.62 -4.02 105.19 106.05 3n2b n GLY 94 Ca 0.15 -0.58 -0.32 0.00 0.00 0.00 0.00 46.02 45.27 3n2b n GLY 94 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3n2b s GLY 95 N -2.53 2.01 -0.35 -0.02 0.00 0.26 -4.88 107.32 101.82 3n2b s GLY 95 Ca 0.00 0.28 -0.18 0.00 0.00 0.00 0.00 44.72 44.82 3n2b s GLY 95 CO 0.00 0.59 0.50 -0.35 0.00 0.00 0.00 173.10 173.83 3n2b s ASP 96 N -3.07 6.30 0.55 1.64 -1.08 -1.26 -4.58 116.67 115.16 3n2b s ASP 96 Ca 0.61 -0.05 0.26 0.00 -0.52 0.00 0.00 52.55 52.85 3n2b s ASP 96 Cb -0.14 -2.26 1.56 0.00 -1.46 0.00 0.00 42.92 40.62 3n2b s ASP 96 CO 0.40 -0.46 2.16 1.55 0.52 0.00 0.00 175.17 179.33 3n2b h PRO 97 N 8.46 0.00 0.00 4.34 0.13 -1.92 -0.44 132.00 142.57 3n2b h PRO 97 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 3n2b h PRO 97 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 3n2b h PRO 97 CO 0.76 0.06 0.00 -1.13 -0.23 0.00 0.00 178.00 177.47 3n2b n SER 98 N -3.89 0.08 -0.87 1.44 3.41 -1.26 -1.20 113.62 111.34 3n2b n SER 98 Ca -0.03 0.52 0.08 0.00 -0.26 0.00 0.00 58.87 59.18 3n2b n SER 98 Cb 0.15 -0.54 0.24 0.00 -0.26 0.00 0.00 64.21 63.80 3n2b n SER 98 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3n2b n LYS 99 N -1.59 2.99 -4.05 4.33 5.02 -0.18 -4.05 118.16 120.63 3n2b n LYS 99 Ca 0.03 -2.65 -0.35 0.00 -2.02 0.00 0.00 58.31 53.31 3n2b n LYS 99 Cb 0.16 -1.71 -0.08 0.00 -0.02 0.00 0.00 35.03 33.37 3n2b n LYS 99 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3n2b s VAL 100 N -2.34 4.91 -0.01 -0.18 1.01 -0.34 -1.67 120.40 121.79 3n2b s VAL 100 Ca 0.38 -0.00 0.07 0.00 0.00 0.00 0.00 61.98 62.43 3n2b s VAL 100 Cb 0.29 -3.16 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 3n2b s VAL 100 CO 0.11 0.55 -0.22 0.68 0.00 0.00 0.00 175.10 176.21 3n2b s VAL 101 N -0.38 2.41 -0.27 2.92 -7.23 -0.41 -0.39 120.40 117.04 3n2b s VAL 101 Ca 0.10 -1.09 -0.03 0.00 -1.81 0.00 0.00 61.98 59.15 3n2b s VAL 101 Cb -0.12 -1.91 0.03 0.00 0.56 0.00 0.00 36.38 34.94 3n2b s VAL 101 CO 0.02 0.51 -0.02 0.12 -0.31 0.00 0.00 175.10 175.41 3n2b s PHE 102 N -0.72 3.13 0.42 2.82 5.99 -0.11 -1.37 117.98 128.14 3n2b s PHE 102 Ca 0.11 -1.54 0.08 0.00 0.00 0.00 0.00 56.93 55.58 3n2b s PHE 102 Cb -0.10 -2.11 -0.02 0.00 0.00 0.00 0.00 43.02 40.79 3n2b s PHE 102 CO 0.01 -0.72 0.38 -1.12 -0.00 0.00 0.00 175.22 173.76 3n2b s SER 103 N 1.34 5.02 0.00 6.13 0.01 0.07 -0.41 113.70 125.85 3n2b s SER 103 Ca -0.01 -0.77 0.00 0.00 1.31 0.00 0.00 55.95 56.48 3n2b s SER 103 Cb -0.18 -0.53 0.00 0.00 0.21 0.00 0.00 66.02 65.52 3n2b s SER 103 CO -0.02 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 173.56 3n2b n GLY 104 N -1.56 3.76 0.13 3.44 0.00 -1.26 -4.27 105.19 105.43 3n2b n GLY 104 Ca 0.03 -1.48 0.12 0.00 0.00 0.00 0.00 46.02 44.69 3n2b n GLY 104 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3n2b h VAL 105 N 0.24 0.00 -0.63 1.61 -1.51 -1.94 -3.38 116.25 110.64 3n2b h VAL 105 Ca 0.00 -0.79 -0.46 0.00 -1.23 0.00 0.00 66.70 64.22 3n2b h VAL 105 Cb 0.00 1.54 -0.36 0.00 -2.13 0.00 0.00 31.29 30.35 3n2b h VAL 105 CO 0.00 0.00 -0.73 0.61 -1.23 0.00 0.00 177.57 176.22 3n2b n GLY 106 N 1.22 6.19 3.70 5.19 0.00 -1.26 -4.94 105.19 115.28 3n2b n GLY 106 Ca 0.03 -2.44 -0.44 0.00 0.00 0.00 0.00 46.02 43.17 3n2b n GLY 106 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3n2b n LYS 107 N -0.78 2.44 -2.67 1.61 5.02 -1.26 -4.99 118.16 117.53 3n2b n LYS 107 Ca 0.40 0.88 -0.26 0.00 -2.02 0.00 0.00 58.31 57.31 3n2b n LYS 107 Cb 0.92 -2.67 0.01 0.00 -0.02 0.00 0.00 35.03 33.28 3n2b n LYS 107 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3n2b s THR 108 N 0.82 4.20 0.25 -0.18 -4.23 -1.26 -4.94 115.64 110.30 3n2b s THR 108 Ca 0.75 -0.09 -0.06 0.00 -1.18 0.00 0.00 61.69 61.11 3n2b s THR 108 Cb -0.59 -3.61 0.25 0.00 1.34 0.00 0.00 72.50 69.89 3n2b s THR 108 CO 0.38 -0.55 1.90 -0.33 -0.54 0.00 0.00 174.62 175.48 3n2b h GLU 109 N 0.14 1.20 -0.55 3.99 5.08 -1.96 -1.50 114.58 120.98 3n2b h GLU 109 Ca -0.46 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 57.83 3n2b h GLU 109 Cb 1.24 -0.27 -0.03 0.00 0.50 0.00 0.00 28.75 30.19 3n2b h GLU 109 CO 0.60 0.79 0.36 0.00 -1.00 0.00 0.00 179.01 179.76 3n2b h ALA 110 N 1.38 0.70 -0.30 3.43 0.00 -2.00 -1.29 119.26 121.18 3n2b h ALA 110 Ca 0.38 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.21 3n2b h ALA 110 Cb -0.03 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3n2b h ALA 110 CO -0.11 0.14 0.08 0.93 0.00 0.00 0.00 179.25 180.29 3n2b h GLU 111 N 0.74 0.47 -0.82 0.00 5.08 -1.87 -2.56 114.58 115.62 3n2b h GLU 111 Ca 0.20 -0.11 0.04 0.00 -1.00 0.00 0.00 59.36 58.49 3n2b h GLU 111 Cb -0.07 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.06 3n2b h GLU 111 CO -0.04 0.54 0.52 0.52 -1.00 0.00 0.00 179.01 179.55 3n2b h MET 112 N 0.32 0.97 -0.32 2.33 2.86 -1.03 -1.86 114.93 118.20 3n2b h MET 112 Ca 0.09 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.67 3n2b h MET 112 Cb 0.28 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 3n2b h MET 112 CO -0.00 0.64 0.16 0.87 1.06 0.00 0.00 176.91 179.65 3n2b h LYS 113 N 1.00 0.46 -0.79 1.72 1.57 -1.05 0.38 116.57 119.86 3n2b h LYS 113 Ca 0.34 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 59.01 3n2b h LYS 113 Cb 0.05 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.24 3n2b h LYS 113 CO -0.13 0.41 0.30 -0.09 -0.57 0.00 0.00 179.45 179.37 3n2b h ARG 114 N 0.39 1.19 -0.53 3.15 9.65 -1.25 -0.54 114.38 126.43 3n2b h ARG 114 Ca 0.11 -0.23 -0.07 0.00 -1.10 0.00 0.00 59.98 58.69 3n2b h ARG 114 Cb 0.09 -0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 28.47 3n2b h ARG 114 CO -0.02 0.97 0.04 0.00 2.80 0.00 0.00 179.97 183.77 3n2b h ALA 115 N 1.16 0.71 -0.65 2.80 0.00 -1.02 -1.89 119.26 120.36 3n2b h ALA 115 Ca 0.26 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 3n2b h ALA 115 Cb 0.24 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3n2b h ALA 115 CO -0.02 0.49 0.20 -0.07 0.00 0.00 0.00 179.25 179.85 3n2b h LEU 116 N 0.79 0.96 -1.39 0.00 3.38 -0.58 -1.90 115.31 116.57 3n2b h LEU 116 Ca 0.16 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 3n2b h LEU 116 Cb 0.47 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 3n2b h LEU 116 CO 0.02 0.92 -0.05 1.56 0.09 0.00 0.00 178.44 180.97 3n2b h GLN 117 N 0.95 0.34 -0.00 1.13 4.20 -0.94 -1.55 115.11 119.24 3n2b h GLN 117 Ca 0.21 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.85 3n2b h GLN 117 Cb 0.30 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.03 3n2b h GLN 117 CO -0.01 0.41 -0.09 1.28 -0.67 0.00 0.00 178.83 179.76 3n2b n LEU 118 N -4.30 0.39 -3.49 1.46 4.77 -0.73 -4.96 117.00 110.14 3n2b n LEU 118 Ca 0.00 0.04 -0.20 0.00 -0.03 0.00 0.00 56.01 55.83 3n2b n LEU 118 Cb 0.24 -0.19 0.06 0.00 -2.33 0.00 0.00 43.42 41.20 3n2b n LEU 118 CO 0.38 0.07 0.00 0.29 -1.33 0.00 0.00 177.39 176.80 3n2b n LYS 119 N -1.00 -3.72 -1.14 3.23 5.02 -0.58 -4.71 118.16 115.26 3n2b n LYS 119 Ca 0.15 0.73 -0.29 0.00 -2.02 0.00 0.00 58.31 56.88 3n2b n LYS 119 Cb 0.27 -5.37 0.17 0.00 -0.02 0.00 0.00 35.03 30.08 3n2b n LYS 119 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 3n2b s ILE 120 N -3.47 2.21 0.02 -0.18 -4.36 -1.14 -4.22 121.20 110.06 3n2b s ILE 120 Ca 0.24 0.07 -0.26 0.00 -0.26 0.00 0.00 60.65 60.44 3n2b s ILE 120 Cb -0.05 -2.53 -0.17 0.00 1.25 0.00 0.00 42.46 40.96 3n2b s ILE 120 CO 0.78 -0.09 1.36 0.50 0.24 0.00 0.00 174.94 177.73 3n2b h LYS 121 N -1.86 -0.33 -1.97 0.37 3.64 -0.70 -3.47 116.57 112.23 3n2b h LYS 121 Ca -0.54 0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 58.82 3n2b h LYS 121 Cb 1.32 0.08 -0.20 0.00 -0.41 0.00 0.00 32.23 33.02 3n2b h LYS 121 CO 0.56 -0.04 0.19 0.00 -2.27 0.00 0.00 179.45 177.89 3n2b s PHE 123 N -0.76 3.31 -0.68 0.00 0.08 -0.24 -0.94 117.98 118.75 3n2b s PHE 123 Ca -0.08 0.46 -0.20 0.00 0.12 0.00 0.00 56.93 57.24 3n2b s PHE 123 Cb -0.01 -2.51 0.11 0.00 -0.57 0.00 0.00 43.02 40.03 3n2b s PHE 123 CO 0.07 -0.10 0.84 -0.80 -0.10 0.00 0.00 175.22 175.13 3n2b s ASN 124 N 1.32 6.28 0.07 1.36 0.01 0.45 -1.07 114.94 123.36 3n2b s ASN 124 Ca 0.15 -1.49 -0.25 0.00 -0.71 0.00 0.00 52.86 50.56 3n2b s ASN 124 Cb -0.15 -2.34 -0.06 0.00 0.41 0.00 0.00 41.25 39.11 3n2b s ASN 124 CO 0.08 -1.16 0.78 -0.69 -1.51 0.00 0.00 177.10 174.60 3n2b s VAL 125 N 2.90 4.65 -0.61 1.60 1.01 0.38 -4.34 120.40 126.00 3n2b s VAL 125 Ca 0.18 1.66 0.13 0.00 0.00 0.00 0.00 61.98 63.95 3n2b s VAL 125 Cb -0.18 -4.13 -0.14 0.00 0.00 0.00 0.00 36.38 31.92 3n2b s VAL 125 CO 0.04 0.39 0.55 -0.62 0.00 0.00 0.00 175.10 175.47 3n2b n GLU 126 N 2.56 2.59 -3.76 2.72 -0.58 -1.26 -1.40 120.64 121.51 3n2b n GLU 126 Ca -0.03 -0.00 -0.10 0.00 -0.42 0.00 0.00 57.16 56.61 3n2b n GLU 126 Cb 0.50 -1.13 -0.04 0.00 -0.57 0.00 0.00 31.44 30.20 3n2b n GLU 126 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 3n2b s SER 127 N -2.27 -0.21 0.15 1.62 1.04 -1.26 -4.29 113.70 108.48 3n2b s SER 127 Ca 0.05 -0.53 -0.11 0.00 0.48 0.00 0.00 55.95 55.84 3n2b s SER 127 Cb 0.10 0.54 -0.01 0.00 0.10 0.00 0.00 66.02 66.75 3n2b s SER 127 CO 0.54 -1.00 1.53 -0.33 0.98 0.00 0.00 173.24 174.96 3n2b h GLU 128 N 2.28 0.94 -0.27 4.02 5.08 -1.99 -1.50 114.58 123.13 3n2b h GLU 128 Ca -0.30 -0.40 -0.04 0.00 -1.00 0.00 0.00 59.36 57.62 3n2b h GLU 128 Cb 1.26 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.46 3n2b h GLU 128 CO 0.40 1.07 -0.00 -1.35 -1.00 0.00 0.00 179.01 178.13 3n2b h PRO 129 N 0.78 0.41 -0.32 2.33 0.11 -1.99 -0.73 132.00 132.59 3n2b h PRO 129 Ca 0.10 -0.08 -0.08 0.00 0.11 0.00 0.00 66.00 66.06 3n2b h PRO 129 Cb 0.78 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.81 3n2b h PRO 129 CO 0.06 0.44 -0.10 1.49 -0.21 0.00 0.00 178.00 179.69 3n2b h GLU 130 N 0.40 0.63 -0.77 1.05 4.81 -1.90 -1.48 114.58 117.33 3n2b h GLU 130 Ca 0.09 -0.25 0.08 0.00 -0.13 0.00 0.00 59.36 59.15 3n2b h GLU 130 Cb 0.27 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.55 3n2b h GLU 130 CO 0.01 0.82 0.43 1.25 -0.73 0.00 0.00 179.01 180.79 3n2b h LEU 131 N 0.41 0.63 -0.41 1.64 5.85 -0.69 -0.71 115.31 122.03 3n2b h LEU 131 Ca 0.08 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 3n2b h LEU 131 Cb 0.60 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 3n2b h LEU 131 CO 0.04 0.38 0.20 1.56 -0.34 0.00 0.00 178.44 180.27 3n2b h GLN 132 N 0.75 0.58 -0.60 1.25 1.08 -0.91 -1.56 115.11 115.71 3n2b h GLN 132 Ca 0.36 -0.08 -0.02 0.00 -1.45 0.00 0.00 58.65 57.46 3n2b h GLN 132 Cb 0.29 -0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 27.59 3n2b h GLN 132 CO -0.22 0.50 0.29 -0.09 -0.95 0.00 0.00 178.83 178.36 3n2b h ARG 133 N 0.52 0.86 -0.62 1.46 2.43 -0.71 -0.90 114.38 117.43 3n2b h ARG 133 Ca 0.14 -0.13 -0.07 0.00 -0.81 0.00 0.00 59.98 59.11 3n2b h ARG 133 Cb 0.11 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 3n2b h ARG 133 CO -0.02 0.69 0.09 1.25 -1.51 0.00 0.00 179.97 180.48 3n2b h LEU 134 N 0.82 0.96 -0.44 3.80 5.85 -1.01 -0.81 115.31 124.49 3n2b h LEU 134 Ca 0.21 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 3n2b h LEU 134 Cb 0.11 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.87 3n2b h LEU 134 CO -0.03 0.97 0.20 -1.13 -0.34 0.00 0.00 178.44 178.11 3n2b h ASN 135 N 0.95 0.58 0.16 1.25 -1.24 -0.97 -0.61 115.58 115.70 3n2b h ASN 135 Ca 0.19 -0.14 0.01 0.00 0.71 0.00 0.00 56.30 57.07 3n2b h ASN 135 Cb 0.42 -0.15 -0.02 0.00 0.73 0.00 0.00 38.32 39.31 3n2b h ASN 135 CO 0.01 0.56 -0.17 0.50 -1.29 0.00 0.00 177.43 177.04 3n2b h LYS 136 N 0.56 -0.35 -0.53 6.67 3.64 -0.66 -1.76 116.57 124.15 3n2b h LYS 136 Ca 0.15 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.55 3n2b h LYS 136 Cb 0.14 0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 3n2b h LYS 136 CO -0.02 -0.23 0.30 0.28 -2.27 0.00 0.00 179.45 177.51 3n2b h VAL 137 N -0.37 1.17 -0.34 2.00 2.07 -1.10 -1.54 116.25 118.14 3n2b h VAL 137 Ca 0.01 -0.40 -0.05 0.00 0.82 0.00 0.00 66.70 67.07 3n2b h VAL 137 Cb 0.35 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 3n2b h VAL 137 CO -0.05 0.18 -0.01 0.00 0.02 0.00 0.00 177.57 177.70 3n2b h ALA 138 N 1.14 1.34 -0.41 1.67 0.00 -1.00 -1.20 119.26 120.80 3n2b h ALA 138 Ca 0.19 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 3n2b h ALA 138 Cb 0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3n2b h ALA 138 CO -0.03 0.45 -0.02 0.78 0.00 0.00 0.00 179.25 180.43 3n2b h GLY 139 N 0.85 0.79 1.29 0.00 0.00 -1.01 0.20 103.07 105.19 3n2b h GLY 139 Ca 0.11 -0.59 -0.02 0.00 0.00 0.00 0.00 47.33 46.82 3n2b h GLY 139 CO 0.01 0.55 0.32 0.83 0.00 0.00 0.00 176.54 178.25 3n2b h GLU 140 N 0.56 0.93 -0.00 4.80 5.08 -0.89 -1.35 114.58 123.70 3n2b h GLU 140 Ca 0.11 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3n2b h GLU 140 Cb 0.50 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.58 3n2b h GLU 140 CO 0.02 0.71 -0.22 1.28 -1.00 0.00 0.00 179.01 179.80 3n2b n LEU 141 N -4.35 0.23 -1.87 1.33 4.32 -0.49 -4.94 117.00 111.23 3n2b n LEU 141 Ca 0.06 0.27 -0.13 0.00 -0.02 0.00 0.00 56.01 56.20 3n2b n LEU 141 Cb 0.13 -0.39 0.02 0.00 -1.62 0.00 0.00 43.42 41.57 3n2b n LEU 141 CO 0.38 0.06 0.03 0.61 -1.22 0.00 0.00 177.39 177.24 3n2b n GLY 142 N 1.50 0.03 3.53 -0.72 0.00 0.29 -5.03 105.19 104.80 3n2b n GLY 142 Ca 0.06 -0.25 -0.26 0.00 0.00 0.00 0.00 46.02 45.57 3n2b n GLY 142 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3n2b s VAL 143 N -2.95 0.73 -0.20 1.61 -7.23 0.43 -5.01 120.40 107.79 3n2b s VAL 143 Ca 0.20 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.34 3n2b s VAL 143 Cb -0.09 -2.38 -0.01 0.00 0.56 0.00 0.00 36.38 34.47 3n2b s VAL 143 CO 0.25 0.00 -0.08 -0.54 -0.31 0.00 0.00 175.10 174.42 3n2b s LYS 144 N -3.75 3.35 -0.20 4.82 -0.14 -1.26 -4.27 119.74 118.29 3n2b s LYS 144 Ca 0.23 -0.65 -0.23 0.00 -1.36 0.00 0.00 55.97 53.96 3n2b s LYS 144 Cb 0.03 -2.89 -0.02 0.00 -1.68 0.00 0.00 37.83 33.28 3n2b s LYS 144 CO 0.13 -0.10 0.74 0.00 -0.76 0.00 0.00 175.35 175.36 3n2b s ALA 145 N 1.19 3.56 -0.06 5.17 0.00 0.28 -4.80 121.76 127.11 3n2b s ALA 145 Ca 0.02 -0.16 -0.30 0.00 0.00 0.00 0.00 51.96 51.52 3n2b s ALA 145 Cb -0.14 -3.12 -0.03 0.00 0.00 0.00 0.00 23.12 19.82 3n2b s ALA 145 CO -0.02 -0.68 1.24 -1.25 0.00 0.00 0.00 175.76 175.04 3n2b s PRO 146 N 2.22 4.33 0.23 0.00 0.04 -1.26 -1.07 135.00 139.50 3n2b s PRO 146 Ca 0.33 1.72 0.08 0.00 0.04 0.00 0.00 61.00 63.17 3n2b s PRO 146 Cb -0.16 -3.58 -0.05 0.00 0.04 0.00 0.00 34.50 30.75 3n2b s PRO 146 CO 0.10 -0.49 -0.14 0.96 0.04 0.00 0.00 177.00 177.47 3n2b s ILE 147 N 2.36 1.88 0.02 0.56 -4.36 0.36 -1.07 121.20 120.94 3n2b s ILE 147 Ca 0.57 -2.24 0.01 0.00 -0.26 0.00 0.00 60.65 58.73 3n2b s ILE 147 Cb -0.25 -2.17 -0.01 0.00 1.25 0.00 0.00 42.46 41.27 3n2b s ILE 147 CO 0.22 -0.50 -0.04 -0.55 0.24 0.00 0.00 174.94 174.31 3n2b s SER 148 N -3.38 0.41 -0.13 4.36 0.15 -0.24 -0.43 113.70 114.44 3n2b s SER 148 Ca 0.25 -0.32 -0.05 0.00 0.70 0.00 0.00 55.95 56.53 3n2b s SER 148 Cb -0.01 0.03 -0.04 0.00 -1.71 0.00 0.00 66.02 64.30 3n2b s SER 148 CO 0.09 -0.14 0.04 -0.76 1.20 0.00 0.00 173.24 173.68 3n2b s LEU 149 N -0.91 3.76 -0.42 3.45 1.43 -1.20 -0.47 118.68 124.32 3n2b s LEU 149 Ca -0.07 0.15 -0.27 0.00 -1.03 0.00 0.00 54.13 52.90 3n2b s LEU 149 Cb -0.06 -1.91 0.02 0.00 0.03 0.00 0.00 46.19 44.27 3n2b s LEU 149 CO -0.00 0.29 1.02 -0.60 0.23 0.00 0.00 176.35 177.29 3n2b s ARG 150 N -0.35 3.75 0.05 1.70 6.06 -0.49 -1.35 118.95 128.33 3n2b s ARG 150 Ca 0.08 0.53 0.03 0.00 -2.50 0.00 0.00 55.73 53.87 3n2b s ARG 150 Cb -0.12 -3.86 -0.04 0.00 0.06 0.00 0.00 34.95 30.99 3n2b s ARG 150 CO 0.02 -1.16 0.03 0.42 -2.50 0.00 0.00 175.30 172.11 3n2b s ILE 151 N 3.90 4.25 -0.15 4.11 -1.09 -0.13 -0.26 121.20 131.83 3n2b s ILE 151 Ca 0.42 -0.76 -0.07 0.00 -2.23 0.00 0.00 60.65 58.01 3n2b s ILE 151 Cb -0.10 -2.98 -0.04 0.00 -1.58 0.00 0.00 42.46 37.76 3n2b s ILE 151 CO 0.25 0.22 0.09 0.20 -1.23 0.00 0.00 174.94 174.47 3n2b s ASN 152 N -2.04 5.94 0.38 3.58 0.01 -0.11 -4.44 114.94 118.26 3n2b s ASN 152 Ca 0.24 0.25 -0.28 0.00 -0.71 0.00 0.00 52.86 52.37 3n2b s ASN 152 Cb -0.12 -1.95 -0.11 0.00 0.41 0.00 0.00 41.25 39.49 3n2b s ASN 152 CO 0.16 0.29 1.45 -2.65 -1.51 0.00 0.00 177.10 174.84 3n2b n PRO 153 N 2.78 2.54 -1.87 -0.60 -0.02 -1.26 -3.75 135.00 132.82 3n2b n PRO 153 Ca -0.18 0.89 -0.43 0.00 -2.02 0.00 0.00 63.50 61.76 3n2b n PRO 153 Cb 0.53 -2.60 -0.03 0.00 -0.02 0.00 0.00 33.50 31.38 3n2b n PRO 153 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3n2b s ASP 154 N -0.20 5.99 0.00 2.55 2.15 -1.26 -4.94 116.67 120.97 3n2b s ASP 154 Ca 0.54 1.78 0.00 0.00 0.43 0.00 0.00 52.55 55.30 3n2b s ASP 154 Cb -0.49 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 39.61 3n2b s ASP 154 CO 0.63 -1.55 0.00 1.33 -0.17 0.00 0.00 175.17 175.41 3n2b n VAL 155 N 6.93 0.00 0.97 1.11 0.24 -1.26 -4.97 118.33 121.35 3n2b n VAL 155 Ca 0.23 0.00 0.08 0.00 -2.04 0.00 0.00 64.34 62.61 3n2b n VAL 155 Cb 0.45 -0.04 0.24 0.00 -1.47 0.00 0.00 33.84 33.02 3n2b n VAL 155 CO 0.00 0.00 0.00 2.22 -2.14 0.00 0.00 176.83 176.91 3n2b n PHE 172 N -2.43 0.39 -1.27 6.34 1.16 -1.26 -5.26 117.46 115.13 3n2b n PHE 172 Ca 0.00 -0.19 0.00 0.00 -1.87 0.00 0.00 57.45 55.39 3n2b n PHE 172 Cb 0.00 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 37.87 3n2b n PHE 172 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3n2b n GLY 173 N 1.11 0.35 3.43 4.97 0.00 -1.26 -4.81 105.19 108.98 3n2b n GLY 173 Ca 0.14 -0.68 -0.32 0.00 0.00 0.00 0.00 46.02 45.15 3n2b n GLY 173 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3n2b s ILE 174 N 0.00 2.78 0.66 -0.61 1.01 0.63 -4.88 121.20 120.79 3n2b s ILE 174 Ca 0.00 -0.86 -0.16 0.00 0.00 0.00 0.00 60.65 59.63 3n2b s ILE 174 Cb 0.00 -2.07 0.00 0.00 0.01 0.00 0.00 42.46 40.40 3n2b s ILE 174 CO 0.00 0.57 1.17 0.42 0.00 0.00 0.00 174.94 177.10 3n2b s THR 175 N -0.71 2.73 0.25 2.92 -4.23 -1.26 -0.94 115.64 114.39 3n2b s THR 175 Ca 0.11 0.38 -0.04 0.00 -1.18 0.00 0.00 61.69 60.97 3n2b s THR 175 Cb -0.10 -2.99 0.21 0.00 1.34 0.00 0.00 72.50 70.96 3n2b s THR 175 CO 0.00 -0.17 1.80 -0.26 -0.54 0.00 0.00 174.62 175.46 3n2b h PHE 176 N 0.23 0.82 0.00 3.99 -1.00 -1.92 -1.88 116.94 117.17 3n2b h PHE 176 Ca -0.48 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.33 3n2b h PHE 176 Cb 1.28 -0.25 0.00 0.00 3.61 0.00 0.00 35.95 40.59 3n2b h PHE 176 CO 0.49 0.31 0.00 -0.40 -1.61 0.00 0.00 178.31 177.11 3n2b n ASP 177 N -4.77 0.36 -0.28 2.17 5.68 -1.26 -2.03 116.55 116.42 3n2b n ASP 177 Ca 0.14 0.59 0.05 0.00 -0.50 0.00 0.00 54.79 55.07 3n2b n ASP 177 Cb 0.30 -0.67 0.01 0.00 -1.14 0.00 0.00 41.12 39.62 3n2b n ASP 177 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3n2b n ARG 178 N -1.90 1.70 0.03 0.11 1.74 -0.95 -4.74 116.66 112.66 3n2b n ARG 178 Ca 0.02 -0.74 -0.10 0.00 -0.77 0.00 0.00 57.85 56.26 3n2b n ARG 178 Cb 0.19 -1.12 -0.04 0.00 -1.02 0.00 0.00 32.46 30.47 3n2b n ARG 178 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3n2b h ALA 179 N 1.88 -0.21 -0.68 7.54 0.00 -0.74 -1.24 119.26 125.81 3n2b h ALA 179 Ca 0.00 0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.02 3n2b h ALA 179 Cb 0.38 0.38 -0.07 0.00 0.00 0.00 0.00 17.79 18.48 3n2b h ALA 179 CO 0.00 -0.68 0.33 0.00 0.00 0.00 0.00 179.25 178.90 3n2b h ALA 180 N 0.64 0.92 -0.34 0.00 0.00 -1.85 0.96 119.26 119.59 3n2b h ALA 180 Ca 0.08 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3n2b h ALA 180 Cb 0.40 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3n2b h ALA 180 CO -0.23 -0.06 0.14 0.37 0.00 0.00 0.00 179.25 179.48 3n2b h GLN 181 N 0.58 0.51 -0.30 0.00 4.15 -1.80 -0.79 115.11 117.46 3n2b h GLN 181 Ca 0.33 -0.09 -0.10 0.00 0.77 0.00 0.00 58.65 59.56 3n2b h GLN 181 Cb 0.33 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.92 3n2b h GLN 181 CO -0.25 0.49 -0.24 0.28 -1.93 0.00 0.00 178.83 177.17 3n2b h VAL 182 N 0.41 1.27 -0.49 2.39 2.07 -0.60 -1.11 116.25 120.18 3n2b h VAL 182 Ca 0.11 -1.30 -0.06 0.00 0.82 0.00 0.00 66.70 66.28 3n2b h VAL 182 Cb 0.17 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 3n2b h VAL 182 CO -0.01 0.42 0.06 1.88 0.02 0.00 0.00 177.57 179.94 3n2b h TYR 183 N 0.51 0.81 -0.15 1.57 -1.99 -0.64 -0.89 116.97 116.19 3n2b h TYR 183 Ca 0.07 -0.09 -0.11 0.00 2.00 0.00 0.00 58.73 60.61 3n2b h TYR 183 Cb 0.69 -0.23 -0.01 0.00 2.00 0.00 0.00 36.73 39.18 3n2b h TYR 183 CO 0.03 0.72 -0.37 0.00 -0.00 0.00 0.00 178.16 178.53 3n2b h ARG 184 N 0.74 0.32 -0.13 4.88 3.08 -0.65 -0.67 114.38 121.95 3n2b h ARG 184 Ca 0.16 -0.15 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 3n2b h ARG 184 Cb 0.36 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.40 3n2b h ARG 184 CO 0.01 0.66 -0.01 1.25 -1.07 0.00 0.00 179.97 180.80 3n2b h LEU 185 N 0.27 0.24 -0.76 3.04 5.85 -0.74 -1.25 115.31 121.96 3n2b h LEU 185 Ca 0.03 -0.33 0.06 0.00 0.84 0.00 0.00 57.88 58.48 3n2b h LEU 185 Cb 0.79 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.70 3n2b h LEU 185 CO 0.06 0.51 0.45 0.00 -0.34 0.00 0.00 178.44 179.12 3n2b h ALA 186 N 0.74 1.03 -0.50 1.25 0.00 -0.97 -0.18 119.26 120.63 3n2b h ALA 186 Ca 0.04 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3n2b h ALA 186 Cb 0.39 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3n2b h ALA 186 CO 0.01 0.16 0.17 1.25 0.00 0.00 0.00 179.25 180.84 3n2b h HIS 187 N 0.82 0.73 0.00 0.00 -0.00 -0.91 -2.84 115.15 112.95 3n2b h HIS 187 Ca 0.34 -0.04 0.00 0.00 -0.00 0.00 0.00 60.37 60.67 3n2b h HIS 187 Cb 0.18 -0.22 0.00 0.00 -0.00 0.00 0.00 27.41 27.37 3n2b h HIS 187 CO -0.06 0.58 -0.18 0.77 -0.00 0.00 0.00 177.93 179.05 3n2b h SER 188 N 0.71 0.00 -3.19 3.26 0.02 -0.51 -3.45 113.55 110.39 3n2b h SER 188 Ca 0.17 -0.01 -0.54 0.00 -0.84 0.00 0.00 61.79 60.57 3n2b h SER 188 Cb 0.18 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 3n2b h SER 188 CO -0.01 0.00 0.58 -0.76 -1.14 0.00 0.00 176.83 175.50 3n2b s LEU 189 N -5.79 4.34 0.49 5.07 1.43 -0.15 -4.93 118.68 119.15 3n2b s LEU 189 Ca 0.06 1.90 0.23 0.00 -1.03 0.00 0.00 54.13 55.29 3n2b s LEU 189 Cb 0.07 -3.57 1.29 0.00 0.03 0.00 0.00 46.19 44.01 3n2b s LEU 189 CO 0.68 -0.48 2.03 1.55 0.23 0.00 0.00 176.35 180.37 3n2b h PRO 190 N 7.01 0.00 -0.50 1.29 0.13 -1.86 -3.20 132.00 134.87 3n2b h PRO 190 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 3n2b h PRO 190 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3n2b h PRO 190 CO 0.82 0.15 0.00 0.09 -0.23 0.00 0.00 178.00 178.84 3n2b n ASN 191 N -3.83 4.36 -4.34 1.44 4.13 -1.26 -4.96 115.26 110.80 3n2b n ASN 191 Ca -0.02 -2.56 -0.29 0.00 1.68 0.00 0.00 54.58 53.38 3n2b n ASN 191 Cb 0.25 -0.52 -0.14 0.00 -1.54 0.00 0.00 39.78 37.83 3n2b n ASN 191 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3n2b s LEU 192 N -2.04 2.20 -0.14 3.41 1.43 -1.21 -0.55 118.68 121.78 3n2b s LEU 192 Ca 0.45 -0.61 0.03 0.00 -1.03 0.00 0.00 54.13 52.96 3n2b s LEU 192 Cb 0.31 -1.24 0.01 0.00 0.03 0.00 0.00 46.19 45.29 3n2b s LEU 192 CO 0.18 0.23 -0.22 -1.81 0.23 0.00 0.00 176.35 174.97 3n2b s ASP 193 N -1.39 3.15 -0.21 2.29 1.01 -0.23 -4.85 116.67 116.44 3n2b s ASP 193 Ca 0.12 -0.59 -0.29 0.00 0.71 0.00 0.00 52.55 52.50 3n2b s ASP 193 Cb -0.10 -1.45 0.01 0.00 1.01 0.00 0.00 42.92 42.39 3n2b s ASP 193 CO 0.03 0.09 1.04 -0.69 0.21 0.00 0.00 175.17 175.85 3n2b s VAL 194 N 0.75 4.68 0.00 -1.27 1.01 -1.26 -0.49 120.40 123.81 3n2b s VAL 194 Ca -0.09 2.01 0.00 0.00 0.00 0.00 0.00 61.98 63.91 3n2b s VAL 194 Cb -0.16 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 31.92 3n2b s VAL 194 CO -0.00 -0.15 0.00 1.41 0.00 0.00 0.00 175.10 176.36 3n2b n HIS 195 N 6.12 0.00 -4.15 5.22 8.25 0.42 -4.70 115.22 126.38 3n2b n HIS 195 Ca 0.12 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.42 3n2b n HIS 195 Cb 0.46 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.52 3n2b n HIS 195 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3n2b n GLY 196 N 3.43 2.82 2.93 -1.41 0.00 -0.65 0.54 105.19 112.84 3n2b n GLY 196 Ca 0.00 -1.77 -0.17 0.00 0.00 0.00 0.00 46.02 44.08 3n2b n GLY 196 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3n2b s ILE 197 N -3.01 0.45 -0.23 -0.61 2.07 -0.65 -3.27 121.20 115.95 3n2b s ILE 197 Ca 0.31 -0.17 0.01 0.00 -1.41 0.00 0.00 60.65 59.39 3n2b s ILE 197 Cb 0.01 -0.43 0.04 0.00 0.13 0.00 0.00 42.46 42.21 3n2b s ILE 197 CO 0.22 0.16 -0.13 -0.62 -1.91 0.00 0.00 174.94 172.66 3n2b s ASP 198 N 0.34 3.93 -0.22 4.50 2.15 -0.46 -0.72 116.67 126.19 3n2b s ASP 198 Ca -0.04 -0.99 -0.03 0.00 0.43 0.00 0.00 52.55 51.92 3n2b s ASP 198 Cb -0.08 -1.55 0.07 0.00 -0.30 0.00 0.00 42.92 41.06 3n2b s ASP 198 CO -0.00 -0.10 0.05 0.00 -0.17 0.00 0.00 175.17 174.95 3n2b n HIS 200 N 5.03 2.23 -1.86 0.00 8.25 -1.26 -4.20 115.22 123.41 3n2b n HIS 200 Ca -0.07 -2.00 -0.41 0.00 -0.26 0.00 0.00 57.72 54.98 3n2b n HIS 200 Cb 0.46 -1.91 -0.01 0.00 1.12 0.00 0.00 29.99 29.65 3n2b n HIS 200 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 3n2b n ILE 201 N 5.95 4.44 -2.96 1.59 -5.35 -1.19 -4.97 119.36 116.88 3n2b n ILE 201 Ca 0.50 -3.65 0.04 0.00 -0.27 0.00 0.00 62.75 59.37 3n2b n ILE 201 Cb 0.41 -2.39 0.00 0.00 -1.74 0.00 0.00 39.64 35.92 3n2b n ILE 201 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3n2b s GLY 202 N 1.48 -1.15 0.00 3.28 0.00 -1.26 -5.00 107.32 104.66 3n2b s GLY 202 Ca 0.53 2.01 0.00 0.00 0.00 0.00 0.00 44.72 47.26 3n2b s GLY 202 CO -0.06 4.30 0.00 -0.10 0.00 0.00 0.00 173.10 177.24 3n2b n LEU 208 N 4.43 1.98 -0.14 0.66 0.00 -1.26 -4.69 117.00 117.98 3n2b n LEU 208 Ca 0.08 0.00 -0.08 0.00 0.00 0.00 0.00 56.01 56.01 3n2b n LEU 208 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 43.42 44.03 3n2b n LEU 208 CO -0.17 0.33 1.00 0.00 0.00 0.00 0.00 177.39 178.55 3n2b h ALA 209 N 0.00 0.53 -0.59 1.96 0.00 -2.04 -2.39 119.26 116.73 3n2b h ALA 209 Ca 0.00 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 3n2b h ALA 209 Cb 0.96 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 3n2b h ALA 209 CO 0.00 0.05 0.01 -1.00 0.00 0.00 0.00 179.25 178.31 3n2b h PRO 210 N 0.54 1.02 -0.31 0.00 0.13 -1.99 -1.41 132.00 129.99 3n2b h PRO 210 Ca 0.15 -0.31 0.07 0.00 -0.87 0.00 0.00 66.00 65.04 3n2b h PRO 210 Cb 0.04 -0.10 -0.08 0.00 0.13 0.00 0.00 31.00 30.99 3n2b h PRO 210 CO -0.02 1.00 -0.27 0.35 -0.23 0.00 0.00 178.00 178.82 3n2b h PHE 211 N 0.94 -0.72 -0.54 1.56 3.57 -1.93 0.43 116.94 120.24 3n2b h PHE 211 Ca 0.17 0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.67 3n2b h PHE 211 Cb 0.53 0.36 -0.02 0.00 2.79 0.00 0.00 35.95 39.61 3n2b h PHE 211 CO 0.04 -0.34 0.16 0.82 -2.23 0.00 0.00 178.31 176.76 3n2b h ILE 212 N -0.24 1.24 -0.76 1.41 2.04 -1.34 -0.81 117.51 119.04 3n2b h ILE 212 Ca 0.16 -0.80 -0.04 0.00 1.00 0.00 0.00 64.86 65.18 3n2b h ILE 212 Cb 0.49 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 3n2b h ILE 212 CO -0.45 0.30 0.34 -0.78 0.00 0.00 0.00 178.15 177.55 3n2b h ASP 213 N 0.74 1.03 0.48 1.72 1.82 -0.57 -2.08 116.42 119.56 3n2b h ASP 213 Ca 0.17 -0.15 -0.13 0.00 -0.39 0.00 0.00 57.03 56.53 3n2b h ASP 213 Cb 0.28 -0.27 -0.02 0.00 0.68 0.00 0.00 39.33 40.01 3n2b h ASP 213 CO -0.00 0.90 -0.58 0.00 -1.61 0.00 0.00 179.24 177.94 3n2b h ALA 214 N 1.17 0.98 -0.47 -0.78 0.00 0.00 -2.81 119.26 117.36 3n2b h ALA 214 Ca 0.26 -0.53 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 3n2b h ALA 214 Cb 0.17 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 3n2b h ALA 214 CO -0.03 0.72 0.14 1.15 0.00 0.00 0.00 179.25 181.23 3n2b h THR 215 N 0.08 1.23 -0.21 0.00 2.02 -0.65 -1.36 112.91 114.02 3n2b h THR 215 Ca -0.00 -0.78 -0.01 0.00 0.77 0.00 0.00 66.41 66.39 3n2b h THR 215 Cb 1.04 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 68.29 3n2b h THR 215 CO 0.08 0.28 0.09 0.44 0.37 0.00 0.00 175.52 176.79 3n2b h ASP 216 N 0.62 0.28 -0.31 4.18 3.32 -1.31 -0.72 116.42 122.47 3n2b h ASP 216 Ca 0.15 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.06 3n2b h ASP 216 Cb 0.29 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 3n2b h ASP 216 CO -0.00 0.33 0.20 0.03 -1.72 0.00 0.00 179.24 178.08 3n2b h ARG 217 N 0.20 0.42 -0.10 3.56 3.08 -1.43 -0.11 114.38 120.00 3n2b h ARG 217 Ca 0.07 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.06 3n2b h ARG 217 Cb 0.14 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 3n2b h ARG 217 CO -0.01 0.29 -0.08 1.25 -1.07 0.00 0.00 179.97 180.35 3n2b h LEU 218 N 0.43 0.24 -0.95 3.04 5.85 -0.82 -1.62 115.31 121.48 3n2b h LEU 218 Ca 0.12 -0.47 -0.07 0.00 0.84 0.00 0.00 57.88 58.30 3n2b h LEU 218 Cb -0.03 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 3n2b h LEU 218 CO -0.02 0.65 0.03 -0.07 -0.34 0.00 0.00 178.44 178.69 3n2b h LEU 219 N -0.17 0.76 -0.90 2.25 3.38 -0.71 -1.16 115.31 118.74 3n2b h LEU 219 Ca 0.02 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 3n2b h LEU 219 Cb 0.58 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 3n2b h LEU 219 CO 0.02 0.81 0.25 0.00 0.09 0.00 0.00 178.44 179.61 3n2b h ALA 220 N 1.28 1.12 -0.61 1.53 0.00 -1.01 -1.84 119.26 119.74 3n2b h ALA 220 Ca 0.15 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 3n2b h ALA 220 Cb 0.41 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3n2b h ALA 220 CO 0.01 0.62 0.04 1.25 0.00 0.00 0.00 179.25 181.18 3n2b h LEU 221 N 1.03 1.02 -1.09 0.00 5.85 -0.66 -1.20 115.31 120.27 3n2b h LEU 221 Ca 0.23 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 3n2b h LEU 221 Cb 0.24 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 3n2b h LEU 221 CO -0.02 1.06 0.40 0.40 -0.34 0.00 0.00 178.44 179.94 3n2b h ILE 222 N 0.96 1.22 0.05 4.05 2.04 -0.88 -1.38 117.51 123.57 3n2b h ILE 222 Ca 0.18 -0.56 -0.00 0.00 1.00 0.00 0.00 64.86 65.47 3n2b h ILE 222 Cb 0.51 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 36.81 3n2b h ILE 222 CO 0.02 0.25 -0.02 0.44 0.00 0.00 0.00 178.15 178.84 3n2b h ASP 223 N 1.04 -0.05 -0.88 1.72 3.32 -0.99 -1.66 116.42 118.92 3n2b h ASP 223 Ca 0.26 -0.39 0.01 0.00 0.02 0.00 0.00 57.03 56.92 3n2b h ASP 223 Cb 0.04 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.56 3n2b h ASP 223 CO -0.04 0.37 0.57 0.77 -1.72 0.00 0.00 179.24 179.19 3n2b h SER 224 N -0.49 1.02 -0.73 6.45 4.64 -1.15 -1.79 113.55 121.50 3n2b h SER 224 Ca -0.01 -0.04 -0.06 0.00 -0.47 0.00 0.00 61.79 61.22 3n2b h SER 224 Cb 0.44 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 62.25 3n2b h SER 224 CO 0.01 0.75 0.21 -0.07 -0.87 0.00 0.00 176.83 176.86 3n2b h LEU 225 N 1.19 1.08 -1.01 5.97 3.38 -1.28 -2.59 115.31 122.06 3n2b h LEU 225 Ca 0.32 -0.21 0.06 0.00 0.09 0.00 0.00 57.88 58.14 3n2b h LEU 225 Cb -0.12 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 40.28 3n2b h LEU 225 CO -0.07 1.01 0.65 0.50 0.09 0.00 0.00 178.44 180.62 3n2b h LYS 226 N 1.10 1.16 -0.04 1.13 3.64 -0.56 -0.49 116.57 122.51 3n2b h LYS 226 Ca 0.23 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.51 3n2b h LYS 226 Cb 0.33 -0.26 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 3n2b h LYS 226 CO -0.00 0.77 -0.16 0.00 -2.27 0.00 0.00 179.45 177.79 3n2b h ALA 227 N 1.45 1.67 -0.08 5.00 0.00 -0.96 -2.13 119.26 124.21 3n2b h ALA 227 Ca 0.43 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3n2b h ALA 227 Cb 0.14 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3n2b h ALA 227 CO -0.17 0.25 0.00 0.39 0.00 0.00 0.00 179.25 179.72 3n2b n GLU 228 N -4.32 1.50 -1.01 0.00 1.02 -0.29 -4.91 120.64 112.62 3n2b n GLU 228 Ca -0.02 -0.75 0.00 0.00 -0.02 0.00 0.00 57.16 56.37 3n2b n GLU 228 Cb 0.24 -1.41 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 3n2b n GLU 228 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3n2b n GLY 229 N 1.06 0.57 3.13 0.62 0.00 -0.80 -5.03 105.19 104.75 3n2b n GLY 229 Ca 0.17 -0.82 -0.35 0.00 0.00 0.00 0.00 46.02 45.02 3n2b n GLY 229 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3n2b s ILE 230 N -2.00 2.97 -0.45 -0.61 1.01 -0.61 -5.02 121.20 116.50 3n2b s ILE 230 Ca 0.00 -1.76 -0.11 0.00 0.00 0.00 0.00 60.65 58.78 3n2b s ILE 230 Cb 0.00 -2.89 0.09 0.00 0.01 0.00 0.00 42.46 39.67 3n2b s ILE 230 CO 0.00 -0.38 0.33 -1.00 0.00 0.00 0.00 174.94 173.90 3n2b s HIS 231 N 1.16 3.32 -0.20 3.97 3.76 -1.26 -2.71 115.29 123.33 3n2b s HIS 231 Ca 0.02 -1.42 -0.28 0.00 -0.15 0.00 0.00 55.06 53.22 3n2b s HIS 231 Cb -0.21 -3.19 0.00 0.00 1.11 0.00 0.00 32.58 30.29 3n2b s HIS 231 CO -0.03 -0.88 1.00 0.42 -0.85 0.00 0.00 174.74 174.40 3n2b s ILE 232 N 1.48 4.73 -0.10 0.60 1.01 -1.26 -4.57 121.20 123.08 3n2b s ILE 232 Ca 0.04 1.97 0.21 0.00 0.00 0.00 0.00 60.65 62.87 3n2b s ILE 232 Cb -0.25 -4.28 -0.23 0.00 0.01 0.00 0.00 42.46 37.71 3n2b s ILE 232 CO 0.03 -0.12 0.61 0.54 0.00 0.00 0.00 174.94 176.00 3n2b n ARG 233 N 5.97 0.65 -3.89 2.79 1.74 0.19 -4.88 116.66 119.22 3n2b n ARG 233 Ca 0.10 -0.07 -0.10 0.00 -0.77 0.00 0.00 57.85 57.02 3n2b n ARG 233 Cb 0.47 -1.62 -0.09 0.00 -1.02 0.00 0.00 32.46 30.20 3n2b n ARG 233 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 3n2b s HIS 234 N -3.34 0.13 -0.13 -1.55 -3.43 -0.89 -1.62 115.29 104.46 3n2b s HIS 234 Ca -0.06 -0.38 0.02 0.00 -0.80 0.00 0.00 55.06 53.84 3n2b s HIS 234 Cb 0.12 -0.09 0.02 0.00 -1.43 0.00 0.00 32.58 31.20 3n2b s HIS 234 CO 0.86 -0.39 -0.17 -1.17 -2.00 0.00 0.00 174.74 171.88 3n2b s LEU 235 N -2.06 1.82 -0.29 5.38 2.96 -0.37 -1.63 118.68 124.48 3n2b s LEU 235 Ca -0.06 -0.49 -0.08 0.00 -0.22 0.00 0.00 54.13 53.29 3n2b s LEU 235 Cb -0.02 -1.20 -0.00 0.00 0.50 0.00 0.00 46.19 45.47 3n2b s LEU 235 CO -0.04 0.02 0.10 -0.62 -1.32 0.00 0.00 176.35 174.49 3n2b s ASP 236 N 1.05 5.24 0.00 3.68 -1.08 0.10 -0.32 116.67 125.34 3n2b s ASP 236 Ca -0.04 -0.55 0.23 0.00 -0.52 0.00 0.00 52.55 51.67 3n2b s ASP 236 Cb -0.15 -1.92 0.51 0.00 -1.46 0.00 0.00 42.92 39.91 3n2b s ASP 236 CO -0.04 -0.16 1.44 1.33 0.52 0.00 0.00 175.17 178.26 3n2b n VAL 237 N 4.91 0.37 -4.33 1.11 0.24 -0.10 -0.35 118.33 120.19 3n2b n VAL 237 Ca -0.15 -0.60 0.00 0.00 -2.04 0.00 0.00 64.34 61.55 3n2b n VAL 237 Cb 0.49 0.82 0.00 0.00 -1.47 0.00 0.00 33.84 33.68 3n2b n VAL 237 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3n2b n GLY 238 N 1.38 -0.67 0.00 7.63 0.00 -1.26 -3.16 105.19 109.11 3n2b n GLY 238 Ca 0.18 -1.15 0.00 0.00 0.00 0.00 0.00 46.02 45.05 3n2b n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n2b n GLY 239 N 0.00 2.69 2.73 -0.02 0.00 -1.24 -1.14 105.19 108.20 3n2b n GLY 239 Ca 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.16 3n2b n GLY 239 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n2b n GLY 240 N 5.00 0.39 3.87 -0.02 0.00 -1.26 -4.40 105.19 108.76 3n2b n GLY 240 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 3n2b n GLY 240 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3n2b s LEU 241 N 0.00 3.54 0.00 0.99 1.02 -1.26 -4.93 118.68 118.04 3n2b s LEU 241 Ca 0.00 -0.57 0.00 0.00 0.02 0.00 0.00 54.13 53.58 3n2b s LEU 241 Cb 0.00 -2.19 0.00 0.00 0.02 0.00 0.00 46.19 44.02 3n2b s LEU 241 CO 0.00 -0.46 0.00 0.61 0.02 0.00 0.00 176.35 176.52 3n2b n GLY 242 N -1.45 0.00 3.48 -3.19 0.00 -1.26 -4.81 105.19 97.97 3n2b n GLY 242 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 3n2b n GLY 242 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3n2b s VAL 243 N 0.00 3.80 -0.24 1.61 1.01 -1.26 -0.59 120.40 124.73 3n2b s VAL 243 Ca 0.00 -0.39 -0.07 0.00 0.00 0.00 0.00 61.98 61.52 3n2b s VAL 243 Cb 0.00 -2.66 -0.03 0.00 0.00 0.00 0.00 36.38 33.69 3n2b s VAL 243 CO 0.00 0.50 0.06 -0.69 0.00 0.00 0.00 175.10 174.97 3n2b s VAL 244 N 0.35 4.31 0.13 2.92 1.01 0.95 -4.87 120.40 125.20 3n2b s VAL 244 Ca -0.05 -0.18 0.06 0.00 0.00 0.00 0.00 61.98 61.82 3n2b s VAL 244 Cb -0.14 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.20 3n2b s VAL 244 CO 0.03 0.36 -0.15 -0.47 0.00 0.00 0.00 175.10 174.87 3n2b s TYR 245 N 1.43 1.49 0.00 5.22 5.04 -1.26 -0.75 117.35 128.52 3n2b s TYR 245 Ca 0.05 -0.53 0.00 0.00 -2.44 0.00 0.00 57.07 54.16 3n2b s TYR 245 Cb -0.15 -0.78 0.00 0.00 0.35 0.00 0.00 41.96 41.39 3n2b s TYR 245 CO 0.03 0.18 0.00 -0.35 -1.34 0.00 0.00 175.55 174.07 3n2b n PRO 250 N 0.55 0.00 -1.92 4.97 -0.04 -1.26 -5.00 135.00 132.30 3n2b n PRO 250 Ca -0.15 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 62.91 3n2b n PRO 250 Cb 0.57 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.04 3n2b n PRO 250 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3n2b s PRO 251 N -0.48 3.75 0.26 0.54 0.04 -1.26 -5.04 135.00 132.81 3n2b s PRO 251 Ca 0.00 2.27 0.11 0.00 0.04 0.00 0.00 61.00 63.42 3n2b s PRO 251 Cb 0.00 -2.64 -0.05 0.00 0.04 0.00 0.00 34.50 31.85 3n2b s PRO 251 CO 0.00 -0.71 -0.14 -0.65 0.04 0.00 0.00 177.00 175.53 3n2b s GLN 252 N -2.42 1.86 0.90 4.56 -0.21 0.07 -4.36 119.66 120.06 3n2b s GLN 252 Ca 0.60 -1.63 -0.12 0.00 0.02 0.00 0.00 55.36 54.23 3n2b s GLN 252 Cb -0.40 -1.90 0.13 0.00 1.00 0.00 0.00 33.01 31.83 3n2b s GLN 252 CO 0.51 0.35 1.12 -1.25 -2.12 0.00 0.00 175.29 173.91 3n2b s PRO 253 N -3.46 1.25 0.90 2.91 0.04 -1.26 -0.04 135.00 135.35 3n2b s PRO 253 Ca 0.29 0.40 -0.12 0.00 0.04 0.00 0.00 61.00 61.62 3n2b s PRO 253 Cb -0.06 -1.84 0.13 0.00 0.04 0.00 0.00 34.50 32.77 3n2b s PRO 253 CO 0.16 -2.14 1.13 -1.54 0.04 0.00 0.00 177.00 174.64 3n2b s SER 254 N -3.92 3.56 0.44 6.66 1.04 0.24 -4.31 113.70 117.41 3n2b s SER 254 Ca 0.63 1.05 0.11 0.00 0.48 0.00 0.00 55.95 58.23 3n2b s SER 254 Cb -0.15 -1.66 1.00 0.00 0.10 0.00 0.00 66.02 65.30 3n2b s SER 254 CO 0.54 -2.53 2.04 1.05 0.98 0.00 0.00 173.24 175.32 3n2b h GLU 255 N -1.48 0.40 0.69 4.02 9.09 -1.96 0.55 114.58 125.89 3n2b h GLU 255 Ca -0.50 -0.02 -0.03 0.00 0.05 0.00 0.00 59.36 58.85 3n2b h GLU 255 Cb 1.32 -0.09 0.01 0.00 -1.65 0.00 0.00 28.75 28.34 3n2b h GLU 255 CO 0.61 0.26 -0.33 1.88 0.05 0.00 0.00 179.01 181.48 3n2b h TYR 256 N 0.41 -0.86 -0.75 2.06 0.05 -1.94 0.56 116.97 116.50 3n2b h TYR 256 Ca 0.19 -0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.94 3n2b h TYR 256 Cb 0.22 0.29 -0.04 0.00 1.01 0.00 0.00 36.73 38.21 3n2b h TYR 256 CO -0.00 -0.51 0.44 0.00 -1.05 0.00 0.00 178.16 177.04 3n2b h ALA 257 N -0.82 0.96 -0.69 3.88 0.00 -1.74 -2.02 119.26 118.83 3n2b h ALA 257 Ca -0.10 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.77 3n2b h ALA 257 Cb 0.74 -0.30 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 3n2b h ALA 257 CO 0.16 0.44 0.41 -0.22 0.00 0.00 0.00 179.25 180.03 3n2b h LYS 258 N 1.03 0.74 -0.48 0.00 3.64 0.15 0.81 116.57 122.45 3n2b h LYS 258 Ca 0.27 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.58 3n2b h LYS 258 Cb -0.02 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.61 3n2b h LYS 258 CO -0.05 0.49 0.21 0.00 -2.27 0.00 0.00 179.45 177.83 3n2b h ALA 259 N 1.33 1.47 0.06 5.00 0.00 -0.24 -2.48 119.26 124.42 3n2b h ALA 259 Ca 0.30 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 3n2b h ALA 259 Cb 0.12 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3n2b h ALA 259 CO -0.15 0.41 -0.03 1.25 0.00 0.00 0.00 179.25 180.73 3n2b h LEU 260 N 0.67 -0.07 -1.04 0.00 5.85 -0.64 -3.24 115.31 116.84 3n2b h LEU 260 Ca 0.17 -0.56 0.14 0.00 0.84 0.00 0.00 57.88 58.47 3n2b h LEU 260 Cb 0.10 0.02 -0.09 0.00 0.37 0.00 0.00 40.66 41.06 3n2b h LEU 260 CO -0.02 0.59 0.62 -0.07 -0.34 0.00 0.00 178.44 179.22 3n2b h LEU 261 N -0.81 0.85 -1.40 2.25 3.38 -0.81 -0.92 115.31 117.85 3n2b h LEU 261 Ca -0.01 0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 3n2b h LEU 261 Cb 0.63 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 3n2b h LEU 261 CO 0.01 0.41 -0.30 0.44 0.09 0.00 0.00 178.44 179.09 3n2b h ASP 262 N 0.89 0.00 0.03 -0.43 3.32 -1.55 -2.27 116.42 116.41 3n2b h ASP 262 Ca 0.52 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.57 3n2b h ASP 262 Cb 0.64 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.19 3n2b h ASP 262 CO -0.29 0.30 -0.03 0.54 -1.72 0.00 0.00 179.24 178.04 3n2b n ARG 263 N -4.10 1.46 -0.34 3.56 1.74 -0.38 -4.00 116.66 114.60 3n2b n ARG 263 Ca -0.02 -0.76 0.07 0.00 -0.77 0.00 0.00 57.85 56.37 3n2b n ARG 263 Cb 0.35 -1.48 0.22 0.00 -1.02 0.00 0.00 32.46 30.53 3n2b n ARG 263 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3n2b n LEU 264 N -0.10 3.52 0.09 0.55 4.77 -0.85 -4.25 117.00 120.73 3n2b n LEU 264 Ca 0.19 -2.54 -0.11 0.00 -0.03 0.00 0.00 56.01 53.53 3n2b n LEU 264 Cb 0.32 -0.41 -0.07 0.00 -2.33 0.00 0.00 43.42 40.93 3n2b n LEU 264 CO 0.18 0.70 0.38 -0.33 -1.33 0.00 0.00 177.39 177.00 3n2b h GLU 265 N 2.03 -0.28 -0.64 3.23 4.39 -1.69 -3.27 114.58 118.35 3n2b h GLU 265 Ca 0.00 0.02 -0.08 0.00 0.34 0.00 0.00 59.36 59.64 3n2b h GLU 265 Cb 1.13 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.82 3n2b h GLU 265 CO 0.13 0.09 0.10 0.07 -1.16 0.00 0.00 179.01 178.24 3n2b h ARG 266 N -0.90 1.05 -6.05 2.33 -0.00 -1.88 -3.37 114.38 105.56 3n2b h ARG 266 Ca -0.03 -0.28 -0.61 0.00 -0.00 0.00 0.00 59.98 59.05 3n2b h ARG 266 Cb 0.50 -0.12 -0.10 0.00 -0.00 0.00 0.00 29.97 30.25 3n2b h ARG 266 CO 0.05 0.98 1.64 -1.01 -0.00 0.00 0.00 179.97 181.63 3n2b s HIS 267 N -5.21 2.58 0.19 4.08 3.76 -1.23 -4.95 115.29 114.50 3n2b s HIS 267 Ca -0.12 -0.99 0.00 0.00 -0.15 0.00 0.00 55.06 53.80 3n2b s HIS 267 Cb 0.14 -4.71 -0.04 0.00 1.11 0.00 0.00 32.58 29.08 3n2b s HIS 267 CO 0.84 -1.91 0.07 1.03 -0.85 0.00 0.00 174.74 173.92 3n2b s ARG 268 N 4.84 1.15 -0.84 1.40 0.52 -1.26 -3.97 118.95 120.79 3n2b s ARG 268 Ca 0.48 -1.59 -0.03 0.00 -0.52 0.00 0.00 55.73 54.07 3n2b s ARG 268 Cb 0.01 0.02 0.20 0.00 0.52 0.00 0.00 34.95 35.69 3n2b s ARG 268 CO -0.06 -0.27 2.33 -0.40 0.02 0.00 0.00 175.30 176.91 3n2b n ASP 269 N -0.26 7.25 -4.46 0.23 5.75 -1.26 -5.09 116.55 118.70 3n2b n ASP 269 Ca -0.02 -3.45 -0.46 0.00 -0.01 0.00 0.00 54.79 50.84 3n2b n ASP 269 Cb 0.65 -1.20 -0.08 0.00 -1.03 0.00 0.00 41.12 39.45 3n2b n ASP 269 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3n2b n LEU 270 N 0.51 1.74 -4.75 -2.12 4.77 -1.26 -4.89 117.00 111.00 3n2b n LEU 270 Ca 0.53 0.20 -0.41 0.00 -0.03 0.00 0.00 56.01 56.30 3n2b n LEU 270 Cb 0.35 -1.24 -0.03 0.00 -2.33 0.00 0.00 43.42 40.17 3n2b n LEU 270 CO 0.49 -0.90 0.98 -0.70 -1.33 0.00 0.00 177.39 175.93 3n2b s GLU 271 N 7.15 4.39 -0.21 3.23 2.12 -0.64 -4.80 118.70 129.95 3n2b s GLU 271 Ca 1.13 2.10 -0.11 0.00 0.36 0.00 0.00 54.97 58.45 3n2b s GLU 271 Cb -0.84 -3.16 -0.05 0.00 0.26 0.00 0.00 34.13 30.35 3n2b s GLU 271 CO 0.45 -0.22 0.17 -0.51 -0.54 0.00 0.00 175.26 174.62 3n2b s LEU 272 N -0.62 4.18 -0.16 2.70 1.43 -0.36 -1.24 118.68 124.61 3n2b s LEU 272 Ca 0.54 0.24 -0.02 0.00 -1.03 0.00 0.00 54.13 53.86 3n2b s LEU 272 Cb -0.37 -2.15 -0.02 0.00 0.03 0.00 0.00 46.19 43.68 3n2b s LEU 272 CO 0.42 0.12 -0.08 -0.63 0.23 0.00 0.00 176.35 176.41 3n2b s ILE 273 N 0.64 3.39 0.03 -0.59 1.01 0.56 -1.08 121.20 125.17 3n2b s ILE 273 Ca 0.09 -0.53 0.06 0.00 0.00 0.00 0.00 60.65 60.28 3n2b s ILE 273 Cb -0.12 -2.48 -0.03 0.00 0.01 0.00 0.00 42.46 39.84 3n2b s ILE 273 CO 0.01 0.49 -0.16 -0.36 0.00 0.00 0.00 174.94 174.92 3n2b s PHE 274 N 0.66 2.62 -0.56 3.97 0.08 -0.90 -0.92 117.98 122.94 3n2b s PHE 274 Ca -0.04 -0.21 0.06 0.00 0.12 0.00 0.00 56.93 56.85 3n2b s PHE 274 Cb -0.15 -1.49 0.33 0.00 -0.57 0.00 0.00 43.02 41.14 3n2b s PHE 274 CO 0.02 0.27 0.90 0.39 -0.10 0.00 0.00 175.22 176.71 3n2b n GLU 275 N 1.56 2.90 -2.25 0.44 1.02 -0.30 -0.47 120.64 123.54 3n2b n GLU 275 Ca -0.16 -4.67 -0.39 0.00 -0.02 0.00 0.00 57.16 51.92 3n2b n GLU 275 Cb 0.52 -2.17 -0.02 0.00 -0.02 0.00 0.00 31.44 29.75 3n2b n GLU 275 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3n2b s PRO 276 N -3.23 4.11 0.00 3.49 0.04 -1.26 -3.69 135.00 134.47 3n2b s PRO 276 Ca 0.47 1.92 0.00 0.00 0.04 0.00 0.00 61.00 63.43 3n2b s PRO 276 Cb 0.27 -2.76 0.00 0.00 0.04 0.00 0.00 34.50 32.05 3n2b s PRO 276 CO -0.12 -0.29 0.00 0.41 0.04 0.00 0.00 177.00 177.04 3n2b n GLY 277 N 0.70 0.07 0.31 0.56 0.00 -1.26 -1.15 105.19 104.41 3n2b n GLY 277 Ca 0.03 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.12 3n2b n GLY 277 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3n2b h ARG 278 N 0.00 0.66 -0.04 1.61 2.43 -1.91 0.22 114.38 117.35 3n2b h ARG 278 Ca 0.00 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.14 3n2b h ARG 278 Cb 0.00 -0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 29.40 3n2b h ARG 278 CO 0.00 0.44 0.03 0.00 -1.51 0.00 0.00 179.97 178.92 3n2b h ALA 279 N 1.53 1.98 0.07 2.80 0.00 -1.89 0.72 119.26 124.47 3n2b h ALA 279 Ca 0.45 -0.00 -0.32 0.00 0.00 0.00 0.00 54.91 55.04 3n2b h ALA 279 Cb 0.58 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 3n2b h ALA 279 CO -0.33 -0.05 -1.74 -0.89 0.00 0.00 0.00 179.25 176.24 3n2b n ILE 280 N -4.45 1.67 -0.05 0.00 5.41 -0.10 -4.73 119.36 117.11 3n2b n ILE 280 Ca -0.02 -0.40 -0.03 0.00 1.00 0.00 0.00 62.75 63.30 3n2b n ILE 280 Cb 0.13 -1.85 -0.15 0.00 -0.71 0.00 0.00 39.64 37.05 3n2b n ILE 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3n2b n ALA 281 N -3.21 1.88 0.12 -1.39 0.00 -0.25 -4.47 120.51 113.19 3n2b n ALA 281 Ca -0.33 -0.98 -0.14 0.00 0.00 0.00 0.00 53.44 51.99 3n2b n ALA 281 Cb 0.90 -0.48 -0.07 0.00 0.00 0.00 0.00 19.45 19.79 3n2b n ALA 281 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3n2b h ALA 282 N 1.30 -0.72 0.00 0.00 0.00 -1.05 -2.10 119.26 116.69 3n2b h ALA 282 Ca -0.34 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3n2b h ALA 282 Cb 1.83 0.67 0.00 0.00 0.00 0.00 0.00 17.79 20.29 3n2b h ALA 282 CO 0.03 -0.97 0.00 0.09 0.00 0.00 0.00 179.25 178.40 3n2b n ASN 283 N -5.46 0.00 -0.14 0.00 3.02 -1.26 -1.04 115.26 110.38 3n2b n ASN 283 Ca -0.07 -0.31 0.12 0.00 -0.03 0.00 0.00 54.58 54.29 3n2b n ASN 283 Cb 0.37 -0.22 0.65 0.00 -0.61 0.00 0.00 39.78 39.97 3n2b n ASN 283 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3n2b n ALA 284 N -1.22 2.62 -2.92 5.41 0.00 -0.79 -4.78 120.51 118.82 3n2b n ALA 284 Ca 0.15 -0.24 -0.11 0.00 0.00 0.00 0.00 53.44 53.25 3n2b n ALA 284 Cb 0.20 -1.32 -0.11 0.00 0.00 0.00 0.00 19.45 18.21 3n2b n ALA 284 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3n2b s GLY 285 N -1.76 0.32 0.11 0.00 0.00 -1.19 -0.96 107.32 103.84 3n2b s GLY 285 Ca 0.36 -0.60 0.05 0.00 0.00 0.00 0.00 44.72 44.53 3n2b s GLY 285 CO 0.29 -0.65 -0.12 -1.34 0.00 0.00 0.00 173.10 171.27 3n2b s VAL 286 N -1.28 1.12 -0.24 1.40 -7.23 -0.41 -1.66 120.40 112.11 3n2b s VAL 286 Ca -0.12 -1.67 -0.05 0.00 -1.81 0.00 0.00 61.98 58.33 3n2b s VAL 286 Cb -0.09 -1.43 -0.01 0.00 0.56 0.00 0.00 36.38 35.41 3n2b s VAL 286 CO -0.00 -0.49 0.00 -0.22 -0.31 0.00 0.00 175.10 174.08 3n2b s LEU 287 N -2.43 3.15 -0.13 1.32 2.96 -0.97 -0.99 118.68 121.59 3n2b s LEU 287 Ca 0.07 -0.37 -0.16 0.00 -0.22 0.00 0.00 54.13 53.46 3n2b s LEU 287 Cb -0.04 -1.81 -0.05 0.00 0.50 0.00 0.00 46.19 44.80 3n2b s LEU 287 CO 0.01 -0.04 0.38 -0.69 -1.32 0.00 0.00 176.35 174.69 3n2b s VAL 288 N 1.52 5.23 0.03 1.68 1.01 0.39 -0.58 120.40 129.68 3n2b s VAL 288 Ca 0.06 0.74 -0.00 0.00 0.00 0.00 0.00 61.98 62.77 3n2b s VAL 288 Cb -0.15 -3.71 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 3n2b s VAL 288 CO -0.01 0.38 -0.03 0.28 0.00 0.00 0.00 175.10 175.73 3n2b s THR 289 N 0.36 0.14 -0.06 3.92 -1.32 -0.21 -1.49 115.64 116.98 3n2b s THR 289 Ca 0.21 -1.17 -0.00 0.00 -1.21 0.00 0.00 61.69 59.52 3n2b s THR 289 Cb -0.14 -0.63 -0.03 0.00 -1.51 0.00 0.00 72.50 70.18 3n2b s THR 289 CO 0.07 -0.64 -0.02 -0.75 -2.21 0.00 0.00 174.62 171.07 3n2b s LYS 290 N -2.18 2.85 -0.23 7.08 2.20 -1.26 -0.22 119.74 127.98 3n2b s LYS 290 Ca -0.09 -0.50 -0.28 0.00 -0.36 0.00 0.00 55.97 54.74 3n2b s LYS 290 Cb -0.05 -2.69 0.00 0.00 -1.51 0.00 0.00 37.83 33.59 3n2b s LYS 290 CO -0.04 0.67 0.97 0.08 -0.36 0.00 0.00 175.35 176.68 3n2b s VAL 291 N -0.91 4.73 -0.15 4.02 1.01 0.25 -1.45 120.40 127.91 3n2b s VAL 291 Ca 0.14 1.89 -0.14 0.00 0.00 0.00 0.00 61.98 63.88 3n2b s VAL 291 Cb -0.11 -4.25 -0.10 0.00 0.00 0.00 0.00 36.38 31.91 3n2b s VAL 291 CO 0.04 -0.14 0.12 -0.33 0.00 0.00 0.00 175.10 174.79 3n2b h GLU 292 N 7.50 0.00 -3.99 2.72 4.39 -0.58 0.64 114.58 125.26 3n2b h GLU 292 Ca -0.21 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.33 3n2b h GLU 292 Cb 1.07 0.00 -0.20 0.00 -0.10 0.00 0.00 28.75 29.52 3n2b h GLU 292 CO 0.94 0.43 -0.69 -0.06 -1.16 0.00 0.00 179.01 178.47 3n2b s PHE 293 N -2.12 0.28 -0.13 4.33 0.08 -1.14 -4.49 117.98 114.78 3n2b s PHE 293 Ca -0.16 -0.56 -0.01 0.00 0.12 0.00 0.00 56.93 56.32 3n2b s PHE 293 Cb 0.02 -0.20 -0.02 0.00 -0.57 0.00 0.00 43.02 42.25 3n2b s PHE 293 CO 0.35 -0.21 -0.11 -0.51 -0.10 0.00 0.00 175.22 174.64 3n2b s LEU 294 N -1.58 2.86 0.02 -0.37 1.43 -1.26 -0.51 118.68 119.27 3n2b s LEU 294 Ca -0.14 -0.27 0.06 0.00 -1.03 0.00 0.00 54.13 52.75 3n2b s LEU 294 Cb -0.08 -1.65 -0.02 0.00 0.03 0.00 0.00 46.19 44.46 3n2b s LEU 294 CO -0.02 0.18 -0.17 -0.75 0.23 0.00 0.00 176.35 175.82 3n2b s LYS 295 N 0.28 1.19 -0.07 1.70 2.20 0.61 -4.99 119.74 120.66 3n2b s LYS 295 Ca -0.08 -0.74 0.03 0.00 -0.36 0.00 0.00 55.97 54.82 3n2b s LYS 295 Cb -0.15 -1.21 0.01 0.00 -1.51 0.00 0.00 37.83 34.97 3n2b s LYS 295 CO 0.05 0.32 -0.14 -1.01 -0.36 0.00 0.00 175.35 174.21 3n2b s HIS 296 N -0.66 1.59 0.55 4.03 3.76 -1.26 -0.22 115.29 123.08 3n2b s HIS 296 Ca 0.05 -0.59 0.04 0.00 -0.15 0.00 0.00 55.06 54.41 3n2b s HIS 296 Cb -0.07 -1.14 0.04 0.00 1.11 0.00 0.00 32.58 32.51 3n2b s HIS 296 CO 0.01 -0.29 0.31 0.95 -0.85 0.00 0.00 174.74 174.87 3n2b s THR 297 N 0.61 1.39 0.22 1.30 -4.23 0.56 -5.01 115.64 110.48 3n2b s THR 297 Ca -0.15 -1.62 -0.08 0.00 -1.18 0.00 0.00 61.69 58.66 3n2b s THR 297 Cb -0.16 -2.01 0.17 0.00 1.34 0.00 0.00 72.50 71.84 3n2b s THR 297 CO 0.04 0.00 1.73 -0.08 -0.54 0.00 0.00 174.62 175.77 3n2b h GLU 298 N 0.83 0.36 0.00 3.99 4.81 -2.05 -3.24 114.58 119.28 3n2b h GLU 298 Ca -0.38 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.83 3n2b h GLU 298 Cb 1.31 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.61 3n2b h GLU 298 CO 0.61 0.24 0.00 0.72 -0.73 0.00 0.00 179.01 179.84 3n2b n HIS 299 N -5.04 0.00 -4.33 0.92 8.25 -1.26 -5.08 115.22 108.68 3n2b n HIS 299 Ca 0.10 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.39 3n2b n HIS 299 Cb 0.32 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.33 3n2b n HIS 299 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3n2b s LYS 300 N -0.34 1.33 -0.02 -0.41 1.02 -1.22 -5.11 119.74 114.98 3n2b s LYS 300 Ca 0.00 -1.67 0.02 0.00 0.02 0.00 0.00 55.97 54.35 3n2b s LYS 300 Cb 0.00 -0.66 0.00 0.00 -0.52 0.00 0.00 37.83 36.65 3n2b s LYS 300 CO 0.00 -0.07 -0.09 -0.80 -0.92 0.00 0.00 175.35 173.47 3n2b s ASN 301 N -3.31 1.11 -0.05 2.83 0.01 -1.25 -0.32 114.94 113.96 3n2b s ASN 301 Ca 0.28 -0.17 0.05 0.00 -0.71 0.00 0.00 52.86 52.30 3n2b s ASN 301 Cb 0.05 -0.25 -0.01 0.00 0.41 0.00 0.00 41.25 41.46 3n2b s ASN 301 CO 0.08 0.07 -0.19 -0.36 -1.51 0.00 0.00 177.10 175.19 3n2b s PHE 302 N 0.08 1.93 -0.29 2.20 0.08 0.69 -1.64 117.98 121.03 3n2b s PHE 302 Ca -0.01 -0.57 -0.04 0.00 0.12 0.00 0.00 56.93 56.43 3n2b s PHE 302 Cb -0.07 -1.29 0.03 0.00 -0.57 0.00 0.00 43.02 41.12 3n2b s PHE 302 CO 0.00 -0.19 0.02 0.00 -0.10 0.00 0.00 175.22 174.96 3n2b s ALA 303 N -0.01 2.90 -0.30 5.36 0.00 -0.71 -0.29 121.76 128.71 3n2b s ALA 303 Ca -0.04 -1.58 -0.26 0.00 0.00 0.00 0.00 51.96 50.08 3n2b s ALA 303 Cb -0.12 -1.99 0.01 0.00 0.00 0.00 0.00 23.12 21.02 3n2b s ALA 303 CO 0.03 -1.04 0.91 0.42 0.00 0.00 0.00 175.76 176.08 3n2b s ILE 304 N 1.38 4.68 0.35 0.00 -1.09 0.34 -1.38 121.20 125.48 3n2b s ILE 304 Ca -0.01 1.46 0.07 0.00 -2.23 0.00 0.00 60.65 59.95 3n2b s ILE 304 Cb -0.18 -4.26 -0.02 0.00 -1.58 0.00 0.00 42.46 36.42 3n2b s ILE 304 CO -0.00 -0.32 0.33 0.27 -1.23 0.00 0.00 174.94 173.99 3n2b s ILE 305 N 3.22 3.41 -1.41 2.92 -4.36 0.48 0.20 121.20 125.66 3n2b s ILE 305 Ca 0.38 -1.32 0.27 0.00 -0.26 0.00 0.00 60.65 59.72 3n2b s ILE 305 Cb -0.14 -3.17 0.27 0.00 1.25 0.00 0.00 42.46 40.68 3n2b s ILE 305 CO 0.13 -0.14 1.69 -0.90 0.24 0.00 0.00 174.94 175.96 3n2b n ASP 306 N -1.44 0.53 -4.73 4.36 5.75 -0.52 -2.96 116.55 117.53 3n2b n ASP 306 Ca -0.00 -0.41 -0.38 0.00 -0.01 0.00 0.00 54.79 53.99 3n2b n ASP 306 Cb 0.60 -0.01 -0.06 0.00 -1.03 0.00 0.00 41.12 40.62 3n2b n ASP 306 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3n2b s ALA 307 N -2.69 3.51 0.48 2.12 0.00 -1.26 -4.63 121.76 119.29 3n2b s ALA 307 Ca 0.21 -0.21 0.05 0.00 0.00 0.00 0.00 51.96 52.01 3n2b s ALA 307 Cb 0.19 -2.60 -0.01 0.00 0.00 0.00 0.00 23.12 20.70 3n2b s ALA 307 CO 0.55 0.06 0.18 0.00 0.00 0.00 0.00 175.76 176.55 3n2b s ALA 308 N 0.42 3.98 0.54 0.00 0.00 -1.26 -4.34 121.76 121.10 3n2b s ALA 308 Ca 0.25 -1.34 0.26 0.00 0.00 0.00 0.00 51.96 51.14 3n2b s ALA 308 Cb -0.15 -0.33 1.43 0.00 0.00 0.00 0.00 23.12 24.07 3n2b s ALA 308 CO 0.10 -0.20 1.98 0.00 0.00 0.00 0.00 175.76 177.64 3n2b h MET 309 N 1.22 0.00 0.00 0.00 -0.00 -1.89 0.81 114.93 115.07 3n2b h MET 309 Ca -0.41 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.29 3n2b h MET 309 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.89 3n2b h MET 309 CO 0.68 0.00 0.00 -2.95 -0.00 0.00 0.00 176.91 174.64 3n2b h ASN 310 N 0.00 0.00 0.19 -0.10 -1.07 -1.88 -3.18 115.58 109.54 3n2b h ASN 310 Ca 0.26 0.00 -0.35 0.00 0.07 0.00 0.00 56.30 56.28 3n2b h ASN 310 Cb 1.09 0.00 -0.03 0.00 -2.07 0.00 0.00 38.32 37.31 3n2b h ASN 310 CO -0.00 0.00 -1.99 0.47 0.07 0.00 0.00 177.43 175.98 3n2b n ASP 311 N -2.69 1.79 -3.44 6.14 8.00 0.25 -0.76 116.55 125.82 3n2b n ASP 311 Ca 0.02 0.22 -0.10 0.00 0.71 0.00 0.00 54.79 55.64 3n2b n ASP 311 Cb 0.31 -0.60 -0.09 0.00 -0.02 0.00 0.00 41.12 40.72 3n2b n ASP 311 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3n2b s LEU 312 N -6.75 -0.59 -0.01 0.64 2.96 -1.02 -4.44 118.68 109.48 3n2b s LEU 312 Ca -0.19 0.39 0.17 0.00 -0.22 0.00 0.00 54.13 54.28 3n2b s LEU 312 Cb 0.07 1.10 -0.23 0.00 0.50 0.00 0.00 46.19 47.63 3n2b s LEU 312 CO 0.77 -0.28 0.53 0.00 -1.32 0.00 0.00 176.35 176.05 3n2b n ILE 313 N 5.37 0.00 -0.17 6.68 3.06 -1.21 -4.27 119.36 128.82 3n2b n ILE 313 Ca -0.05 -0.27 -0.05 0.00 -2.50 0.00 0.00 62.75 59.89 3n2b n ILE 313 Cb 0.50 0.50 0.01 0.00 0.54 0.00 0.00 39.64 41.19 3n2b n ILE 313 CO 0.00 0.00 0.00 0.03 -2.50 0.00 0.00 176.55 174.08 3n2b h ARG 314 N 0.00 -0.14 -0.73 9.51 3.08 -1.90 0.48 114.38 124.67 3n2b h ARG 314 Ca 0.00 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 3n2b h ARG 314 Cb 0.62 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.67 3n2b h ARG 314 CO 0.00 -0.10 0.44 -1.35 -1.07 0.00 0.00 179.97 177.90 3n2b h PRO 315 N -0.15 0.99 0.11 0.04 0.11 -1.80 0.30 132.00 131.59 3n2b h PRO 315 Ca 0.23 -0.08 -0.01 0.00 0.11 0.00 0.00 66.00 66.25 3n2b h PRO 315 Cb 0.51 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.41 3n2b h PRO 315 CO -0.60 0.69 -0.05 0.00 -0.21 0.00 0.00 178.00 177.82 3n2b h ALA 316 N 1.48 -0.15 0.48 -0.75 0.00 -1.47 -3.39 119.26 115.45 3n2b h ALA 316 Ca 0.26 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 3n2b h ALA 316 Cb -0.05 0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3n2b h ALA 316 CO -0.05 -0.22 -0.23 1.25 0.00 0.00 0.00 179.25 180.00 3n2b h LEU 317 N -0.89 -0.54 0.00 0.00 5.85 -0.12 -3.46 115.31 116.15 3n2b h LEU 317 Ca -0.02 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3n2b h LEU 317 Cb 0.54 0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.71 3n2b h LEU 317 CO 0.03 -0.35 0.00 -1.22 -0.34 0.00 0.00 178.44 176.56 3n2b n TYR 318 N -3.95 -0.22 -2.23 1.25 4.01 0.09 -5.02 117.16 111.10 3n2b n TYR 318 Ca -0.08 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.43 3n2b n TYR 318 Cb 0.25 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.30 3n2b n TYR 318 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 3n2b n GLN 319 N -0.06 3.36 -2.26 -0.72 1.13 -1.25 -4.56 117.38 113.01 3n2b n GLN 319 Ca 0.00 -4.19 -0.41 0.00 -1.94 0.00 0.00 57.00 50.46 3n2b n GLN 319 Cb 0.00 -2.19 -0.03 0.00 0.11 0.00 0.00 30.24 28.13 3n2b n GLN 319 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3n2b s ALA 320 N -3.58 3.49 -0.29 -1.58 0.00 -1.25 -5.01 121.76 113.54 3n2b s ALA 320 Ca 0.48 1.07 -0.07 0.00 0.00 0.00 0.00 51.96 53.44 3n2b s ALA 320 Cb 0.40 -3.46 -0.00 0.00 0.00 0.00 0.00 23.12 20.07 3n2b s ALA 320 CO -0.03 -0.49 0.09 -0.46 0.00 0.00 0.00 175.76 174.88 3n2b s TRP 321 N -0.14 3.14 -0.08 0.00 -0.00 -1.26 -4.44 118.94 116.16 3n2b s TRP 321 Ca 0.54 -0.79 0.05 0.00 -0.00 0.00 0.00 56.10 55.89 3n2b s TRP 321 Cb -0.36 -2.27 -0.00 0.00 -0.00 0.00 0.00 33.47 30.84 3n2b s TRP 321 CO 0.40 -0.51 -0.23 -0.65 -0.00 0.00 0.00 176.95 175.95 3n2b s GLN 322 N 1.54 2.73 0.27 5.86 -0.21 -1.26 -5.11 119.66 123.49 3n2b s GLN 322 Ca 0.04 -0.84 -0.30 0.00 0.02 0.00 0.00 55.36 54.28 3n2b s GLN 322 Cb -0.17 -2.15 -0.10 0.00 1.00 0.00 0.00 33.01 31.58 3n2b s GLN 322 CO 0.03 0.23 1.49 0.34 -2.12 0.00 0.00 175.29 175.26 3n2b s ASP 323 N 0.19 6.56 -0.17 5.90 3.68 -1.26 -4.81 116.67 126.76 3n2b s ASP 323 Ca -0.13 2.77 0.01 0.00 2.13 0.00 0.00 52.55 57.33 3n2b s ASP 323 Cb -0.16 -2.63 0.02 0.00 -1.45 0.00 0.00 42.92 38.70 3n2b s ASP 323 CO 0.07 -0.77 -0.18 -0.63 0.13 0.00 0.00 175.17 173.78 3n2b s ILE 324 N -0.09 1.92 0.08 4.11 1.01 -1.26 -0.27 121.20 126.70 3n2b s ILE 324 Ca 0.60 -0.85 0.04 0.00 0.00 0.00 0.00 60.65 60.44 3n2b s ILE 324 Cb -0.44 -1.74 -0.03 0.00 0.01 0.00 0.00 42.46 40.26 3n2b s ILE 324 CO 0.46 0.52 -0.12 0.27 0.00 0.00 0.00 174.94 176.06 3n2b s ILE 325 N 1.30 1.02 0.29 2.92 -4.36 -0.19 -4.96 121.20 117.22 3n2b s ILE 325 Ca 0.04 -1.43 -0.29 0.00 -0.26 0.00 0.00 60.65 58.71 3n2b s ILE 325 Cb -0.13 -1.15 -0.09 0.00 1.25 0.00 0.00 42.46 42.33 3n2b s ILE 325 CO -0.11 -0.37 1.09 -2.16 0.24 0.00 0.00 174.94 173.63 3n2b s PRO 326 N -2.14 4.60 0.39 0.37 0.04 -1.26 0.36 135.00 137.36 3n2b s PRO 326 Ca 0.01 1.78 0.09 0.00 0.04 0.00 0.00 61.00 62.91 3n2b s PRO 326 Cb -0.07 -3.14 0.79 0.00 0.04 0.00 0.00 34.50 32.12 3n2b s PRO 326 CO 0.01 0.19 1.95 -0.07 0.04 0.00 0.00 177.00 179.12 3n2b h LEU 327 N 3.71 0.30 -6.74 -3.56 4.07 -1.62 -3.39 115.31 108.09 3n2b h LEU 327 Ca -0.47 -0.05 -0.56 0.00 0.08 0.00 0.00 57.88 56.88 3n2b h LEU 327 Cb 1.21 -0.08 -0.40 0.00 1.08 0.00 0.00 40.66 42.48 3n2b h LEU 327 CO 0.66 0.39 -0.81 -0.60 -1.08 0.00 0.00 178.44 177.00 3n2b s ARG 328 N -4.92 0.45 0.32 1.13 3.52 -1.26 -0.23 118.95 117.96 3n2b s ARG 328 Ca -0.06 -1.01 -0.29 0.00 -0.13 0.00 0.00 55.73 54.24 3n2b s ARG 328 Cb 0.16 -1.35 -0.11 0.00 -1.56 0.00 0.00 34.95 32.09 3n2b s ARG 328 CO 0.73 -1.11 1.56 -2.14 -0.81 0.00 0.00 175.30 173.53 3n2b s PRO 329 N 1.51 4.12 0.11 5.12 0.02 -1.26 -5.00 135.00 139.62 3n2b s PRO 329 Ca 0.14 2.58 0.02 0.00 0.02 0.00 0.00 61.00 63.75 3n2b s PRO 329 Cb -0.20 -3.00 -0.04 0.00 0.02 0.00 0.00 34.50 31.28 3n2b s PRO 329 CO -0.17 -0.60 0.24 1.03 -0.33 0.00 0.00 177.00 177.17 3n2b s ARG 330 N -1.10 3.40 0.35 5.54 0.52 -1.26 -5.08 118.95 121.32 3n2b s ARG 330 Ca 0.59 -0.55 -0.09 0.00 -0.52 0.00 0.00 55.73 55.17 3n2b s ARG 330 Cb -0.47 -2.98 -0.06 0.00 0.52 0.00 0.00 34.95 31.96 3n2b s ARG 330 CO 0.54 0.56 0.68 -0.65 0.02 0.00 0.00 175.30 176.44 3n2b s GLN 331 N -2.91 3.75 0.00 3.54 -1.52 -1.26 -4.85 119.66 116.41 3n2b s GLN 331 Ca 0.34 0.32 0.00 0.00 -1.95 0.00 0.00 55.36 54.07 3n2b s GLN 331 Cb -0.12 -2.50 0.00 0.00 -0.22 0.00 0.00 33.01 30.17 3n2b s GLN 331 CO 0.28 0.09 0.00 0.41 -0.25 0.00 0.00 175.29 175.82 3n2b n GLY 332 N -1.02 0.87 3.72 3.09 0.00 -1.26 -5.05 105.19 105.54 3n2b n GLY 332 Ca 0.01 -2.18 -0.42 0.00 0.00 0.00 0.00 46.02 43.43 3n2b n GLY 332 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3n2b s GLU 333 N -0.96 4.51 0.38 1.61 2.12 -1.26 -4.97 118.70 120.12 3n2b s GLU 333 Ca 0.00 1.65 -0.16 0.00 0.36 0.00 0.00 54.97 56.82 3n2b s GLU 333 Cb 0.00 -3.37 -0.09 0.00 0.26 0.00 0.00 34.13 30.93 3n2b s GLU 333 CO 0.00 -0.12 0.83 0.00 -0.54 0.00 0.00 175.26 175.43 3n2b s ALA 334 N 0.77 3.22 0.24 6.30 0.00 -1.26 -4.79 121.76 126.23 3n2b s ALA 334 Ca 0.55 0.13 0.11 0.00 0.00 0.00 0.00 51.96 52.74 3n2b s ALA 334 Cb -0.27 -2.91 -0.05 0.00 0.00 0.00 0.00 23.12 19.90 3n2b s ALA 334 CO 0.30 0.17 -0.14 -0.65 0.00 0.00 0.00 175.76 175.44 3n2b s GLN 335 N -3.27 1.88 -0.18 0.00 -0.21 -0.65 -4.86 119.66 112.38 3n2b s GLN 335 Ca 0.57 -1.54 -0.17 0.00 0.02 0.00 0.00 55.36 54.23 3n2b s GLN 335 Cb -0.10 -1.96 -0.04 0.00 1.00 0.00 0.00 33.01 31.92 3n2b s GLN 335 CO 0.19 0.37 0.47 0.99 -2.12 0.00 0.00 175.29 175.19 3n2b s THR 336 N -2.15 5.16 0.08 -0.19 2.01 -1.26 -1.01 115.64 118.28 3n2b s THR 336 Ca 0.28 0.87 0.07 0.00 0.31 0.00 0.00 61.69 63.22 3n2b s THR 336 Cb -0.07 -3.80 -0.03 0.00 0.01 0.00 0.00 72.50 68.62 3n2b s THR 336 CO 0.15 0.24 -0.19 -0.31 -0.69 0.00 0.00 174.62 173.82 3n2b s TYR 337 N 1.29 1.61 -0.17 4.92 2.02 0.49 -3.77 117.35 123.74 3n2b s TYR 337 Ca 0.23 -0.42 -0.11 0.00 -0.37 0.00 0.00 57.07 56.40 3n2b s TYR 337 Cb -0.15 -0.90 -0.05 0.00 -0.40 0.00 0.00 41.96 40.46 3n2b s TYR 337 CO 0.09 0.14 0.18 -0.51 -1.57 0.00 0.00 175.55 173.89 3n2b s ASP 338 N -1.70 6.32 -0.33 2.29 1.01 -0.65 -0.66 116.67 122.95 3n2b s ASP 338 Ca 0.04 0.37 -0.16 0.00 0.71 0.00 0.00 52.55 53.51 3n2b s ASP 338 Cb -0.10 -2.12 -0.02 0.00 1.01 0.00 0.00 42.92 41.70 3n2b s ASP 338 CO 0.03 0.20 0.41 -0.76 0.21 0.00 0.00 175.17 175.27 3n2b s LEU 339 N 0.11 4.31 0.06 1.23 2.01 0.89 -1.73 118.68 125.56 3n2b s LEU 339 Ca 0.12 -0.03 0.09 0.00 0.01 0.00 0.00 54.13 54.32 3n2b s LEU 339 Cb -0.12 -2.44 -0.03 0.00 0.01 0.00 0.00 46.19 43.61 3n2b s LEU 339 CO 0.01 -0.34 -0.23 0.68 1.01 0.00 0.00 176.35 177.47 3n2b s VAL 340 N 2.15 1.91 1.11 -1.59 -7.23 -0.48 -1.09 120.40 115.18 3n2b s VAL 340 Ca 0.15 -1.38 -0.19 0.00 -1.81 0.00 0.00 61.98 58.75 3n2b s VAL 340 Cb -0.16 -1.66 0.27 0.00 0.56 0.00 0.00 36.38 35.38 3n2b s VAL 340 CO 0.12 0.21 1.25 -0.83 -0.31 0.00 0.00 175.10 175.54 3n2b s GLY 341 N -1.40 1.72 0.00 2.32 0.00 0.42 -0.39 107.32 109.99 3n2b s GLY 341 Ca 0.10 -1.22 0.25 0.00 0.00 0.00 0.00 44.72 43.84 3n2b s GLY 341 CO 0.03 -0.33 1.40 -1.55 0.00 0.00 0.00 173.10 172.64 3n2b n PRO 342 N -4.35 1.38 0.00 2.90 -0.04 -1.16 -4.62 135.00 129.12 3n2b n PRO 342 Ca 0.16 -1.00 0.00 0.00 -0.04 0.00 0.00 63.50 62.63 3n2b n PRO 342 Cb 0.59 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 32.58 3n2b n PRO 342 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 3n2b n VAL 343 N 0.06 0.00 -2.85 0.52 0.24 -1.26 -5.07 118.33 109.97 3n2b n VAL 343 Ca 0.13 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.31 3n2b n VAL 343 Cb 0.43 0.00 0.01 0.00 -1.47 0.00 0.00 33.84 32.81 3n2b n VAL 343 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3n2b s GLU 345 N -2.67 1.01 0.28 0.00 0.41 -1.26 -5.03 118.70 111.44 3n2b s GLU 345 Ca 0.31 -0.88 0.05 0.00 -0.41 0.00 0.00 54.97 54.05 3n2b s GLU 345 Cb 0.41 -1.07 0.41 0.00 -1.78 0.00 0.00 34.13 32.11 3n2b s GLU 345 CO -0.01 0.26 1.68 1.15 -0.49 0.00 0.00 175.26 177.85 3n2b h THR 346 N 4.39 1.31 -0.26 3.63 2.02 -2.03 -2.75 112.91 119.21 3n2b h THR 346 Ca -0.40 -1.53 0.00 0.00 0.77 0.00 0.00 66.41 65.25 3n2b h THR 346 Cb 1.18 1.66 0.00 0.00 -1.74 0.00 0.00 68.15 69.25 3n2b h THR 346 CO 0.43 0.46 0.00 -1.54 0.37 0.00 0.00 175.52 175.24 3n2b n SER 347 N -4.03 1.44 -4.43 4.18 3.41 -1.26 -4.66 113.62 108.27 3n2b n SER 347 Ca -0.01 -2.01 -0.44 0.00 -0.26 0.00 0.00 58.87 56.15 3n2b n SER 347 Cb 0.48 -0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 3n2b n SER 347 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3n2b n ASP 348 N 0.27 5.12 -3.70 4.04 2.03 -1.04 -4.51 116.55 118.75 3n2b n ASP 348 Ca 0.09 -2.97 -0.12 0.00 0.52 0.00 0.00 54.79 52.31 3n2b n ASP 348 Cb 0.23 -1.61 -0.07 0.00 -0.72 0.00 0.00 41.12 38.95 3n2b n ASP 348 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 3n2b s PHE 349 N 2.16 -0.20 -0.06 -0.67 -0.12 -1.26 -0.44 117.98 117.39 3n2b s PHE 349 Ca 0.45 0.12 0.12 0.00 -0.05 0.00 0.00 56.93 57.57 3n2b s PHE 349 Cb 0.00 0.17 -0.18 0.00 -0.63 0.00 0.00 43.02 42.38 3n2b s PHE 349 CO 0.02 -0.55 0.18 1.28 -0.05 0.00 0.00 175.22 176.10 3n2b n LEU 350 N 0.51 0.00 -3.55 -1.99 4.77 -0.25 -4.40 117.00 112.09 3n2b n LEU 350 Ca -0.18 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.69 3n2b n LEU 350 Cb 0.60 0.14 -0.04 0.00 -2.33 0.00 0.00 43.42 41.78 3n2b n LEU 350 CO 0.20 0.14 0.72 -0.83 -1.33 0.00 0.00 177.39 176.29 3n2b s GLY 351 N -3.96 -0.35 0.12 -0.72 0.00 -1.21 -4.77 107.32 96.43 3n2b s GLY 351 Ca -0.05 1.67 0.09 0.00 0.00 0.00 0.00 44.72 46.42 3n2b s GLY 351 CO 0.53 0.82 -0.22 0.54 0.00 0.00 0.00 173.10 174.77 3n2b s LYS 352 N -1.71 1.20 -1.22 2.90 1.02 -1.26 -0.08 119.74 120.59 3n2b s LYS 352 Ca -0.01 -1.24 -0.06 0.00 0.02 0.00 0.00 55.97 54.68 3n2b s LYS 352 Cb -0.01 -1.48 -0.01 0.00 -0.52 0.00 0.00 37.83 35.81 3n2b s LYS 352 CO -0.01 0.34 0.76 -0.25 -0.92 0.00 0.00 175.35 175.27 3n2b n ASP 353 N 0.92 -3.11 -4.44 2.83 8.00 -0.90 -4.94 116.55 114.92 3n2b n ASP 353 Ca -0.18 -0.85 -0.35 0.00 0.71 0.00 0.00 54.79 54.11 3n2b n ASP 353 Cb 0.54 -4.08 -0.13 0.00 -0.02 0.00 0.00 41.12 37.44 3n2b n ASP 353 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3n2b s ARG 354 N -5.71 3.62 -0.37 -1.24 1.81 0.17 -4.83 118.95 112.38 3n2b s ARG 354 Ca 0.20 -0.51 -0.27 0.00 -1.72 0.00 0.00 55.73 53.43 3n2b s ARG 354 Cb -0.05 -3.17 0.02 0.00 -0.45 0.00 0.00 34.95 31.29 3n2b s ARG 354 CO 0.81 -0.08 0.98 -0.51 -0.68 0.00 0.00 175.30 175.82 3n2b s ASP 355 N 1.27 6.73 0.06 0.23 1.01 -1.26 -0.38 116.67 124.33 3n2b s ASP 355 Ca 0.04 0.67 -0.03 0.00 0.71 0.00 0.00 52.55 53.93 3n2b s ASP 355 Cb -0.15 -2.49 -0.03 0.00 1.01 0.00 0.00 42.92 41.27 3n2b s ASP 355 CO 0.02 -0.91 0.04 -0.76 0.21 0.00 0.00 175.17 173.77 3n2b s LEU 356 N 3.63 2.11 -0.47 1.23 1.43 -0.18 -4.89 118.68 121.54 3n2b s LEU 356 Ca 0.41 -0.82 -0.05 0.00 -1.03 0.00 0.00 54.13 52.64 3n2b s LEU 356 Cb -0.11 0.46 0.12 0.00 0.03 0.00 0.00 46.19 46.69 3n2b s LEU 356 CO 0.19 -0.60 0.29 -0.69 0.23 0.00 0.00 176.35 175.78 3n2b s VAL 357 N -3.57 3.66 0.10 -1.59 1.01 -1.26 -1.63 120.40 117.12 3n2b s VAL 357 Ca 0.03 -2.14 0.09 0.00 0.00 0.00 0.00 61.98 59.97 3n2b s VAL 357 Cb 0.05 -3.46 -0.04 0.00 0.00 0.00 0.00 36.38 32.94 3n2b s VAL 357 CO -0.09 -0.75 -0.19 -0.76 0.00 0.00 0.00 175.10 173.30 3n2b s LEU 358 N 0.99 2.62 0.12 3.92 1.43 -1.26 -4.48 118.68 122.02 3n2b s LEU 358 Ca 0.09 -0.55 0.06 0.00 -1.03 0.00 0.00 54.13 52.70 3n2b s LEU 358 Cb -0.23 -1.50 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 3n2b s LEU 358 CO -0.03 0.20 -0.15 -1.10 0.23 0.00 0.00 176.35 175.50 3n2b s GLN 359 N -1.96 1.02 0.34 1.70 -0.21 -1.26 -5.10 119.66 114.19 3n2b s GLN 359 Ca 0.17 -1.22 -0.29 0.00 0.02 0.00 0.00 55.36 54.04 3n2b s GLN 359 Cb -0.10 -0.94 -0.11 0.00 1.00 0.00 0.00 33.01 32.86 3n2b s GLN 359 CO 0.08 0.18 1.46 -1.21 -2.12 0.00 0.00 175.29 173.69 3n2b s GLU 360 N -2.56 4.18 0.00 2.91 2.02 -1.26 -2.25 118.70 121.74 3n2b s GLU 360 Ca 0.08 2.47 0.00 0.00 0.02 0.00 0.00 54.97 57.54 3n2b s GLU 360 Cb -0.06 -3.02 0.00 0.00 0.10 0.00 0.00 34.13 31.16 3n2b s GLU 360 CO 0.03 -0.47 0.00 0.41 0.02 0.00 0.00 175.26 175.25 3n2b n GLY 361 N 1.06 0.73 3.76 -1.39 0.00 0.22 -5.03 105.19 104.53 3n2b n GLY 361 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 3n2b n GLY 361 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3n2b s ASP 362 N -2.05 5.90 -0.09 1.61 1.11 -0.96 -4.60 116.67 117.59 3n2b s ASP 362 Ca 0.00 2.73 -0.06 0.00 0.18 0.00 0.00 52.55 55.40 3n2b s ASP 362 Cb 0.00 -2.64 -0.04 0.00 1.07 0.00 0.00 42.92 41.31 3n2b s ASP 362 CO 0.00 -1.14 0.14 -0.76 1.18 0.00 0.00 175.17 174.59 3n2b s LEU 363 N -2.86 4.31 0.13 1.23 1.43 -1.26 -0.58 118.68 121.08 3n2b s LEU 363 Ca 0.62 0.41 0.07 0.00 -1.03 0.00 0.00 54.13 54.21 3n2b s LEU 363 Cb -0.39 -2.16 -0.04 0.00 0.03 0.00 0.00 46.19 43.63 3n2b s LEU 363 CO 0.49 0.37 -0.16 -0.76 0.23 0.00 0.00 176.35 176.52 3n2b s LEU 364 N -1.22 2.39 -0.08 1.79 1.43 0.69 -1.60 118.68 122.09 3n2b s LEU 364 Ca 0.18 -0.80 0.05 0.00 -1.03 0.00 0.00 54.13 52.53 3n2b s LEU 364 Cb -0.12 -0.69 -0.01 0.00 0.03 0.00 0.00 46.19 45.40 3n2b s LEU 364 CO 0.07 -0.08 -0.24 0.00 0.23 0.00 0.00 176.35 176.34 3n2b s ALA 365 N -1.92 2.20 -0.38 4.21 0.00 0.16 -1.04 121.76 124.99 3n2b s ALA 365 Ca 0.10 -1.01 -0.14 0.00 0.00 0.00 0.00 51.96 50.91 3n2b s ALA 365 Cb -0.06 -0.75 0.00 0.00 0.00 0.00 0.00 23.12 22.31 3n2b s ALA 365 CO 0.04 0.37 0.27 0.08 0.00 0.00 0.00 175.76 176.52 3n2b s VAL 366 N 0.02 5.26 0.83 0.00 1.01 0.25 -1.03 120.40 126.75 3n2b s VAL 366 Ca -0.09 -0.46 -0.11 0.00 0.00 0.00 0.00 61.98 61.32 3n2b s VAL 366 Cb -0.15 -3.83 0.09 0.00 0.00 0.00 0.00 36.38 32.49 3n2b s VAL 366 CO 0.06 -0.17 1.09 -0.13 0.00 0.00 0.00 175.10 175.95 3n2b s ARG 367 N 1.70 1.83 -1.36 2.72 0.52 0.63 -2.30 118.95 122.69 3n2b s ARG 367 Ca 0.05 0.73 -0.08 0.00 -0.52 0.00 0.00 55.73 55.91 3n2b s ARG 367 Cb -0.18 -1.88 0.02 0.00 0.52 0.00 0.00 34.95 33.42 3n2b s ARG 367 CO 0.10 -1.82 1.14 0.43 0.02 0.00 0.00 175.30 175.17 3n2b n SER 368 N -3.58 -5.71 -0.90 0.23 7.64 -1.20 -4.36 113.62 105.74 3n2b n SER 368 Ca 0.07 -0.58 0.07 0.00 1.01 0.00 0.00 58.87 59.45 3n2b n SER 368 Cb 0.56 -4.93 0.23 0.00 -1.01 0.00 0.00 64.21 59.06 3n2b n SER 368 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 3n2b n SER 369 N -3.02 3.59 0.07 6.43 7.64 -0.66 -4.52 113.62 123.15 3n2b n SER 369 Ca -0.02 -2.42 0.13 0.00 1.01 0.00 0.00 58.87 57.56 3n2b n SER 369 Cb 0.57 -0.40 0.36 0.00 -1.01 0.00 0.00 64.21 63.73 3n2b n SER 369 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3n2b n GLY 370 N 0.30 -1.55 3.21 0.23 0.00 -0.21 -4.35 105.19 102.82 3n2b n GLY 370 Ca 0.18 -0.13 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 3n2b n GLY 370 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n2b s ALA 371 N -3.10 1.62 -1.45 4.61 0.00 -1.25 -4.47 121.76 117.73 3n2b s ALA 371 Ca 0.10 -0.90 -0.12 0.00 0.00 0.00 0.00 51.96 51.05 3n2b s ALA 371 Cb 0.14 -0.38 0.08 0.00 0.00 0.00 0.00 23.12 22.97 3n2b s ALA 371 CO 0.63 0.38 0.69 0.66 0.00 0.00 0.00 175.76 178.13 3n2b n TYR 372 N 2.34 -1.95 0.00 0.00 4.01 0.12 -4.89 117.16 116.80 3n2b n TYR 372 Ca -0.16 0.65 0.00 0.00 -0.16 0.00 0.00 57.90 58.24 3n2b n TYR 372 Cb 0.53 -3.39 0.00 0.00 -0.31 0.00 0.00 39.34 36.18 3n2b n TYR 372 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3n2b n GLY 373 N -1.39 0.28 0.30 2.72 0.00 -1.26 -4.56 105.19 101.28 3n2b n GLY 373 Ca 0.01 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 3n2b n GLY 373 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3n2b h PHE 374 N 0.00 0.34 -0.62 1.61 3.57 -1.80 -2.15 116.94 117.90 3n2b h PHE 374 Ca 0.00 0.01 0.15 0.00 3.53 0.00 0.00 57.97 61.66 3n2b h PHE 374 Cb 0.00 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.59 3n2b h PHE 374 CO 0.00 0.21 0.43 0.00 -2.23 0.00 0.00 178.31 176.72 3n2b h THR 375 N 0.36 0.77 -0.61 4.41 1.03 -1.88 -0.94 112.91 116.06 3n2b h THR 375 Ca 0.13 -0.07 0.00 0.00 -0.01 0.00 0.00 66.41 66.46 3n2b h THR 375 Cb 0.06 0.56 0.00 0.00 -1.07 0.00 0.00 68.15 67.70 3n2b h THR 375 CO -0.03 0.04 0.00 0.23 -0.01 0.00 0.00 175.52 175.75 3n2b n MET 376 N -4.42 2.65 -2.36 0.00 2.81 -0.81 -4.99 117.12 110.00 3n2b n MET 376 Ca 0.11 -2.52 -0.39 0.00 -1.81 0.00 0.00 57.70 53.10 3n2b n MET 376 Cb 0.56 -1.54 -0.03 0.00 -0.71 0.00 0.00 33.22 31.50 3n2b n MET 376 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3n2b s SER 377 N -1.16 6.82 0.24 7.83 0.15 -0.36 -4.83 113.70 122.39 3n2b s SER 377 Ca 0.45 2.33 0.01 0.00 0.70 0.00 0.00 55.95 59.44 3n2b s SER 377 Cb 0.24 -2.62 -0.00 0.00 -1.71 0.00 0.00 66.02 61.93 3n2b s SER 377 CO 0.32 -0.47 0.05 -1.54 1.20 0.00 0.00 173.24 172.80 3n2b n SER 378 N 0.50 1.74 -1.43 5.45 3.41 0.06 -5.02 113.62 118.32 3n2b n SER 378 Ca 0.02 -2.18 0.00 0.00 -0.26 0.00 0.00 58.87 56.45 3n2b n SER 378 Cb 0.46 0.41 0.27 0.00 -0.26 0.00 0.00 64.21 65.09 3n2b n SER 378 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3n2b n ASN 379 N -1.54 4.06 -4.65 4.04 4.13 -1.26 -4.67 115.26 115.37 3n2b n ASN 379 Ca -0.06 -3.25 -0.45 0.00 1.68 0.00 0.00 54.58 52.49 3n2b n ASN 379 Cb 0.34 -0.65 -0.03 0.00 -1.54 0.00 0.00 39.78 37.90 3n2b n ASN 379 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3n2b n TYR 380 N -0.46 1.94 -1.20 3.10 9.36 -1.26 -0.15 117.16 128.48 3n2b n TYR 380 Ca 0.32 0.51 -0.07 0.00 3.32 0.00 0.00 57.90 61.98 3n2b n TYR 380 Cb 1.14 -2.40 -0.03 0.00 -0.63 0.00 0.00 39.34 37.41 3n2b n TYR 380 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 3n2b n ASN 381 N 1.91 -3.91 -3.76 2.98 5.03 -1.26 -3.64 115.26 112.61 3n2b n ASN 381 Ca 0.11 0.17 -0.30 0.00 0.87 0.00 0.00 54.58 55.44 3n2b n ASN 381 Cb 0.31 -2.03 0.03 0.00 -1.02 0.00 0.00 39.78 37.06 3n2b n ASN 381 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 3n2b n THR 382 N -2.77 -4.97 -4.21 3.41 -1.04 0.78 -4.98 114.28 100.50 3n2b n THR 382 Ca -0.07 -0.81 -0.34 0.00 -2.04 0.00 0.00 64.05 60.79 3n2b n THR 382 Cb 0.24 -3.82 -0.13 0.00 -1.82 0.00 0.00 70.33 64.80 3n2b n THR 382 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 3n2b s ARG 383 N -6.17 3.56 0.43 -2.82 0.52 -1.03 -5.09 118.95 108.33 3n2b s ARG 383 Ca 0.33 -0.56 -0.25 0.00 -0.52 0.00 0.00 55.73 54.73 3n2b s ARG 383 Cb -0.12 -2.97 -0.08 0.00 0.52 0.00 0.00 34.95 32.30 3n2b s ARG 383 CO 0.87 0.05 1.24 -2.14 0.02 0.00 0.00 175.30 175.34 3n2b s PRO 384 N 0.85 3.89 0.58 3.54 0.02 -1.26 -4.40 135.00 138.22 3n2b s PRO 384 Ca -0.01 1.98 -0.18 0.00 0.02 0.00 0.00 61.00 62.82 3n2b s PRO 384 Cb -0.15 -2.62 -0.04 0.00 0.02 0.00 0.00 34.50 31.71 3n2b s PRO 384 CO 0.02 -0.50 1.11 1.03 -0.33 0.00 0.00 177.00 178.33 3n2b s ARG 385 N -2.40 3.18 0.89 5.54 0.52 -1.26 -4.81 118.95 120.61 3n2b s ARG 385 Ca 0.59 1.50 -0.14 0.00 -0.52 0.00 0.00 55.73 57.16 3n2b s ARG 385 Cb -0.34 -1.99 0.15 0.00 0.52 0.00 0.00 34.95 33.28 3n2b s ARG 385 CO 0.43 -0.96 1.25 0.14 0.02 0.00 0.00 175.30 176.18 3n2b s VAL 386 N -2.02 2.01 0.43 3.52 -7.23 -1.26 -1.71 120.40 114.13 3n2b s VAL 386 Ca 0.70 -0.02 -0.15 0.00 -1.81 0.00 0.00 61.98 60.70 3n2b s VAL 386 Cb -0.22 -2.99 -0.08 0.00 0.56 0.00 0.00 36.38 33.65 3n2b s VAL 386 CO 0.32 0.00 0.87 0.00 -0.31 0.00 0.00 175.10 175.98 3n2b s ALA 387 N -3.74 3.20 -0.08 1.32 0.00 -1.26 -4.36 121.76 116.84 3n2b s ALA 387 Ca 0.69 0.07 0.04 0.00 0.00 0.00 0.00 51.96 52.76 3n2b s ALA 387 Cb -0.07 -2.93 -0.00 0.00 0.00 0.00 0.00 23.12 20.12 3n2b s ALA 387 CO 0.51 -0.00 -0.23 -1.21 0.00 0.00 0.00 175.76 174.83 3n2b s GLU 388 N -3.66 2.76 0.00 0.00 2.02 -0.33 -2.26 118.70 117.23 3n2b s GLU 388 Ca 0.56 -0.84 0.04 0.00 0.02 0.00 0.00 54.97 54.74 3n2b s GLU 388 Cb -0.10 -2.16 -0.01 0.00 0.10 0.00 0.00 34.13 31.96 3n2b s GLU 388 CO 0.26 0.23 -0.11 0.14 0.02 0.00 0.00 175.26 175.79 3n2b s VAL 389 N 0.21 0.89 -0.11 2.63 -7.23 -0.46 -1.27 120.40 115.06 3n2b s VAL 389 Ca -0.14 -0.59 -0.02 0.00 -1.81 0.00 0.00 61.98 59.43 3n2b s VAL 389 Cb -0.16 -0.76 -0.03 0.00 0.56 0.00 0.00 36.38 35.98 3n2b s VAL 389 CO 0.07 0.17 -0.02 -0.32 -0.31 0.00 0.00 175.10 174.68 3n2b s MET 390 N -0.47 3.17 0.13 4.82 1.75 0.57 -0.79 119.30 128.48 3n2b s MET 390 Ca 0.03 -0.47 0.04 0.00 -1.25 0.00 0.00 55.69 54.04 3n2b s MET 390 Cb -0.05 -2.80 -0.04 0.00 2.84 0.00 0.00 34.83 34.78 3n2b s MET 390 CO -0.00 0.54 0.11 0.14 -0.65 0.00 0.00 175.02 175.16 3n2b s VAL 391 N -0.45 4.49 -0.35 10.11 -7.23 0.14 -0.39 120.40 126.72 3n2b s VAL 391 Ca 0.07 -0.96 0.05 0.00 -1.81 0.00 0.00 61.98 59.33 3n2b s VAL 391 Cb -0.12 -3.24 0.17 0.00 0.56 0.00 0.00 36.38 33.75 3n2b s VAL 391 CO 0.02 -0.02 0.50 -0.62 -0.31 0.00 0.00 175.10 174.68 3n2b s ASP 392 N -2.82 -0.32 1.66 4.85 2.15 -0.57 -1.91 116.67 119.71 3n2b s ASP 392 Ca 0.30 -0.79 0.00 0.00 0.43 0.00 0.00 52.55 52.50 3n2b s ASP 392 Cb -0.11 1.37 0.00 0.00 -0.30 0.00 0.00 42.92 43.88 3n2b s ASP 392 CO 0.23 -0.26 0.00 0.61 -0.17 0.00 0.00 175.17 175.58 3n2b n GLY 393 N 4.73 3.57 1.33 2.66 0.00 -1.26 -1.56 105.19 114.66 3n2b n GLY 393 Ca 0.08 -0.04 0.09 0.00 0.00 0.00 0.00 46.02 46.15 3n2b n GLY 393 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3n2b n ASN 394 N 9.11 4.31 -4.81 1.61 0.23 -1.26 -0.80 115.26 123.66 3n2b n ASN 394 Ca 0.00 -2.42 -0.29 0.00 -0.53 0.00 0.00 54.58 51.35 3n2b n ASN 394 Cb 0.00 -0.51 -0.06 0.00 -2.08 0.00 0.00 39.78 37.13 3n2b n ASN 394 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 3n2b s LYS 395 N -1.77 2.97 -0.05 -3.83 -0.14 -0.60 -4.85 119.74 111.46 3n2b s LYS 395 Ca 0.45 -0.73 0.04 0.00 -1.36 0.00 0.00 55.97 54.38 3n2b s LYS 395 Cb 0.29 -2.74 -0.00 0.00 -1.68 0.00 0.00 37.83 33.70 3n2b s LYS 395 CO 0.22 0.54 -0.17 0.95 -0.76 0.00 0.00 175.35 176.13 3n2b s THR 396 N -1.55 1.43 -0.09 2.17 -4.23 -1.26 -1.51 115.64 110.60 3n2b s THR 396 Ca 0.31 -0.71 0.02 0.00 -1.18 0.00 0.00 61.69 60.13 3n2b s THR 396 Cb -0.11 -1.24 0.01 0.00 1.34 0.00 0.00 72.50 72.50 3n2b s THR 396 CO 0.23 0.41 -0.16 -0.31 -0.54 0.00 0.00 174.62 174.26 3n2b s TYR 397 N 0.10 1.88 0.01 3.99 2.02 0.48 -4.98 117.35 120.85 3n2b s TYR 397 Ca -0.05 -0.79 -0.30 0.00 -0.37 0.00 0.00 57.07 55.56 3n2b s TYR 397 Cb -0.12 -1.34 -0.05 0.00 -0.40 0.00 0.00 41.96 40.05 3n2b s TYR 397 CO 0.03 -0.38 1.23 -1.17 -1.57 0.00 0.00 175.55 173.69 3n2b s LEU 398 N 0.71 4.33 -0.00 -1.29 2.96 -1.26 -0.31 118.68 123.81 3n2b s LEU 398 Ca -0.13 1.96 0.06 0.00 -0.22 0.00 0.00 54.13 55.80 3n2b s LEU 398 Cb -0.16 -3.57 -0.07 0.00 0.50 0.00 0.00 46.19 42.89 3n2b s LEU 398 CO 0.03 -0.55 0.22 1.33 -1.32 0.00 0.00 176.35 176.06 3n2b n VAL 399 N 4.30 0.00 -3.67 1.68 0.24 -0.40 -4.92 118.33 115.56 3n2b n VAL 399 Ca 0.10 -0.32 -0.09 0.00 -2.04 0.00 0.00 64.34 61.99 3n2b n VAL 399 Cb 0.46 0.88 -0.10 0.00 -1.47 0.00 0.00 33.84 33.61 3n2b n VAL 399 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3n2b s ARG 400 N -1.71 0.35 0.35 7.34 3.52 -0.62 -4.70 118.95 123.47 3n2b s ARG 400 Ca 0.01 0.97 -0.27 0.00 -0.13 0.00 0.00 55.73 56.31 3n2b s ARG 400 Cb 0.04 0.23 -0.09 0.00 -1.56 0.00 0.00 34.95 33.57 3n2b s ARG 400 CO 0.24 -0.22 1.19 -0.65 -0.81 0.00 0.00 175.30 175.04 3n2b s GLN 401 N 2.25 4.30 0.35 5.12 -0.21 -1.26 -1.19 119.66 129.02 3n2b s GLN 401 Ca -0.04 1.93 -0.29 0.00 0.02 0.00 0.00 55.36 56.98 3n2b s GLN 401 Cb -0.11 -2.92 -0.11 0.00 1.00 0.00 0.00 33.01 30.87 3n2b s GLN 401 CO -0.13 -0.14 1.52 0.50 -2.12 0.00 0.00 175.29 174.93 3n2b s ARG 402 N -1.93 4.11 0.42 2.91 3.52 -1.26 -4.65 118.95 122.06 3n2b s ARG 402 Ca 0.51 2.58 -0.25 0.00 -0.13 0.00 0.00 55.73 58.45 3n2b s ARG 402 Cb -0.33 -2.98 -0.08 0.00 -1.56 0.00 0.00 34.95 29.99 3n2b s ARG 402 CO 0.43 -0.57 1.23 -1.21 -0.81 0.00 0.00 175.30 174.36 3n2b s GLU 403 N -1.60 3.93 0.13 5.12 2.02 -0.70 -4.95 118.70 122.65 3n2b s GLU 403 Ca 0.56 1.96 -0.30 0.00 0.02 0.00 0.00 54.97 57.21 3n2b s GLU 403 Cb -0.47 -2.64 -0.06 0.00 0.10 0.00 0.00 34.13 31.05 3n2b s GLU 403 CO 0.59 -0.47 1.05 -1.21 0.02 0.00 0.00 175.26 175.24 3n2b s GLU 404 N -2.37 4.61 0.14 1.61 0.41 -1.26 -4.73 118.70 117.11 3n2b s GLU 404 Ca 0.59 1.61 -0.24 0.00 -0.41 0.00 0.00 54.97 56.52 3n2b s GLU 404 Cb -0.34 -3.33 -0.01 0.00 -1.78 0.00 0.00 34.13 28.68 3n2b s GLU 404 CO 0.42 0.08 1.63 1.25 -0.49 0.00 0.00 175.26 178.15 3n2b h LEU 405 N 5.57 -0.77 -2.86 1.80 5.85 -1.99 -2.32 115.31 120.57 3n2b h LEU 405 Ca -0.43 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.41 3n2b h LEU 405 Cb 1.21 0.34 0.00 0.00 0.37 0.00 0.00 40.66 42.59 3n2b h LEU 405 CO 0.73 -0.30 0.00 0.28 -0.34 0.00 0.00 178.44 178.82 3n2b h SER 406 N -0.31 0.00 0.85 1.25 0.02 -2.01 -1.84 113.55 111.52 3n2b h SER 406 Ca 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.06 3n2b h SER 406 Cb 0.46 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.00 3n2b h SER 406 CO -0.32 0.00 0.00 0.77 -1.14 0.00 0.00 176.83 176.14 3n2b h SER 407 N 0.00 0.00 -0.35 3.07 4.64 -1.82 -3.15 113.55 115.94 3n2b h SER 407 Ca 0.00 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 3n2b h SER 407 Cb 0.01 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.08 3n2b h SER 407 CO 0.00 0.00 0.23 -0.07 -0.87 0.00 0.00 176.83 176.12 3n2b h LEU 408 N 0.00 0.40 -3.05 5.97 4.07 -1.46 -2.78 115.31 118.46 3n2b h LEU 408 Ca 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.95 3n2b h LEU 408 Cb 0.43 -0.10 0.00 0.00 1.08 0.00 0.00 40.66 42.07 3n2b h LEU 408 CO 0.00 0.29 0.00 -2.67 -1.08 0.00 0.00 178.44 174.98 3n2b n TRP 409 N -4.48 0.17 0.29 1.13 2.14 -1.19 -4.75 117.44 110.74 3n2b n TRP 409 Ca 0.02 -0.95 0.16 0.00 2.07 0.00 0.00 57.50 58.80 3n2b n TRP 409 Cb 0.07 -0.17 0.88 0.00 -0.81 0.00 0.00 31.31 31.27 3n2b n TRP 409 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 3n2b h ALA 410 N 0.34 1.19 -0.22 -1.67 0.00 -1.47 -1.80 119.26 115.63 3n2b h ALA 410 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3n2b h ALA 410 Cb 1.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3n2b h ALA 410 CO 0.04 0.07 0.00 1.28 0.00 0.00 0.00 179.25 180.64 3n2b n LEU 411 N -3.43 2.40 -4.94 0.00 4.77 -1.26 -4.96 117.00 109.58 3n2b n LEU 411 Ca -0.02 -0.98 -0.20 0.00 -0.03 0.00 0.00 56.01 54.78 3n2b n LEU 411 Cb 0.18 -0.14 -0.02 0.00 -2.33 0.00 0.00 43.42 41.12 3n2b n LEU 411 CO 0.27 0.49 0.01 -1.61 -1.33 0.00 0.00 177.39 175.22 3n2b s GLU 412 N -1.72 2.99 -0.04 3.23 2.02 -0.68 -5.13 118.70 119.38 3n2b s GLU 412 Ca 0.34 -1.10 -0.09 0.00 0.02 0.00 0.00 54.97 54.14 3n2b s GLU 412 Cb 0.20 -2.70 0.01 0.00 0.10 0.00 0.00 34.13 31.74 3n2b s GLU 412 CO 0.29 0.09 0.21 -1.12 0.02 0.00 0.00 175.26 174.75 3n2b s SER 413 N -4.11 -0.13 0.91 -0.19 0.01 -1.26 -5.09 113.70 103.83 3n2b s SER 413 Ca 0.43 0.15 -0.12 0.00 1.31 0.00 0.00 55.95 57.72 3n2b s SER 413 Cb -0.08 0.34 0.19 0.00 0.21 0.00 0.00 66.02 66.68 3n2b s SER 413 CO 0.29 -0.26 1.24 0.68 0.41 0.00 0.00 173.24 175.61 3n2b s VAL 414 N -0.71 2.03 0.28 3.43 -7.23 -1.26 -5.04 120.40 111.90 3n2b s VAL 414 Ca -0.08 -0.16 -0.20 0.00 -1.81 0.00 0.00 61.98 59.73 3n2b s VAL 414 Cb -0.04 -2.87 -0.09 0.00 0.56 0.00 0.00 36.38 33.94 3n2b s VAL 414 CO 0.02 0.00 0.79 -0.76 -0.31 0.00 0.00 175.10 174.84 3n2b s LEU 415 N -5.71 4.25 0.18 1.32 1.43 -1.26 -4.96 118.68 113.93 3n2b s LEU 415 Ca 0.72 1.49 0.09 0.00 -1.03 0.00 0.00 54.13 55.41 3n2b s LEU 415 Cb -0.04 -3.86 -0.05 0.00 0.03 0.00 0.00 46.19 42.27 3n2b s LEU 415 CO 0.51 -0.07 1.37 1.55 0.23 0.00 0.00 176.35 179.94 3n2b h PRO 416 N 2.98 0.00 0.00 1.29 0.13 -2.08 -3.58 132.00 130.75 3n2b h PRO 416 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3n2b h PRO 416 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3n2b h PRO 416 CO 0.65 0.83 0.00 -1.91 -0.23 0.00 0.00 178.00 177.34