#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aaz n ASP 17 N 0.00 1.35 -4.68 2.55 8.00 -1.26 -4.89 116.55 117.61 2aaz n ASP 17 Ca 0.00 -1.56 -0.42 0.00 0.71 0.00 0.00 54.79 53.52 2aaz n ASP 17 Cb 0.00 -0.05 -0.03 0.00 -0.02 0.00 0.00 41.12 41.02 2aaz n ASP 17 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2aaz s HIS 18 N -1.89 1.87 0.61 1.24 2.46 -1.26 -4.85 115.29 113.46 2aaz s HIS 18 Ca 0.35 -0.17 0.30 0.00 0.47 0.00 0.00 55.06 56.01 2aaz s HIS 18 Cb 0.19 -4.20 1.61 0.00 -0.13 0.00 0.00 32.58 30.05 2aaz s HIS 18 CO 0.29 -5.10 2.00 0.93 -2.47 0.00 0.00 174.74 170.39 2aaz h GLU 19 N 9.23 0.00 0.00 2.88 5.08 -1.93 -1.62 114.58 128.23 2aaz h GLU 19 Ca -0.47 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.88 2aaz h GLU 19 Cb 1.22 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.47 2aaz h GLU 19 CO 0.95 0.00 -0.06 1.49 -1.00 0.00 0.00 179.01 180.38 2aaz h GLU 20 N 0.00 0.00 0.00 2.33 4.81 -1.96 -2.23 114.58 117.52 2aaz h GLU 20 Ca 0.11 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 2aaz h GLU 20 Cb 0.76 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.14 2aaz h GLU 20 CO -0.00 0.06 0.00 1.88 -0.73 0.00 0.00 179.01 180.22 2aaz h TYR 21 N 0.00 0.00 -0.45 0.92 -1.99 -1.65 -1.59 116.97 112.21 2aaz h TYR 21 Ca -0.00 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.70 2aaz h TYR 21 Cb 0.38 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.09 2aaz h TYR 21 CO 0.00 0.00 0.17 1.96 -0.00 0.00 0.00 178.16 180.29 2aaz h GLN 22 N 0.00 0.68 -0.11 4.88 4.20 -1.60 0.25 115.11 123.42 2aaz h GLN 22 Ca 0.00 -0.13 -0.04 0.00 0.06 0.00 0.00 58.65 58.54 2aaz h GLN 22 Cb 0.22 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 27.89 2aaz h GLN 22 CO 0.00 0.64 -0.09 -0.92 -0.67 0.00 0.00 178.83 177.79 2aaz h TYR 23 N 0.59 0.30 -0.58 2.96 5.03 -1.48 -2.47 116.97 121.32 2aaz h TYR 23 Ca 0.15 -0.09 -0.04 0.00 2.58 0.00 0.00 58.73 61.33 2aaz h TYR 23 Cb 0.22 -0.06 -0.02 0.00 1.55 0.00 0.00 36.73 38.41 2aaz h TYR 23 CO 0.01 0.65 0.19 -0.07 -1.32 0.00 0.00 178.16 177.61 2aaz h LEU 24 N -0.14 0.84 -0.73 2.82 3.38 -1.33 -2.62 115.31 117.53 2aaz h LEU 24 Ca 0.02 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.71 2aaz h LEU 24 Cb 0.59 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 2aaz h LEU 24 CO 0.02 0.82 0.12 0.44 0.09 0.00 0.00 178.44 179.93 2aaz h ASP 25 N 0.81 1.04 -0.41 -0.43 3.45 -0.54 -1.94 116.42 118.41 2aaz h ASP 25 Ca 0.19 -0.24 -0.02 0.00 0.43 0.00 0.00 57.03 57.38 2aaz h ASP 25 Cb 0.28 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 38.75 2aaz h ASP 25 CO -0.01 1.03 0.16 0.25 -1.57 0.00 0.00 179.24 179.10 2aaz h LEU 26 N 1.03 0.57 -0.48 1.55 5.85 -1.32 -0.34 115.31 122.16 2aaz h LEU 26 Ca 0.21 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.76 2aaz h LEU 26 Cb 0.42 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 2aaz h LEU 26 CO 0.01 0.58 0.31 0.40 -0.34 0.00 0.00 178.44 179.40 2aaz h ILE 27 N 0.51 1.10 -0.76 4.05 2.04 -1.34 0.17 117.51 123.29 2aaz h ILE 27 Ca 0.13 -0.21 0.01 0.00 1.00 0.00 0.00 64.86 65.79 2aaz h ILE 27 Cb 0.20 0.42 -0.04 0.00 -0.74 0.00 0.00 36.82 36.66 2aaz h ILE 27 CO -0.01 0.11 0.50 -0.09 0.00 0.00 0.00 178.15 178.66 2aaz h ARG 28 N 0.62 0.98 -0.31 2.37 2.43 -1.10 -1.18 114.38 118.20 2aaz h ARG 28 Ca 0.18 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.25 2aaz h ARG 28 Cb -0.05 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.27 2aaz h ARG 28 CO -0.05 0.65 0.02 -0.09 -1.51 0.00 0.00 179.97 178.99 2aaz h ARG 29 N 1.01 0.52 -0.56 0.20 2.43 -0.39 -1.49 114.38 116.11 2aaz h ARG 29 Ca 0.29 -0.15 0.02 0.00 -0.81 0.00 0.00 59.98 59.32 2aaz h ARG 29 Cb -0.09 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.38 2aaz h ARG 29 CO -0.07 0.64 0.35 0.82 -1.51 0.00 0.00 179.97 180.20 2aaz h ILE 30 N 0.33 1.10 -0.72 1.20 2.04 -0.33 0.12 117.51 121.25 2aaz h ILE 30 Ca 0.09 -0.24 -0.06 0.00 1.00 0.00 0.00 64.86 65.64 2aaz h ILE 30 Cb 0.39 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 36.77 2aaz h ILE 30 CO 0.01 0.13 0.19 0.40 0.00 0.00 0.00 178.15 178.88 2aaz h ILE 31 N 0.71 1.26 0.33 -0.67 2.04 -1.14 0.38 117.51 120.42 2aaz h ILE 31 Ca 0.21 -0.95 -0.02 0.00 1.00 0.00 0.00 64.86 65.11 2aaz h ILE 31 Cb -0.03 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 36.56 2aaz h ILE 31 CO -0.07 0.37 -0.16 0.78 0.00 0.00 0.00 178.15 179.06 2aaz h ASN 32 N 1.08 -0.38 -0.21 1.72 -0.26 -0.70 -3.39 115.58 113.43 2aaz h ASN 32 Ca 0.23 -0.10 0.00 0.00 -0.56 0.00 0.00 56.30 55.87 2aaz h ASN 32 Cb 0.35 0.10 0.00 0.00 -1.06 0.00 0.00 38.32 37.70 2aaz h ASN 32 CO -0.00 0.08 0.00 1.33 -1.06 0.00 0.00 177.43 177.78 2aaz n VAL 33 N -5.08 0.80 -1.00 2.81 0.24 0.38 -5.04 118.33 111.44 2aaz n VAL 33 Ca -0.07 -0.90 -0.31 0.00 -2.04 0.00 0.00 64.34 61.02 2aaz n VAL 33 Cb 0.23 0.64 0.13 0.00 -1.47 0.00 0.00 33.84 33.37 2aaz n VAL 33 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2aaz s GLY 34 N -0.94 1.72 -0.21 7.63 0.00 0.13 -4.99 107.32 110.67 2aaz s GLY 34 Ca 0.16 0.47 -0.13 0.00 0.00 0.00 0.00 44.72 45.22 2aaz s GLY 34 CO 0.12 0.85 0.25 1.85 0.00 0.00 0.00 173.10 176.17 2aaz s GLU 35 N -4.71 4.16 -0.03 2.90 2.12 -0.02 -4.72 118.70 118.39 2aaz s GLU 35 Ca 0.65 -0.05 -0.30 0.00 0.36 0.00 0.00 54.97 55.63 2aaz s GLU 35 Cb -0.21 -3.50 -0.05 0.00 0.26 0.00 0.00 34.13 30.64 2aaz s GLU 35 CO 0.56 0.10 1.40 0.08 -0.54 0.00 0.00 175.26 176.86 2aaz s VAL 36 N 0.92 3.81 0.03 3.70 1.01 -1.26 -0.94 120.40 127.68 2aaz s VAL 36 Ca 0.13 1.14 0.00 0.00 0.00 0.00 0.00 61.98 63.25 2aaz s VAL 36 Cb -0.13 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 2aaz s VAL 36 CO 0.04 -0.03 -0.04 -0.13 0.00 0.00 0.00 175.10 174.95 2aaz s ARG 37 N 2.75 0.43 0.72 2.72 0.52 0.45 -4.99 118.95 121.56 2aaz s ARG 37 Ca 0.63 -0.80 -0.11 0.00 -0.52 0.00 0.00 55.73 54.93 2aaz s ARG 37 Cb -0.30 0.06 0.03 0.00 0.52 0.00 0.00 34.95 35.26 2aaz s ARG 37 CO 0.25 -0.05 1.11 -2.14 0.02 0.00 0.00 175.30 174.49 2aaz s PRO 38 N -2.13 2.70 0.32 3.54 0.02 -1.26 -1.36 135.00 136.83 2aaz s PRO 38 Ca -0.09 0.39 -0.12 0.00 0.02 0.00 0.00 61.00 61.20 2aaz s PRO 38 Cb -0.05 -2.02 0.02 0.00 0.02 0.00 0.00 34.50 32.47 2aaz s PRO 38 CO -0.03 -1.12 0.61 0.16 -0.33 0.00 0.00 177.00 176.28 2aaz s ASP 39 N -4.40 0.17 0.25 2.53 -4.77 -1.26 -4.79 116.67 104.40 2aaz s ASP 39 Ca 0.59 -1.08 -0.03 0.00 -3.30 0.00 0.00 52.55 48.72 2aaz s ASP 39 Cb -0.11 0.71 0.42 0.00 -1.09 0.00 0.00 42.92 42.84 2aaz s ASP 39 CO 0.51 -1.37 1.82 -0.09 0.70 0.00 0.00 175.17 176.74 2aaz h ARG 40 N 2.10 0.82 -0.03 2.11 2.43 -2.01 -2.53 114.38 117.28 2aaz h ARG 40 Ca -0.27 -0.05 -0.10 0.00 -0.81 0.00 0.00 59.98 58.74 2aaz h ARG 40 Cb 1.25 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.60 2aaz h ARG 40 CO 0.36 0.54 -0.47 1.79 -1.51 0.00 0.00 179.97 180.68 2aaz h THR 41 N 0.84 1.34 0.00 0.20 1.35 -1.91 -3.47 112.91 111.26 2aaz h THR 41 Ca 0.41 -1.62 0.00 0.00 -0.55 0.00 0.00 66.41 64.65 2aaz h THR 41 Cb 0.36 1.84 0.00 0.00 -1.73 0.00 0.00 68.15 68.62 2aaz h THR 41 CO -0.24 0.47 0.00 0.61 -0.25 0.00 0.00 175.52 176.11 2aaz n GLY 42 N -0.15 0.68 0.11 5.82 0.00 -0.95 -4.91 105.19 105.79 2aaz n GLY 42 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.06 2aaz n GLY 42 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2aaz h THR 43 N 0.00 0.28 0.00 2.61 1.35 -1.92 -3.48 112.91 111.76 2aaz h THR 43 Ca 0.00 -1.51 0.00 0.00 -0.55 0.00 0.00 66.41 64.35 2aaz h THR 43 Cb 0.00 1.83 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 2aaz h THR 43 CO 0.00 0.16 0.00 0.61 -0.25 0.00 0.00 175.52 176.04 2aaz n GLY 44 N 1.27 -1.21 3.57 5.82 0.00 -1.26 -4.52 105.19 108.85 2aaz n GLY 44 Ca -0.04 -1.58 -0.13 0.00 0.00 0.00 0.00 46.02 44.28 2aaz n GLY 44 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2aaz s THR 45 N -3.00 0.00 -0.10 2.61 -4.23 -0.46 -2.10 115.64 108.35 2aaz s THR 45 Ca 0.00 -1.45 0.01 0.00 -1.18 0.00 0.00 61.69 59.07 2aaz s THR 45 Cb 0.00 -2.64 0.02 0.00 1.34 0.00 0.00 72.50 71.22 2aaz s THR 45 CO 0.00 0.00 -0.11 0.54 -0.54 0.00 0.00 174.62 174.51 2aaz s VAL 46 N -3.01 1.18 0.17 2.29 0.11 -0.84 -0.41 120.40 119.89 2aaz s VAL 46 Ca 0.26 -0.44 -0.02 0.00 -2.93 0.00 0.00 61.98 58.85 2aaz s VAL 46 Cb -0.01 -1.12 -0.04 0.00 -1.53 0.00 0.00 36.38 33.68 2aaz s VAL 46 CO 0.17 0.38 0.12 0.00 -3.33 0.00 0.00 175.10 172.45 2aaz s ALA 47 N 1.19 0.89 0.01 1.54 0.00 -0.11 -1.39 121.76 123.89 2aaz s ALA 47 Ca -0.04 -1.51 0.01 0.00 0.00 0.00 0.00 51.96 50.42 2aaz s ALA 47 Cb -0.14 1.11 -0.01 0.00 0.00 0.00 0.00 23.12 24.08 2aaz s ALA 47 CO -0.03 -0.56 -0.04 -0.51 0.00 0.00 0.00 175.76 174.61 2aaz s LEU 48 N -3.09 2.12 -0.11 0.00 1.43 -0.33 -0.84 118.68 117.85 2aaz s LEU 48 Ca 0.30 -0.27 -0.05 0.00 -1.03 0.00 0.00 54.13 53.08 2aaz s LEU 48 Cb 0.07 -0.12 -0.04 0.00 0.03 0.00 0.00 46.19 46.13 2aaz s LEU 48 CO 0.07 -0.09 0.09 0.12 0.23 0.00 0.00 176.35 176.77 2aaz s PHE 49 N -0.68 3.43 -1.25 0.29 5.36 -1.26 -1.62 117.98 122.25 2aaz s PHE 49 Ca -0.05 0.40 -0.23 0.00 -0.96 0.00 0.00 56.93 56.09 2aaz s PHE 49 Cb -0.05 -1.90 0.02 0.00 -0.34 0.00 0.00 43.02 40.75 2aaz s PHE 49 CO -0.00 0.62 0.61 0.00 -1.46 0.00 0.00 175.22 174.98 2aaz n ALA 50 N 2.12 -2.46 -1.63 11.12 0.00 0.33 -4.96 120.51 125.04 2aaz n ALA 50 Ca -0.19 -0.43 -0.29 0.00 0.00 0.00 0.00 53.44 52.52 2aaz n ALA 50 Cb 0.54 -2.74 0.11 0.00 0.00 0.00 0.00 19.45 17.37 2aaz n ALA 50 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2aaz s PRO 51 N -6.91 1.62 0.34 0.00 0.04 -1.26 -4.94 135.00 123.89 2aaz s PRO 51 Ca 0.38 0.35 -0.27 0.00 0.04 0.00 0.00 61.00 61.50 2aaz s PRO 51 Cb -0.18 -1.89 -0.13 0.00 0.04 0.00 0.00 34.50 32.34 2aaz s PRO 51 CO 0.93 -1.88 1.02 -2.30 0.04 0.00 0.00 177.00 174.82 2aaz n PRO 52 N -3.56 1.41 -1.58 0.56 -0.02 -1.26 -4.60 135.00 125.95 2aaz n PRO 52 Ca 0.07 0.50 -0.32 0.00 -2.02 0.00 0.00 63.50 61.73 2aaz n PRO 52 Cb 0.59 -1.94 0.06 0.00 -0.02 0.00 0.00 33.50 32.18 2aaz n PRO 52 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2aaz s SER 53 N -0.60 5.02 0.15 2.55 1.04 -1.26 -4.87 113.70 115.72 2aaz s SER 53 Ca 0.60 1.85 -0.08 0.00 0.48 0.00 0.00 55.95 58.79 2aaz s SER 53 Cb -0.64 -2.53 -0.06 0.00 0.10 0.00 0.00 66.02 62.89 2aaz s SER 53 CO 0.59 -1.69 0.44 -0.36 0.98 0.00 0.00 173.24 173.20 2aaz s PHE 54 N -2.68 3.49 -0.06 5.02 0.08 -0.34 -4.91 117.98 118.58 2aaz s PHE 54 Ca 0.63 0.73 0.01 0.00 0.12 0.00 0.00 56.93 58.42 2aaz s PHE 54 Cb -0.18 -2.14 0.02 0.00 -0.57 0.00 0.00 43.02 40.16 2aaz s PHE 54 CO 0.48 0.41 -0.06 1.03 -0.10 0.00 0.00 175.22 176.99 2aaz s ARG 55 N -2.48 1.06 -0.07 0.44 0.52 -1.26 -1.09 118.95 116.07 2aaz s ARG 55 Ca 0.41 -0.15 0.02 0.00 -0.52 0.00 0.00 55.73 55.48 2aaz s ARG 55 Cb -0.12 -1.07 0.01 0.00 0.52 0.00 0.00 34.95 34.29 2aaz s ARG 55 CO 0.22 -0.12 -0.13 -0.06 0.02 0.00 0.00 175.30 175.23 2aaz s PHE 56 N 1.13 1.51 0.12 -0.53 0.08 0.10 -4.97 117.98 115.42 2aaz s PHE 56 Ca -0.07 -0.57 -0.30 0.00 0.12 0.00 0.00 56.93 56.10 2aaz s PHE 56 Cb -0.14 -1.11 -0.06 0.00 -0.57 0.00 0.00 43.02 41.14 2aaz s PHE 56 CO -0.01 -0.30 1.04 0.45 -0.10 0.00 0.00 175.22 176.31 2aaz s SER 57 N 0.70 7.35 0.00 1.36 0.15 -1.26 -0.72 113.70 121.28 2aaz s SER 57 Ca -0.14 1.92 0.10 0.00 0.70 0.00 0.00 55.95 58.53 2aaz s SER 57 Cb -0.16 -2.59 0.26 0.00 -1.71 0.00 0.00 66.02 61.82 2aaz s SER 57 CO 0.03 -0.19 1.19 0.18 1.20 0.00 0.00 173.24 175.66 2aaz n LEU 58 N 2.86 2.76 -4.78 3.45 4.77 0.63 -4.75 117.00 121.94 2aaz n LEU 58 Ca 0.04 -1.90 -0.31 0.00 -0.03 0.00 0.00 56.01 53.81 2aaz n LEU 58 Cb 0.48 -0.19 0.07 0.00 -2.33 0.00 0.00 43.42 41.45 2aaz n LEU 58 CO 0.53 0.68 0.71 0.00 -1.33 0.00 0.00 177.39 177.98 2aaz s ALA 59 N -0.99 2.38 -1.45 -1.18 0.00 -1.22 -3.54 121.76 115.77 2aaz s ALA 59 Ca 0.21 0.30 -0.10 0.00 0.00 0.00 0.00 51.96 52.37 2aaz s ALA 59 Cb 0.11 -3.27 0.04 0.00 0.00 0.00 0.00 23.12 20.00 2aaz s ALA 59 CO 0.14 -1.55 1.01 -0.25 0.00 0.00 0.00 175.76 175.11 2aaz n ASP 60 N -3.18 -5.68 -1.98 0.00 8.00 -1.26 -1.94 116.55 110.51 2aaz n ASP 60 Ca 0.09 -0.59 -0.17 0.00 0.71 0.00 0.00 54.79 54.83 2aaz n ASP 60 Cb 0.53 -4.51 -0.04 0.00 -0.02 0.00 0.00 41.12 37.08 2aaz n ASP 60 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2aaz n ASN 61 N -2.85 -4.80 -4.75 -2.24 4.13 -1.24 -4.90 115.26 98.61 2aaz n ASN 61 Ca 0.01 0.24 -0.41 0.00 1.68 0.00 0.00 54.58 56.10 2aaz n ASN 61 Cb 0.55 -4.16 -0.04 0.00 -1.54 0.00 0.00 39.78 34.59 2aaz n ASN 61 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2aaz s THR 62 N -2.66 3.50 -0.24 3.41 2.01 -0.82 -0.30 115.64 120.54 2aaz s THR 62 Ca 0.00 1.37 0.02 0.00 0.31 0.00 0.00 61.69 63.39 2aaz s THR 62 Cb 0.00 -3.88 0.05 0.00 0.01 0.00 0.00 72.50 68.69 2aaz s THR 62 CO 0.00 0.27 -0.10 -0.22 -0.69 0.00 0.00 174.62 173.88 2aaz s LEU 63 N -0.83 2.97 -0.77 4.42 2.96 -0.62 -4.58 118.68 122.23 2aaz s LEU 63 Ca 0.49 -1.21 -0.20 0.00 -0.22 0.00 0.00 54.13 52.99 2aaz s LEU 63 Cb -0.33 -1.42 -0.14 0.00 0.50 0.00 0.00 46.19 44.80 2aaz s LEU 63 CO 0.39 -0.18 1.94 -0.81 -1.32 0.00 0.00 176.35 176.37 2aaz n PRO 64 N 4.54 1.55 -3.38 0.98 -0.04 -1.26 -3.86 135.00 133.53 2aaz n PRO 64 Ca -0.14 -1.77 -0.43 0.00 -0.04 0.00 0.00 63.50 61.11 2aaz n PRO 64 Cb 0.44 -2.84 -0.09 0.00 -0.04 0.00 0.00 33.50 30.97 2aaz n PRO 64 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2aaz s LEU 65 N 1.00 5.11 0.19 1.53 2.96 -1.26 -4.25 118.68 123.96 2aaz s LEU 65 Ca 0.55 -0.90 -0.30 0.00 -0.22 0.00 0.00 54.13 53.26 2aaz s LEU 65 Cb 0.14 -2.26 -0.17 0.00 0.50 0.00 0.00 46.19 44.40 2aaz s LEU 65 CO 0.10 -0.56 0.73 0.18 -1.32 0.00 0.00 176.35 175.48 2aaz n LEU 66 N 5.39 -0.25 -0.00 -0.68 4.77 -1.26 -4.73 117.00 120.24 2aaz n LEU 66 Ca -0.10 1.14 0.04 0.00 -0.03 0.00 0.00 56.01 57.07 2aaz n LEU 66 Cb 0.46 -1.04 -0.05 0.00 -2.33 0.00 0.00 43.42 40.47 2aaz n LEU 66 CO 0.45 -2.40 -0.03 0.35 -1.33 0.00 0.00 177.39 174.43 2aaz n THR 67 N 0.34 0.00 1.47 -5.08 -2.24 -1.26 -4.52 114.28 102.99 2aaz n THR 67 Ca 0.16 -0.29 0.09 0.00 -2.27 0.00 0.00 64.05 61.73 2aaz n THR 67 Cb 0.25 0.99 0.51 0.00 -2.10 0.00 0.00 70.33 69.97 2aaz n THR 67 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2aaz n THR 68 N -1.21 0.00 -3.54 4.28 -2.24 -1.26 -1.02 114.28 109.28 2aaz n THR 68 Ca 0.02 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.69 2aaz n THR 68 Cb 0.14 -0.50 -0.04 0.00 -2.10 0.00 0.00 70.33 67.83 2aaz n THR 68 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 2aaz s LYS 69 N -2.00 0.74 -0.21 -0.78 -2.85 -1.26 -4.63 119.74 108.75 2aaz s LYS 69 Ca 0.26 -0.01 -0.29 0.00 -1.00 0.00 0.00 55.97 54.92 2aaz s LYS 69 Cb 0.12 0.35 -0.00 0.00 -2.06 0.00 0.00 37.83 36.23 2aaz s LYS 69 CO 0.20 -0.27 1.20 0.50 0.10 0.00 0.00 175.35 177.08 2aaz s ARG 70 N -1.89 4.19 -0.14 1.78 3.52 -1.12 -4.55 118.95 120.74 2aaz s ARG 70 Ca -0.00 1.50 -0.10 0.00 -0.13 0.00 0.00 55.73 57.00 2aaz s ARG 70 Cb -0.01 -3.75 -0.05 0.00 -1.56 0.00 0.00 34.95 29.59 2aaz s ARG 70 CO -0.01 -0.76 0.19 0.08 -0.81 0.00 0.00 175.30 173.99 2aaz s VAL 71 N 3.56 5.39 -1.07 7.11 1.01 -1.26 -4.77 120.40 130.37 2aaz s VAL 71 Ca 0.52 0.33 -0.23 0.00 0.00 0.00 0.00 61.98 62.60 2aaz s VAL 71 Cb -0.19 -3.50 -0.12 0.00 0.00 0.00 0.00 36.38 32.57 2aaz s VAL 71 CO 0.14 0.52 1.94 0.33 0.00 0.00 0.00 175.10 178.02 2aaz n PHE 72 N 2.74 2.34 -0.07 5.22 -0.00 -1.26 -4.78 117.46 121.65 2aaz n PHE 72 Ca -0.17 -1.38 -0.07 0.00 -0.00 0.00 0.00 57.45 55.83 2aaz n PHE 72 Cb 0.53 -2.41 -0.01 0.00 -0.00 0.00 0.00 39.48 37.60 2aaz n PHE 72 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 2aaz h LEU 73 N 17.53 -0.69 -1.52 -2.13 5.85 -2.00 -1.10 115.31 131.25 2aaz h LEU 73 Ca 0.24 0.14 0.13 0.00 0.84 0.00 0.00 57.88 59.22 2aaz h LEU 73 Cb 0.89 0.35 -0.05 0.00 0.37 0.00 0.00 40.66 42.21 2aaz h LEU 73 CO 1.36 -0.25 0.49 -0.09 -0.34 0.00 0.00 178.44 179.61 2aaz h ARG 74 N -0.19 0.49 -0.51 1.25 2.43 -2.00 -0.27 114.38 115.58 2aaz h ARG 74 Ca 0.15 -0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.18 2aaz h ARG 74 Cb 0.43 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 2aaz h ARG 74 CO -0.41 0.32 -0.12 0.78 -1.51 0.00 0.00 179.97 179.04 2aaz h GLY 75 N 0.51 1.06 0.90 2.80 0.00 -1.61 -0.26 103.07 106.46 2aaz h GLY 75 Ca 0.36 -0.87 -0.01 0.00 0.00 0.00 0.00 47.33 46.81 2aaz h GLY 75 CO -0.12 0.80 0.07 -2.08 0.00 0.00 0.00 176.54 175.20 2aaz h VAL 76 N 0.84 1.13 -0.18 4.60 2.07 -0.49 -1.53 116.25 122.68 2aaz h VAL 76 Ca 0.13 -0.38 -0.00 0.00 0.82 0.00 0.00 66.70 67.27 2aaz h VAL 76 Cb 0.69 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 2aaz h VAL 76 CO 0.05 0.12 0.09 0.40 0.02 0.00 0.00 177.57 178.25 2aaz h ILE 77 N 0.09 1.11 -0.42 4.57 2.04 -1.15 -1.68 117.51 122.07 2aaz h ILE 77 Ca 0.05 -0.30 0.04 0.00 1.00 0.00 0.00 64.86 65.65 2aaz h ILE 77 Cb 0.13 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 2aaz h ILE 77 CO -0.01 0.10 0.20 0.00 0.00 0.00 0.00 178.15 178.44 2aaz h ALA 78 N 0.98 0.52 -0.76 1.87 0.00 -0.97 -1.07 119.26 119.83 2aaz h ALA 78 Ca 0.06 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 2aaz h ALA 78 Cb 0.08 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 2aaz h ALA 78 CO -0.01 -0.17 0.40 1.49 0.00 0.00 0.00 179.25 180.96 2aaz h GLU 79 N 0.40 1.07 0.08 0.00 4.81 -1.15 -1.35 114.58 118.43 2aaz h GLU 79 Ca 0.18 -0.13 -0.00 0.00 -0.13 0.00 0.00 59.36 59.28 2aaz h GLU 79 Cb 0.11 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.29 2aaz h GLU 79 CO -0.14 0.80 -0.04 1.25 -0.73 0.00 0.00 179.01 180.15 2aaz h LEU 80 N 1.05 -0.09 -2.01 1.64 5.85 -0.75 0.29 115.31 121.29 2aaz h LEU 80 Ca 0.27 -0.11 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 2aaz h LEU 80 Cb 0.06 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 2aaz h LEU 80 CO -0.04 0.05 -0.09 -0.07 -0.34 0.00 0.00 178.44 177.95 2aaz h LEU 81 N -0.23 0.00 -0.22 2.25 3.38 -1.13 -0.73 115.31 118.63 2aaz h LEU 81 Ca -0.01 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 2aaz h LEU 81 Cb 0.19 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 2aaz h LEU 81 CO 0.02 0.09 -0.16 -0.25 0.09 0.00 0.00 178.44 178.23 2aaz h TRP 82 N 0.00 0.58 0.18 1.13 7.01 -0.65 -1.87 115.95 122.34 2aaz h TRP 82 Ca -0.00 -0.16 -0.01 0.00 2.11 0.00 0.00 58.89 60.83 2aaz h TRP 82 Cb 0.21 -0.13 0.00 0.00 -2.10 0.00 0.00 29.16 27.15 2aaz h TRP 82 CO 0.00 0.81 -0.09 0.74 -2.79 0.00 0.00 178.44 177.11 2aaz h PHE 83 N 0.19 -0.23 -0.99 2.65 0.04 0.40 -2.83 116.94 116.17 2aaz h PHE 83 Ca 0.04 -0.01 0.13 0.00 2.80 0.00 0.00 57.97 60.94 2aaz h PHE 83 Cb 0.68 0.08 -0.09 0.00 2.20 0.00 0.00 35.95 38.82 2aaz h PHE 83 CO 0.07 -0.14 0.62 0.28 -0.60 0.00 0.00 178.31 178.54 2aaz h VAL 84 N -0.25 0.88 0.00 -0.55 2.07 -1.18 0.18 116.25 117.39 2aaz h VAL 84 Ca -0.03 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.17 2aaz h VAL 84 Cb 0.20 -0.15 0.00 0.00 -1.52 0.00 0.00 31.29 29.82 2aaz h VAL 84 CO 0.04 0.17 0.00 -1.54 0.02 0.00 0.00 177.57 176.26 2aaz n SER 85 N -4.65 0.60 0.00 0.57 3.41 -0.71 -4.85 113.62 108.00 2aaz n SER 85 Ca 0.19 0.67 0.00 0.00 -0.26 0.00 0.00 58.87 59.47 2aaz n SER 85 Cb 0.39 -0.79 0.00 0.00 -0.26 0.00 0.00 64.21 63.55 2aaz n SER 85 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2aaz n GLY 86 N -0.24 0.82 3.77 5.00 0.00 0.05 -5.01 105.19 109.58 2aaz n GLY 86 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 2aaz n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aaz n THR 88 N 0.33 1.05 -3.37 0.00 -2.24 -1.26 -4.56 114.28 104.23 2aaz n THR 88 Ca 0.03 -1.17 -0.42 0.00 -2.27 0.00 0.00 64.05 60.22 2aaz n THR 88 Cb 0.47 0.33 -0.09 0.00 -2.10 0.00 0.00 70.33 68.93 2aaz n THR 88 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2aaz s ASP 89 N -1.47 6.17 0.63 3.42 3.68 -1.26 -2.72 116.67 125.12 2aaz s ASP 89 Ca 0.10 -0.60 0.40 0.00 2.13 0.00 0.00 52.55 54.58 2aaz s ASP 89 Cb 0.09 -2.20 2.16 0.00 -1.45 0.00 0.00 42.92 41.51 2aaz s ASP 89 CO 0.01 -0.49 2.29 0.00 0.13 0.00 0.00 175.17 177.11 2aaz h ALA 90 N 8.64 1.11 0.00 3.66 0.00 -1.28 -1.63 119.26 129.75 2aaz h ALA 90 Ca -0.27 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2aaz h ALA 90 Cb 1.12 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 2aaz h ALA 90 CO 0.75 0.01 -0.06 0.87 0.00 0.00 0.00 179.25 180.83 2aaz h LYS 91 N 0.00 0.00 0.00 0.00 1.79 -1.89 0.06 116.57 116.52 2aaz h LYS 91 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2aaz h LYS 91 Cb 0.08 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.73 2aaz h LYS 91 CO 0.00 0.06 0.00 0.52 -1.08 0.00 0.00 179.45 178.95 2aaz h MET 92 N 0.00 0.00 0.03 3.15 2.86 -1.69 -0.60 114.93 118.68 2aaz h MET 92 Ca -0.00 0.00 -0.38 0.00 -2.06 0.00 0.00 59.70 57.26 2aaz h MET 92 Cb 0.23 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.84 2aaz h MET 92 CO 0.01 0.00 -2.21 1.28 1.06 0.00 0.00 176.91 177.05 2aaz n LEU 93 N -2.80 2.47 0.20 1.22 4.77 -0.07 -4.22 117.00 118.57 2aaz n LEU 93 Ca 0.01 0.15 0.05 0.00 -0.03 0.00 0.00 56.01 56.19 2aaz n LEU 93 Cb 0.30 -0.94 0.42 0.00 -2.33 0.00 0.00 43.42 40.86 2aaz n LEU 93 CO 0.25 0.73 0.76 0.77 -1.33 0.00 0.00 177.39 178.57 2aaz h SER 94 N -0.39 0.00 0.68 -1.43 4.64 -0.39 0.13 113.55 116.79 2aaz h SER 94 Ca -0.54 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.75 2aaz h SER 94 Cb 1.77 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.86 2aaz h SER 94 CO -0.15 0.33 -0.13 0.77 -0.87 0.00 0.00 176.83 176.78 2aaz h SER 95 N 0.00 0.00 -0.47 4.97 4.64 -1.30 -2.43 113.55 118.96 2aaz h SER 95 Ca -0.00 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.18 2aaz h SER 95 Cb 0.65 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.66 2aaz h SER 95 CO 0.04 0.13 0.09 0.00 -0.87 0.00 0.00 176.83 176.23 2aaz n GLN 96 N -3.40 2.92 -1.03 4.77 10.64 -0.85 -4.94 117.38 125.51 2aaz n GLN 96 Ca -0.01 -3.02 -0.01 0.00 -1.83 0.00 0.00 57.00 52.13 2aaz n GLN 96 Cb 0.31 -1.98 -0.00 0.00 -0.86 0.00 0.00 30.24 27.71 2aaz n GLN 96 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2aaz n GLY 97 N -0.56 0.46 3.06 2.61 0.00 -0.91 -5.04 105.19 104.81 2aaz n GLY 97 Ca 0.32 -1.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.02 2aaz n GLY 97 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2aaz s VAL 98 N -2.03 2.15 -0.28 1.61 1.01 0.40 -4.97 120.40 118.29 2aaz s VAL 98 Ca 0.00 -1.67 0.11 0.00 0.00 0.00 0.00 61.98 60.41 2aaz s VAL 98 Cb 0.00 -2.29 0.55 0.00 0.00 0.00 0.00 36.38 34.64 2aaz s VAL 98 CO 0.00 -0.08 1.52 0.61 0.00 0.00 0.00 175.10 177.16 2aaz n GLY 99 N 4.43 4.52 0.30 4.51 0.00 -1.26 -1.45 105.19 116.24 2aaz n GLY 99 Ca -0.13 -1.14 0.15 0.00 0.00 0.00 0.00 46.02 44.90 2aaz n GLY 99 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 2aaz h ILE 100 N 1.35 0.49 -0.43 -0.61 3.07 -1.94 -2.04 117.51 117.39 2aaz h ILE 100 Ca 0.20 -0.09 0.00 0.00 1.55 0.00 0.00 64.86 66.52 2aaz h ILE 100 Cb 1.77 1.06 0.00 0.00 -0.27 0.00 0.00 36.82 39.38 2aaz h ILE 100 CO 0.44 0.02 0.00 0.79 -1.05 0.00 0.00 178.15 178.35 2aaz n TRP 101 N -3.74 0.57 -0.03 0.16 7.02 -1.26 -4.48 117.44 115.67 2aaz n TRP 101 Ca -0.03 -0.41 -0.04 0.00 -1.02 0.00 0.00 57.50 56.00 2aaz n TRP 101 Cb 0.11 -0.01 0.19 0.00 -2.42 0.00 0.00 31.31 29.18 2aaz n TRP 101 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 2aaz h ASP 102 N 3.06 0.60 -0.06 -0.99 3.45 -1.70 -2.02 116.42 118.76 2aaz h ASP 102 Ca 0.00 -0.17 0.01 0.00 0.43 0.00 0.00 57.03 57.30 2aaz h ASP 102 Cb 0.82 -0.16 -0.01 0.00 -0.56 0.00 0.00 39.33 39.42 2aaz h ASP 102 CO 0.00 0.76 0.01 1.23 -1.57 0.00 0.00 179.24 179.67 2aaz h GLY 103 N 0.97 0.06 0.39 2.75 0.00 -1.79 -0.97 103.07 104.48 2aaz h GLY 103 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 2aaz h GLY 103 CO 0.04 -0.00 -0.15 0.70 0.00 0.00 0.00 176.54 177.12 2aaz n ASN 104 N -5.09 0.86 -0.36 0.19 4.13 -1.21 -3.63 115.26 110.15 2aaz n ASN 104 Ca -0.06 -0.88 0.08 0.00 1.68 0.00 0.00 54.58 55.40 2aaz n ASN 104 Cb 0.05 0.03 -0.01 0.00 -1.54 0.00 0.00 39.78 38.31 2aaz n ASN 104 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2aaz n GLY 105 N 1.28 -0.07 3.75 7.41 0.00 -0.76 -4.55 105.19 112.24 2aaz n GLY 105 Ca 0.15 -0.48 -0.38 0.00 0.00 0.00 0.00 46.02 45.31 2aaz n GLY 105 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2aaz s SER 106 N -2.01 5.14 0.41 1.61 1.04 -0.39 -0.62 113.70 118.88 2aaz s SER 106 Ca 0.13 2.66 0.11 0.00 0.48 0.00 0.00 55.95 59.34 2aaz s SER 106 Cb 0.13 -2.63 0.94 0.00 0.10 0.00 0.00 66.02 64.57 2aaz s SER 106 CO 0.44 -1.65 1.97 0.50 0.98 0.00 0.00 173.24 175.48 2aaz h LYS 107 N 1.19 0.50 -0.11 4.02 1.63 -1.93 -1.63 116.57 120.24 2aaz h LYS 107 Ca -0.51 -0.03 -0.01 0.00 -0.85 0.00 0.00 60.65 59.25 2aaz h LYS 107 Cb 1.31 -0.11 -0.00 0.00 -0.60 0.00 0.00 32.23 32.82 2aaz h LYS 107 CO 0.56 0.33 0.02 1.49 -3.45 0.00 0.00 179.45 178.40 2aaz h GLU 108 N 0.51 0.17 -0.27 1.90 4.81 -1.95 -2.21 114.58 117.54 2aaz h GLU 108 Ca 0.29 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.44 2aaz h GLU 108 Cb 0.46 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 2aaz h GLU 108 CO -0.09 0.35 0.01 0.35 -0.73 0.00 0.00 179.01 178.91 2aaz h PHE 109 N -0.04 0.51 -0.23 0.92 3.57 -1.69 -1.53 116.94 118.46 2aaz h PHE 109 Ca 0.03 -0.08 0.05 0.00 3.53 0.00 0.00 57.97 61.50 2aaz h PHE 109 Cb 0.26 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 38.82 2aaz h PHE 109 CO 0.01 0.61 -0.08 -0.07 -2.23 0.00 0.00 178.31 176.55 2aaz h LEU 110 N 0.27 -0.27 -1.65 0.59 3.38 -1.32 0.09 115.31 116.39 2aaz h LEU 110 Ca 0.08 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 2aaz h LEU 110 Cb 0.40 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 2aaz h LEU 110 CO 0.01 -0.10 -0.15 -0.33 0.09 0.00 0.00 178.44 177.96 2aaz h GLU 111 N -0.03 0.04 -0.36 1.13 5.08 -1.36 0.32 114.58 119.40 2aaz h GLU 111 Ca 0.11 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.40 2aaz h GLU 111 Cb 0.20 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 2aaz h GLU 111 CO -0.25 0.18 -0.07 -0.22 -1.00 0.00 0.00 179.01 177.65 2aaz h LYS 112 N 0.03 0.59 -0.59 2.33 3.64 0.04 -2.85 116.57 119.77 2aaz h LYS 112 Ca 0.01 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 2aaz h LYS 112 Cb 0.28 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2aaz h LYS 112 CO 0.02 0.67 0.00 1.33 -2.27 0.00 0.00 179.45 179.20 2aaz n VAL 113 N -4.21 2.67 -1.42 2.00 0.24 -0.44 -4.92 118.33 112.25 2aaz n VAL 113 Ca 0.01 -1.37 -0.02 0.00 -2.04 0.00 0.00 64.34 60.92 2aaz n VAL 113 Cb 0.31 -0.25 -0.00 0.00 -1.47 0.00 0.00 33.84 32.42 2aaz n VAL 113 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2aaz n GLY 114 N 0.66 0.43 2.21 7.63 0.00 -1.07 -4.96 105.19 110.09 2aaz n GLY 114 Ca 0.27 -0.94 -0.23 0.00 0.00 0.00 0.00 46.02 45.13 2aaz n GLY 114 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2aaz n LEU 115 N -0.22 4.59 0.06 0.99 4.77 0.11 -4.81 117.00 122.48 2aaz n LEU 115 Ca -0.02 -4.76 0.10 0.00 -0.03 0.00 0.00 56.01 51.31 2aaz n LEU 115 Cb 0.23 -0.31 0.42 0.00 -2.33 0.00 0.00 43.42 41.43 2aaz n LEU 115 CO 0.03 2.07 0.82 0.61 -1.33 0.00 0.00 177.39 179.58 2aaz n GLY 116 N -0.62 -1.23 0.01 -0.72 0.00 -1.24 -2.71 105.19 98.68 2aaz n GLY 116 Ca 0.40 -0.01 0.15 0.00 0.00 0.00 0.00 46.02 46.56 2aaz n GLY 116 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2aaz n HIS 117 N -1.83 0.00 -3.94 1.61 1.44 -1.26 -4.82 115.22 106.42 2aaz n HIS 117 Ca 0.04 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.42 2aaz n HIS 117 Cb 0.24 -0.15 -0.05 0.00 0.12 0.00 0.00 29.99 30.15 2aaz n HIS 117 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 2aaz s ARG 118 N -2.30 3.37 0.60 -1.40 0.52 -1.10 -5.09 118.95 113.55 2aaz s ARG 118 Ca 0.38 -0.38 -0.15 0.00 -0.52 0.00 0.00 55.73 55.06 2aaz s ARG 118 Cb 0.21 -3.04 -0.03 0.00 0.52 0.00 0.00 34.95 32.60 2aaz s ARG 118 CO 0.42 0.66 1.06 -0.98 0.02 0.00 0.00 175.30 176.47 2aaz s ARG 119 N -2.03 3.31 0.23 3.54 1.70 -1.26 -4.94 118.95 119.50 2aaz s ARG 119 Ca 0.28 1.18 -0.32 0.00 -0.47 0.00 0.00 55.73 56.40 2aaz s ARG 119 Cb -0.13 -2.03 -0.13 0.00 -0.57 0.00 0.00 34.95 32.09 2aaz s ARG 119 CO 0.20 -0.82 1.49 -1.91 -1.08 0.00 0.00 175.30 173.18 2aaz n GLU 120 N -2.09 2.22 0.00 3.89 2.13 -1.26 -1.97 120.64 123.55 2aaz n GLU 120 Ca 0.09 0.79 0.00 0.00 0.66 0.00 0.00 57.16 58.70 2aaz n GLU 120 Cb 0.53 -2.50 0.00 0.00 0.27 0.00 0.00 31.44 29.74 2aaz n GLU 120 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2aaz n GLY 121 N 2.50 2.82 3.52 8.31 0.00 0.21 -4.86 105.19 117.69 2aaz n GLY 121 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2aaz n GLY 121 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2aaz s ASP 122 N -1.21 6.47 0.45 1.61 -1.08 -0.83 -0.71 116.67 121.37 2aaz s ASP 122 Ca 0.00 -1.46 0.30 0.00 -0.52 0.00 0.00 52.55 50.87 2aaz s ASP 122 Cb 0.00 -2.51 1.17 0.00 -1.46 0.00 0.00 42.92 40.11 2aaz s ASP 122 CO 0.00 -1.43 1.88 -0.07 0.52 0.00 0.00 175.17 176.07 2aaz h LEU 123 N 12.11 0.00 0.00 -1.34 3.38 -1.84 -3.46 115.31 124.15 2aaz h LEU 123 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2aaz h LEU 123 Cb 1.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 2aaz h LEU 123 CO 1.31 0.00 0.00 0.61 0.09 0.00 0.00 178.44 180.45 2aaz n GLY 124 N 0.16 -1.80 2.59 0.83 0.00 -1.26 -1.22 105.19 104.48 2aaz n GLY 124 Ca 0.01 -2.03 -0.36 0.00 0.00 0.00 0.00 46.02 43.64 2aaz n GLY 124 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2aaz n PRO 125 N 0.00 2.82 -1.59 1.61 -0.04 -1.26 -4.77 135.00 131.76 2aaz n PRO 125 Ca 0.00 -2.08 -0.14 0.00 -0.04 0.00 0.00 63.50 61.24 2aaz n PRO 125 Cb 0.00 -2.86 0.08 0.00 -0.04 0.00 0.00 33.50 30.69 2aaz n PRO 125 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2aaz n VAL 126 N 4.43 0.00 0.00 0.52 0.24 -1.26 -4.52 118.33 117.75 2aaz n VAL 126 Ca 0.60 -0.83 0.00 0.00 -2.04 0.00 0.00 64.34 62.07 2aaz n VAL 126 Cb 0.27 -1.26 0.00 0.00 -1.47 0.00 0.00 33.84 31.38 2aaz n VAL 126 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2aaz n TYR 127 N -2.46 0.00 -0.30 6.34 4.01 -1.26 -0.34 117.16 123.15 2aaz n TYR 127 Ca 0.10 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.98 2aaz n TYR 127 Cb 0.34 0.00 0.30 0.00 -0.31 0.00 0.00 39.34 39.68 2aaz n TYR 127 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2aaz h GLY 128 N 0.00 1.39 0.93 2.72 0.00 -1.80 -0.41 103.07 105.89 2aaz h GLY 128 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 47.33 47.29 2aaz h GLY 128 CO 0.00 -0.40 0.13 -2.75 0.00 0.00 0.00 176.54 173.52 2aaz h PHE 129 N 0.18 0.53 -0.67 5.60 3.04 -0.67 -2.22 116.94 122.73 2aaz h PHE 129 Ca 0.57 -0.04 -0.07 0.00 3.98 0.00 0.00 57.97 62.41 2aaz h PHE 129 Cb 1.17 -0.16 -0.03 0.00 2.56 0.00 0.00 35.95 39.50 2aaz h PHE 129 CO -0.28 0.50 0.15 1.96 -2.02 0.00 0.00 178.31 178.62 2aaz h GLN 130 N 0.41 1.09 -0.62 1.11 1.08 -1.06 0.67 115.11 117.79 2aaz h GLN 130 Ca 0.11 -0.27 0.04 0.00 -1.45 0.00 0.00 58.65 57.08 2aaz h GLN 130 Cb 0.20 -0.14 -0.04 0.00 -0.05 0.00 0.00 27.48 27.45 2aaz h GLN 130 CO -0.01 0.98 0.36 -1.49 -0.95 0.00 0.00 178.83 177.73 2aaz h TRP 131 N 1.01 0.68 0.00 2.96 4.06 -0.92 -2.24 115.95 121.50 2aaz h TRP 131 Ca 0.21 0.02 0.00 0.00 2.06 0.00 0.00 58.89 61.18 2aaz h TRP 131 Cb 0.39 -0.22 0.00 0.00 -1.00 0.00 0.00 29.16 28.34 2aaz h TRP 131 CO 0.03 0.37 -1.21 0.54 -3.56 0.00 0.00 178.44 174.61 2aaz n ARG 132 N -4.76 1.25 -2.20 0.49 5.12 -0.85 -1.33 116.66 114.38 2aaz n ARG 132 Ca 0.06 -0.07 0.01 0.00 -1.93 0.00 0.00 57.85 55.92 2aaz n ARG 132 Cb 0.11 -1.29 0.04 0.00 -1.16 0.00 0.00 32.46 30.16 2aaz n ARG 132 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 2aaz n HIS 133 N -1.69 0.76 -1.65 -1.55 8.25 0.23 -3.41 115.22 116.16 2aaz n HIS 133 Ca 0.00 -1.45 -0.48 0.00 -0.26 0.00 0.00 57.72 55.53 2aaz n HIS 133 Cb 0.32 -0.20 -0.05 0.00 1.12 0.00 0.00 29.99 31.18 2aaz n HIS 133 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2aaz n PHE 134 N -0.16 2.05 0.00 4.41 -0.00 -0.84 -1.46 117.46 121.46 2aaz n PHE 134 Ca 0.08 0.36 0.00 0.00 -0.00 0.00 0.00 57.45 57.89 2aaz n PHE 134 Cb 0.95 -2.49 0.00 0.00 -0.00 0.00 0.00 39.48 37.94 2aaz n PHE 134 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2aaz n GLY 135 N 3.29 3.31 3.75 7.13 0.00 -1.26 -0.53 105.19 120.88 2aaz n GLY 135 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 2aaz n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aaz s ALA 136 N -2.71 2.30 -0.06 4.61 0.00 -0.54 -4.91 121.76 120.45 2aaz s ALA 136 Ca 0.00 0.71 -0.30 0.00 0.00 0.00 0.00 51.96 52.37 2aaz s ALA 136 Cb 0.00 -3.39 -0.02 0.00 0.00 0.00 0.00 23.12 19.71 2aaz s ALA 136 CO 0.00 -1.56 1.02 -2.00 0.00 0.00 0.00 175.76 173.23 2aaz s GLU 137 N -3.99 4.46 -0.15 0.00 2.12 -1.26 -5.02 118.70 114.86 2aaz s GLU 137 Ca 0.70 1.44 -0.13 0.00 0.36 0.00 0.00 54.97 57.34 2aaz s GLU 137 Cb -0.25 -3.51 -0.05 0.00 0.26 0.00 0.00 34.13 30.59 2aaz s GLU 137 CO 0.43 -0.24 0.28 -0.47 -0.54 0.00 0.00 175.26 174.71 2aaz s TYR 138 N 1.69 3.49 0.00 5.30 5.04 -1.26 -4.98 117.35 126.63 2aaz s TYR 138 Ca 0.51 0.60 0.00 0.00 -2.44 0.00 0.00 57.07 55.74 2aaz s TYR 138 Cb -0.20 -2.29 0.00 0.00 0.35 0.00 0.00 41.96 39.82 2aaz s TYR 138 CO 0.22 0.32 0.00 0.25 -1.34 0.00 0.00 175.55 175.00 2aaz n THR 139 N 3.27 0.00 -3.98 4.34 -2.24 -1.26 -5.08 114.28 109.32 2aaz n THR 139 Ca -0.13 0.19 -0.11 0.00 -2.27 0.00 0.00 64.05 61.73 2aaz n THR 139 Cb 0.52 -1.12 -0.03 0.00 -2.10 0.00 0.00 70.33 67.60 2aaz n THR 139 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2aaz n ASP 140 N -2.12 -0.78 0.06 3.42 3.85 -1.26 -5.03 116.55 114.69 2aaz n ASP 140 Ca 0.00 -2.32 0.10 0.00 -0.71 0.00 0.00 54.79 51.87 2aaz n ASP 140 Cb 0.00 1.53 0.42 0.00 -1.35 0.00 0.00 41.12 41.72 2aaz n ASP 140 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2aaz n ALA 141 N -1.47 1.80 1.16 2.12 0.00 -1.26 -2.53 120.51 120.33 2aaz n ALA 141 Ca -0.09 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.48 2aaz n ALA 141 Cb 0.39 -1.35 0.23 0.00 0.00 0.00 0.00 19.45 18.72 2aaz n ALA 141 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2aaz n ASP 142 N -1.87 1.55 -4.64 0.00 10.43 -1.26 -4.83 116.55 115.93 2aaz n ASP 142 Ca 0.04 -1.24 -0.36 0.00 2.57 0.00 0.00 54.79 55.80 2aaz n ASP 142 Cb 0.24 0.25 0.09 0.00 1.84 0.00 0.00 41.12 43.54 2aaz n ASP 142 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2aaz n GLY 143 N 1.36 -0.26 3.45 0.44 0.00 -1.05 -4.94 105.19 104.18 2aaz n GLY 143 Ca 0.12 -0.34 -0.44 0.00 0.00 0.00 0.00 46.02 45.36 2aaz n GLY 143 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2aaz s ASP 144 N -1.67 6.23 0.00 1.61 2.15 -1.26 -4.87 116.67 118.85 2aaz s ASP 144 Ca 0.74 -0.90 0.12 0.00 0.43 0.00 0.00 52.55 52.94 2aaz s ASP 144 Cb -0.34 -2.30 0.10 0.00 -0.30 0.00 0.00 42.92 40.08 2aaz s ASP 144 CO 0.49 -0.94 0.89 -1.22 -0.17 0.00 0.00 175.17 174.22 2aaz n TYR 145 N 6.31 0.02 -1.66 -5.34 4.01 -1.26 -4.96 117.16 114.28 2aaz n TYR 145 Ca -0.06 -0.02 -0.50 0.00 -0.16 0.00 0.00 57.90 57.15 2aaz n TYR 145 Cb 0.45 -0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.43 2aaz n TYR 145 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 2aaz n LYS 146 N 0.66 1.74 -0.98 -0.72 4.81 -1.26 -0.30 118.16 122.11 2aaz n LYS 146 Ca 0.07 0.63 0.00 0.00 -0.87 0.00 0.00 58.31 58.14 2aaz n LYS 146 Cb 0.30 -2.38 0.00 0.00 0.02 0.00 0.00 35.03 32.97 2aaz n LYS 146 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2aaz n GLY 147 N 3.69 0.53 3.57 3.14 0.00 -1.26 -5.02 105.19 109.83 2aaz n GLY 147 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 2aaz n GLY 147 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2aaz s LYS 148 N -0.28 2.59 0.10 1.61 1.02 0.59 -5.03 119.74 120.35 2aaz s LYS 148 Ca 0.00 -0.67 0.00 0.00 0.02 0.00 0.00 55.97 55.32 2aaz s LYS 148 Cb 0.00 -2.50 0.00 0.00 -0.52 0.00 0.00 37.83 34.81 2aaz s LYS 148 CO 0.00 0.62 0.00 0.41 -0.92 0.00 0.00 175.35 175.46 2aaz n GLY 149 N 1.89 -2.23 3.65 -3.33 0.00 -1.26 -4.41 105.19 99.50 2aaz n GLY 149 Ca -0.17 -1.51 -0.39 0.00 0.00 0.00 0.00 46.02 43.95 2aaz n GLY 149 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2aaz s VAL 150 N -0.98 5.10 -1.05 1.61 1.01 0.31 -4.75 120.40 121.66 2aaz s VAL 150 Ca 0.00 0.93 -0.17 0.00 0.00 0.00 0.00 61.98 62.74 2aaz s VAL 150 Cb 0.00 -3.83 0.14 0.00 0.00 0.00 0.00 36.38 32.69 2aaz s VAL 150 CO 0.00 0.16 1.27 -0.62 0.00 0.00 0.00 175.10 175.90 2aaz s ASP 151 N 1.23 6.80 0.19 3.32 3.68 -1.22 -2.23 116.67 128.45 2aaz s ASP 151 Ca 0.23 -2.40 -0.12 0.00 2.13 0.00 0.00 52.55 52.39 2aaz s ASP 151 Cb -0.15 -2.41 0.11 0.00 -1.45 0.00 0.00 42.92 39.02 2aaz s ASP 151 CO 0.09 -0.95 1.83 1.56 0.13 0.00 0.00 175.17 177.83 2aaz h GLN 152 N 8.19 0.89 -0.13 4.34 4.20 -1.47 -2.70 115.11 128.43 2aaz h GLN 152 Ca 0.23 -0.08 0.02 0.00 0.06 0.00 0.00 58.65 58.88 2aaz h GLN 152 Cb 0.96 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 28.53 2aaz h GLN 152 CO 1.17 0.64 -0.02 1.25 -0.67 0.00 0.00 178.83 181.21 2aaz h LEU 153 N 0.90 -0.08 -1.01 1.46 5.85 -1.85 -0.20 115.31 120.37 2aaz h LEU 153 Ca 0.24 0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.91 2aaz h LEU 153 Cb -0.03 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 2aaz h LEU 153 CO -0.04 -0.02 -0.17 -0.61 -0.34 0.00 0.00 178.44 177.25 2aaz h GLN 154 N 0.02 0.51 -0.55 1.25 5.75 -1.87 -2.18 115.11 118.05 2aaz h GLN 154 Ca 0.06 -0.17 -0.06 0.00 -0.15 0.00 0.00 58.65 58.33 2aaz h GLN 154 Cb 0.08 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.57 2aaz h GLN 154 CO -0.12 0.67 0.09 -0.09 -2.65 0.00 0.00 178.83 176.73 2aaz h ARG 155 N 0.46 0.87 -0.64 1.69 9.65 -1.11 0.01 114.38 125.31 2aaz h ARG 155 Ca 0.08 -0.20 -0.02 0.00 -1.10 0.00 0.00 59.98 58.74 2aaz h ARG 155 Cb 0.57 -0.12 -0.03 0.00 -1.39 0.00 0.00 29.97 29.00 2aaz h ARG 155 CO 0.04 0.81 0.33 0.28 2.80 0.00 0.00 179.97 184.23 2aaz h VAL 156 N 0.82 1.21 0.28 0.20 2.07 -0.51 0.05 116.25 120.37 2aaz h VAL 156 Ca 0.17 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 2aaz h VAL 156 Cb 0.37 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2aaz h VAL 156 CO 0.01 0.24 -0.13 0.40 0.02 0.00 0.00 177.57 178.10 2aaz h ILE 157 N 0.88 0.75 -0.88 4.57 1.08 -0.80 -1.76 117.51 121.36 2aaz h ILE 157 Ca 0.22 -0.23 0.06 0.00 -0.39 0.00 0.00 64.86 64.52 2aaz h ILE 157 Cb 0.08 0.88 -0.06 0.00 -3.07 0.00 0.00 36.82 34.65 2aaz h ILE 157 CO -0.03 0.05 0.55 0.44 -0.69 0.00 0.00 178.15 178.47 2aaz h ASP 158 N -0.50 0.87 -0.47 1.72 3.45 -0.86 -2.43 116.42 118.20 2aaz h ASP 158 Ca -0.04 0.01 -0.11 0.00 0.43 0.00 0.00 57.03 57.33 2aaz h ASP 158 Cb 0.37 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 38.96 2aaz h ASP 158 CO 0.06 0.56 -0.12 0.74 -1.57 0.00 0.00 179.24 178.91 2aaz h THR 159 N 1.01 1.27 -0.47 0.35 2.02 -0.89 -0.60 112.91 115.60 2aaz h THR 159 Ca 0.38 -1.25 -0.03 0.00 0.77 0.00 0.00 66.41 66.27 2aaz h THR 159 Cb 0.15 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 2aaz h THR 159 CO -0.17 0.43 0.15 0.40 0.37 0.00 0.00 175.52 176.71 2aaz h ILE 160 N 0.75 1.19 0.25 3.11 2.04 -1.02 0.31 117.51 124.13 2aaz h ILE 160 Ca 0.12 -0.64 -0.33 0.00 1.00 0.00 0.00 64.86 65.00 2aaz h ILE 160 Cb 0.67 0.67 0.04 0.00 -0.74 0.00 0.00 36.82 37.46 2aaz h ILE 160 CO 0.05 0.24 -1.47 0.11 0.00 0.00 0.00 178.15 177.08 2aaz h LYS 161 N 0.68 0.53 0.00 2.37 1.57 -1.28 -3.33 116.57 117.11 2aaz h LYS 161 Ca 0.16 -0.90 0.00 0.00 -1.87 0.00 0.00 60.65 58.04 2aaz h LYS 161 Cb 0.20 0.34 0.00 0.00 0.08 0.00 0.00 32.23 32.84 2aaz h LYS 161 CO -0.01 1.43 -1.39 0.09 -0.57 0.00 0.00 179.45 179.00 2aaz n ASN 162 N -3.70 1.08 -2.85 0.86 3.02 -0.25 -4.78 115.26 108.65 2aaz n ASN 162 Ca -0.16 -0.31 -0.11 0.00 -0.03 0.00 0.00 54.58 53.96 2aaz n ASN 162 Cb 1.10 1.48 0.05 0.00 -0.61 0.00 0.00 39.78 41.80 2aaz n ASN 162 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2aaz n ASN 163 N -1.82 -1.80 -0.12 6.41 5.15 0.10 -5.02 115.26 118.17 2aaz n ASN 163 Ca -0.01 -3.40 0.22 0.00 -0.60 0.00 0.00 54.58 50.79 2aaz n ASN 163 Cb 0.36 1.29 0.64 0.00 -0.53 0.00 0.00 39.78 41.55 2aaz n ASN 163 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2aaz h PRO 164 N 3.37 0.12 -0.02 1.20 0.13 -1.51 -1.27 132.00 134.03 2aaz h PRO 164 Ca -0.07 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2aaz h PRO 164 Cb 1.04 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.14 2aaz h PRO 164 CO 0.27 0.08 0.00 0.25 -0.23 0.00 0.00 178.00 178.37 2aaz n THR 165 N -4.38 0.02 -1.76 1.56 -2.24 -1.26 -4.23 114.28 101.99 2aaz n THR 165 Ca 0.14 -0.03 -0.38 0.00 -2.27 0.00 0.00 64.05 61.51 2aaz n THR 165 Cb 0.71 -0.24 0.05 0.00 -2.10 0.00 0.00 70.33 68.75 2aaz n THR 165 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2aaz s ASP 166 N -1.61 5.17 -0.14 3.42 -1.08 -0.48 -4.92 116.67 117.03 2aaz s ASP 166 Ca 0.30 2.77 0.15 0.00 -0.52 0.00 0.00 52.55 55.25 2aaz s ASP 166 Cb 0.14 -2.64 0.53 0.00 -1.46 0.00 0.00 42.92 39.50 2aaz s ASP 166 CO 0.23 -1.64 1.44 0.54 0.52 0.00 0.00 175.17 176.26 2aaz n ARG 167 N -1.13 3.21 -0.36 4.34 1.74 -1.26 -4.48 116.66 118.73 2aaz n ARG 167 Ca 0.11 -2.71 0.08 0.00 -0.77 0.00 0.00 57.85 54.56 2aaz n ARG 167 Cb 0.45 -1.77 0.16 0.00 -1.02 0.00 0.00 32.46 30.29 2aaz n ARG 167 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2aaz n ARG 168 N 0.00 1.35 -2.05 5.56 3.00 -1.26 -4.94 116.66 118.33 2aaz n ARG 168 Ca 0.20 -2.85 -0.38 0.00 -0.01 0.00 0.00 57.85 54.81 2aaz n ARG 168 Cb 0.82 -1.49 -0.03 0.00 0.00 0.00 0.00 32.46 31.76 2aaz n ARG 168 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 2aaz n ILE 169 N -1.21 2.81 -4.66 0.55 5.41 -1.26 -4.90 119.36 116.09 2aaz n ILE 169 Ca 0.17 -2.79 -0.31 0.00 1.00 0.00 0.00 62.75 60.81 2aaz n ILE 169 Cb 0.68 -2.32 -0.12 0.00 -0.71 0.00 0.00 39.64 37.17 2aaz n ILE 169 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2aaz s ILE 170 N 6.66 3.05 -0.24 1.39 -1.09 -1.26 -1.74 121.20 127.97 2aaz s ILE 170 Ca 0.59 -0.99 -0.00 0.00 -2.23 0.00 0.00 60.65 58.02 2aaz s ILE 170 Cb 0.05 -2.28 0.07 0.00 -1.58 0.00 0.00 42.46 38.73 2aaz s ILE 170 CO 0.08 0.40 0.01 -0.22 -1.23 0.00 0.00 174.94 173.99 2aaz s LEU 171 N -1.28 2.22 0.03 2.97 2.96 -0.68 -4.87 118.68 120.03 2aaz s LEU 171 Ca 0.15 -1.21 0.05 0.00 -0.22 0.00 0.00 54.13 52.90 2aaz s LEU 171 Cb -0.11 -0.97 -0.02 0.00 0.50 0.00 0.00 46.19 45.59 2aaz s LEU 171 CO 0.05 -0.30 -0.16 -0.55 -1.32 0.00 0.00 176.35 174.07 2aaz s SER 172 N 1.55 1.84 0.00 3.68 0.15 -1.26 -1.15 113.70 118.51 2aaz s SER 172 Ca -0.01 -0.45 0.10 0.00 0.70 0.00 0.00 55.95 56.30 2aaz s SER 172 Cb -0.18 -0.14 -0.02 0.00 -1.71 0.00 0.00 66.02 63.98 2aaz s SER 172 CO -0.10 0.08 0.59 0.00 1.20 0.00 0.00 173.24 175.01 2aaz n ALA 173 N 1.99 2.87 -2.30 5.45 0.00 -0.63 -4.36 120.51 123.52 2aaz n ALA 173 Ca -0.17 -0.41 -0.43 0.00 0.00 0.00 0.00 53.44 52.43 2aaz n ALA 173 Cb 0.54 -0.34 -0.02 0.00 0.00 0.00 0.00 19.45 19.63 2aaz n ALA 173 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 2aaz s TRP 174 N -1.40 2.69 -0.31 0.00 -0.11 -1.18 -4.79 118.94 113.85 2aaz s TRP 174 Ca 0.08 0.82 -0.02 0.00 1.22 0.00 0.00 56.10 58.19 2aaz s TRP 174 Cb 0.08 -3.61 0.12 0.00 -1.50 0.00 0.00 33.47 28.55 2aaz s TRP 174 CO 0.26 -2.26 0.18 1.21 -4.62 0.00 0.00 176.95 171.72 2aaz s ASN 175 N 2.20 3.07 0.48 5.86 3.84 -1.26 -5.02 114.94 124.11 2aaz s ASN 175 Ca 0.61 -1.43 0.24 0.00 0.21 0.00 0.00 52.86 52.49 2aaz s ASN 175 Cb -0.26 -0.21 1.28 0.00 -0.55 0.00 0.00 41.25 41.51 2aaz s ASN 175 CO 0.21 -0.40 1.88 -0.65 -2.79 0.00 0.00 177.10 175.35 2aaz h PRO 176 N 8.03 0.20 -0.10 0.43 0.11 -2.01 -1.45 132.00 137.21 2aaz h PRO 176 Ca -0.12 -0.01 -0.23 0.00 0.11 0.00 0.00 66.00 65.74 2aaz h PRO 176 Cb 1.01 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 32.09 2aaz h PRO 176 CO 0.38 0.13 -0.86 -0.22 -0.21 0.00 0.00 178.00 177.22 2aaz h LYS 177 N 0.20 0.72 0.00 1.05 3.64 -2.02 -3.30 116.57 116.86 2aaz h LYS 177 Ca 0.44 -0.64 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 2aaz h LYS 177 Cb 1.41 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 33.38 2aaz h LYS 177 CO -0.10 1.25 -0.35 -0.25 -2.27 0.00 0.00 179.45 177.73 2aaz n ASP 178 N -3.89 0.43 -0.28 4.20 8.00 -0.69 -4.45 116.55 119.86 2aaz n ASP 178 Ca -0.08 0.11 -0.05 0.00 0.71 0.00 0.00 54.79 55.48 2aaz n ASP 178 Cb 0.79 -0.07 -0.00 0.00 -0.02 0.00 0.00 41.12 41.82 2aaz n ASP 178 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2aaz h LEU 179 N 0.00 -1.42 -2.39 0.64 3.38 -1.38 0.11 115.31 114.25 2aaz h LEU 179 Ca 0.00 0.27 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2aaz h LEU 179 Cb 0.57 0.69 0.00 0.00 0.09 0.00 0.00 40.66 42.02 2aaz h LEU 179 CO 0.00 -0.30 0.12 1.55 0.09 0.00 0.00 178.44 179.89 2aaz h PRO 180 N -0.11 0.00 -0.00 1.13 0.13 -1.83 0.16 132.00 131.47 2aaz h PRO 180 Ca 0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.38 2aaz h PRO 180 Cb 0.56 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.69 2aaz h PRO 180 CO -0.81 0.00 -0.39 1.28 -0.23 0.00 0.00 178.00 177.85 2aaz n LEU 181 N -2.86 0.47 -4.76 1.56 4.77 0.35 -4.86 117.00 111.67 2aaz n LEU 181 Ca -0.02 0.05 -0.39 0.00 -0.03 0.00 0.00 56.01 55.63 2aaz n LEU 181 Cb 0.17 -0.27 -0.06 0.00 -2.33 0.00 0.00 43.42 40.93 2aaz n LEU 181 CO 0.16 0.11 0.25 -0.04 -1.33 0.00 0.00 177.39 176.54 2aaz s MET 182 N -2.94 4.28 0.53 3.23 -1.94 0.56 -4.30 119.30 118.72 2aaz s MET 182 Ca 0.13 0.64 0.21 0.00 -1.71 0.00 0.00 55.69 54.96 2aaz s MET 182 Cb 0.18 -3.35 1.40 0.00 2.01 0.00 0.00 34.83 35.07 2aaz s MET 182 CO 0.65 0.35 2.15 0.00 -0.01 0.00 0.00 175.02 178.16 2aaz h ALA 183 N 5.80 1.76 -2.23 3.03 0.00 -1.45 -3.42 119.26 122.74 2aaz h ALA 183 Ca -0.45 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 2aaz h ALA 183 Cb 1.20 -0.01 -0.23 0.00 0.00 0.00 0.00 17.79 18.75 2aaz h ALA 183 CO 0.70 0.05 -0.08 -1.17 0.00 0.00 0.00 179.25 178.75 2aaz s LEU 184 N -8.46 -0.60 0.56 0.00 2.96 -1.26 -5.05 118.68 106.83 2aaz s LEU 184 Ca -0.05 1.29 -0.20 0.00 -0.22 0.00 0.00 54.13 54.95 2aaz s LEU 184 Cb 0.16 2.03 -0.04 0.00 0.50 0.00 0.00 46.19 48.84 2aaz s LEU 184 CO 0.63 -0.22 1.23 -2.84 -1.32 0.00 0.00 176.35 173.83 2aaz s PRO 185 N 1.37 3.14 0.16 0.98 0.02 -1.26 -4.92 135.00 134.48 2aaz s PRO 185 Ca -0.08 1.89 -0.34 0.00 0.02 0.00 0.00 61.00 62.49 2aaz s PRO 185 Cb -0.06 -2.07 -0.13 0.00 0.02 0.00 0.00 34.50 32.26 2aaz s PRO 185 CO -0.15 -1.09 1.62 -2.30 -0.33 0.00 0.00 177.00 174.76 2aaz n PRO 186 N -1.30 2.27 -0.06 5.54 -0.02 -1.26 -4.93 135.00 135.24 2aaz n PRO 186 Ca 0.12 0.82 -0.03 0.00 -2.02 0.00 0.00 63.50 62.39 2aaz n PRO 186 Cb 0.49 -2.61 -0.01 0.00 -0.02 0.00 0.00 33.50 31.34 2aaz n PRO 186 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2aaz s HIS 188 N -1.83 2.74 -0.69 0.00 0.00 -1.26 -1.80 115.29 112.45 2aaz s HIS 188 Ca -0.06 -0.96 0.24 0.00 -3.00 0.00 0.00 55.06 51.28 2aaz s HIS 188 Cb 0.01 -4.50 0.91 0.00 -4.00 0.00 0.00 32.58 24.99 2aaz s HIS 188 CO 0.12 -1.76 1.74 0.00 -1.00 0.00 0.00 174.74 173.84 2aaz n MET 189 N 7.95 0.18 0.00 -0.38 0.00 -1.13 -4.74 117.12 119.01 2aaz n MET 189 Ca 0.24 0.27 0.00 0.00 0.00 0.00 0.00 57.70 58.21 2aaz n MET 189 Cb 0.50 -1.77 0.00 0.00 0.00 0.00 0.00 33.22 31.95 2aaz n MET 189 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 175.97 177.94 2aaz n PHE 190 N -2.10 0.00 -3.76 3.17 1.16 -1.25 -1.61 117.46 113.06 2aaz n PHE 190 Ca 0.04 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.51 2aaz n PHE 190 Cb 0.32 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.12 2aaz n PHE 190 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2aaz s GLN 192 N -2.81 1.97 0.03 0.00 0.74 0.70 -1.68 119.66 118.61 2aaz s GLN 192 Ca -0.03 -0.58 -0.01 0.00 0.05 0.00 0.00 55.36 54.78 2aaz s GLN 192 Cb 0.00 -1.63 -0.04 0.00 1.10 0.00 0.00 33.01 32.44 2aaz s GLN 192 CO -0.05 0.15 0.19 -0.06 -0.55 0.00 0.00 175.29 174.98 2aaz s PHE 193 N 0.32 3.52 -0.02 1.67 0.40 -0.71 -1.30 117.98 121.86 2aaz s PHE 193 Ca -0.10 0.29 0.02 0.00 -0.60 0.00 0.00 56.93 56.53 2aaz s PHE 193 Cb -0.14 -1.78 0.00 0.00 0.51 0.00 0.00 43.02 41.61 2aaz s PHE 193 CO 0.04 0.61 -0.05 0.12 0.70 0.00 0.00 175.22 176.64 2aaz s PHE 194 N -1.43 0.55 -0.18 0.36 2.19 -0.70 -4.64 117.98 114.13 2aaz s PHE 194 Ca 0.32 -0.11 0.00 0.00 0.33 0.00 0.00 56.93 57.46 2aaz s PHE 194 Cb -0.13 -0.41 0.01 0.00 -1.31 0.00 0.00 43.02 41.18 2aaz s PHE 194 CO 0.24 -0.06 -0.17 0.08 1.83 0.00 0.00 175.22 177.14 2aaz s VAL 195 N 0.20 2.37 -0.15 3.12 1.01 -1.26 -0.92 120.40 124.78 2aaz s VAL 195 Ca -0.02 -0.84 -0.20 0.00 0.00 0.00 0.00 61.98 60.92 2aaz s VAL 195 Cb -0.06 -2.01 -0.03 0.00 0.00 0.00 0.00 36.38 34.27 2aaz s VAL 195 CO -0.00 0.52 0.57 -0.44 0.00 0.00 0.00 175.10 175.74 2aaz s SER 196 N 1.26 6.71 0.59 3.32 0.01 0.24 -4.75 113.70 121.08 2aaz s SER 196 Ca 0.04 0.85 -0.17 0.00 1.31 0.00 0.00 55.95 57.98 2aaz s SER 196 Cb -0.14 -2.33 -0.03 0.00 0.21 0.00 0.00 66.02 63.73 2aaz s SER 196 CO -0.09 -0.14 1.10 -0.76 0.41 0.00 0.00 173.24 173.76 2aaz s LEU 197 N 1.24 3.57 0.24 2.44 1.43 -1.26 -1.74 118.68 124.59 2aaz s LEU 197 Ca 0.28 2.02 -0.31 0.00 -1.03 0.00 0.00 54.13 55.08 2aaz s LEU 197 Cb -0.16 -4.56 -0.12 0.00 0.03 0.00 0.00 46.19 41.38 2aaz s LEU 197 CO 0.11 -1.33 1.59 -2.65 0.23 0.00 0.00 176.35 174.30 2aaz n PRO 198 N -1.85 2.50 0.23 1.29 -0.02 -1.26 -4.85 135.00 131.04 2aaz n PRO 198 Ca 0.10 0.90 0.13 0.00 -2.02 0.00 0.00 63.50 62.61 2aaz n PRO 198 Cb 0.52 -2.67 0.76 0.00 -0.02 0.00 0.00 33.50 32.09 2aaz n PRO 198 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2aaz h PRO 199 N 5.37 0.00 0.00 0.52 0.11 -1.93 -3.50 132.00 132.57 2aaz h PRO 199 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2aaz h PRO 199 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2aaz h PRO 199 CO 0.84 0.00 0.00 -0.35 -0.21 0.00 0.00 178.00 178.28 2aaz n PRO 203 N -4.17 0.00 0.09 1.05 -0.04 -1.26 -4.98 135.00 125.68 2aaz n PRO 203 Ca -0.00 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.57 2aaz n PRO 203 Cb 0.20 -0.45 0.09 0.00 -0.04 0.00 0.00 33.50 33.29 2aaz n PRO 203 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 2aaz h GLY 204 N 0.00 0.00 -1.29 0.55 0.00 -2.04 -3.47 103.07 96.81 2aaz h GLY 204 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 2aaz h GLY 204 CO 0.00 0.00 0.26 -0.56 0.00 0.00 0.00 176.54 176.24 2aaz s SER 205 N -4.89 3.49 0.23 0.19 0.01 -1.26 -4.99 113.70 106.48 2aaz s SER 205 Ca 0.03 2.06 -0.25 0.00 1.31 0.00 0.00 55.95 59.10 2aaz s SER 205 Cb 0.11 -2.55 -0.09 0.00 0.21 0.00 0.00 66.02 63.70 2aaz s SER 205 CO 0.75 -2.72 0.84 -0.54 0.41 0.00 0.00 173.24 171.98 2aaz s LYS 206 N -4.74 4.57 0.60 12.44 1.02 -1.26 -4.75 119.74 127.62 2aaz s LYS 206 Ca 0.65 1.21 -0.19 0.00 0.02 0.00 0.00 55.97 57.65 2aaz s LYS 206 Cb -0.21 -3.08 -0.03 0.00 -0.52 0.00 0.00 37.83 34.00 2aaz s LYS 206 CO 0.57 0.45 1.27 -2.14 -0.92 0.00 0.00 175.35 174.59 2aaz s PRO 207 N -1.54 2.89 -0.09 -1.68 0.02 -1.26 -4.58 135.00 128.76 2aaz s PRO 207 Ca 0.42 2.00 -0.16 0.00 0.02 0.00 0.00 61.00 63.27 2aaz s PRO 207 Cb -0.21 -1.99 -0.05 0.00 0.02 0.00 0.00 34.50 32.27 2aaz s PRO 207 CO 0.26 -1.32 0.41 0.15 -0.33 0.00 0.00 177.00 176.17 2aaz s LYS 208 N -3.23 4.19 -0.17 5.54 1.02 -0.71 -0.36 119.74 126.02 2aaz s LYS 208 Ca 0.78 0.36 -0.05 0.00 0.02 0.00 0.00 55.97 57.07 2aaz s LYS 208 Cb -0.35 -3.36 -0.03 0.00 -0.52 0.00 0.00 37.83 33.56 2aaz s LYS 208 CO 0.39 0.35 0.01 -1.17 -0.92 0.00 0.00 175.35 174.00 2aaz s LEU 209 N 0.04 3.47 0.25 3.17 2.96 0.42 -0.59 118.68 128.40 2aaz s LEU 209 Ca 0.23 -0.06 0.10 0.00 -0.22 0.00 0.00 54.13 54.18 2aaz s LEU 209 Cb -0.15 -1.86 -0.05 0.00 0.50 0.00 0.00 46.19 44.63 2aaz s LEU 209 CO 0.10 0.15 -0.16 -0.44 -1.32 0.00 0.00 176.35 174.68 2aaz s SER 210 N 0.48 3.12 -0.07 3.68 0.01 -0.09 0.25 113.70 121.08 2aaz s SER 210 Ca -0.01 -1.05 -0.03 0.00 1.31 0.00 0.00 55.95 56.17 2aaz s SER 210 Cb -0.14 -0.23 0.04 0.00 0.21 0.00 0.00 66.02 65.91 2aaz s SER 210 CO 0.02 -0.10 0.16 0.00 0.41 0.00 0.00 173.24 173.74 2aaz s LEU 212 N 1.18 2.32 -0.03 0.00 0.20 -0.42 0.40 118.68 122.33 2aaz s LEU 212 Ca -0.09 -0.54 0.07 0.00 0.69 0.00 0.00 54.13 54.26 2aaz s LEU 212 Cb -0.11 -1.52 -0.02 0.00 -0.43 0.00 0.00 46.19 44.11 2aaz s LEU 212 CO -0.06 0.06 -0.25 -0.32 -0.29 0.00 0.00 176.35 175.49 2aaz s MET 213 N 0.95 2.23 -0.15 1.98 -2.45 0.08 -0.21 119.30 121.72 2aaz s MET 213 Ca -0.03 -0.90 -0.03 0.00 -1.25 0.00 0.00 55.69 53.48 2aaz s MET 213 Cb -0.15 -2.10 -0.02 0.00 1.25 0.00 0.00 34.83 33.81 2aaz s MET 213 CO -0.03 0.53 -0.07 -0.47 1.05 0.00 0.00 175.02 176.03 2aaz s TYR 214 N -0.54 2.95 -0.22 4.11 5.04 -0.71 -1.11 117.35 126.86 2aaz s TYR 214 Ca 0.08 -0.45 0.00 0.00 -2.44 0.00 0.00 57.07 54.26 2aaz s TYR 214 Cb -0.11 -1.93 0.03 0.00 0.35 0.00 0.00 41.96 40.30 2aaz s TYR 214 CO -0.00 -0.13 -0.12 -1.14 -1.34 0.00 0.00 175.55 172.82 2aaz s GLN 215 N 0.44 2.77 0.21 4.97 0.74 -0.14 -2.82 119.66 125.82 2aaz s GLN 215 Ca -0.06 -1.00 -0.07 0.00 0.05 0.00 0.00 55.36 54.29 2aaz s GLN 215 Cb -0.15 -2.81 0.15 0.00 1.10 0.00 0.00 33.01 31.30 2aaz s GLN 215 CO 0.04 -0.36 1.68 0.07 -0.55 0.00 0.00 175.29 176.17 2aaz h ARG 216 N 7.93 1.00 -4.20 1.67 0.11 -1.66 0.24 114.38 119.48 2aaz h ARG 216 Ca -0.35 -0.30 -0.46 0.00 0.10 0.00 0.00 59.98 58.97 2aaz h ARG 216 Cb 1.11 -0.10 -0.34 0.00 1.11 0.00 0.00 29.97 31.74 2aaz h ARG 216 CO 0.57 0.98 -0.79 0.45 0.10 0.00 0.00 179.97 181.28 2aaz s SER 217 N -6.59 1.42 -0.18 0.08 0.15 -1.26 0.11 113.70 107.43 2aaz s SER 217 Ca -0.11 -0.20 -0.00 0.00 0.70 0.00 0.00 55.95 56.33 2aaz s SER 217 Cb 0.14 -0.62 0.04 0.00 -1.71 0.00 0.00 66.02 63.87 2aaz s SER 217 CO 0.84 -0.04 -0.06 0.00 1.20 0.00 0.00 173.24 175.18 2aaz s ASP 219 N 1.58 6.43 0.41 0.00 3.68 -1.26 -1.67 116.67 125.83 2aaz s ASP 219 Ca -0.00 -1.58 0.09 0.00 2.13 0.00 0.00 52.55 53.19 2aaz s ASP 219 Cb -0.16 -2.41 0.89 0.00 -1.45 0.00 0.00 42.92 39.80 2aaz s ASP 219 CO -0.08 -1.23 2.01 -0.07 0.13 0.00 0.00 175.17 175.93 2aaz h LEU 220 N 10.85 0.48 0.24 -1.34 4.07 -1.83 0.33 115.31 128.11 2aaz h LEU 220 Ca -0.04 -0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.91 2aaz h LEU 220 Cb 1.04 -0.10 0.00 0.00 1.08 0.00 0.00 40.66 42.68 2aaz h LEU 220 CO 1.15 0.32 -0.12 1.23 -1.08 0.00 0.00 178.44 179.94 2aaz h GLY 221 N 0.55 -0.34 0.00 0.83 0.00 -1.90 -3.38 103.07 98.82 2aaz h GLY 221 Ca 0.24 0.13 -0.36 0.00 0.00 0.00 0.00 47.33 47.33 2aaz h GLY 221 CO -0.07 -0.12 -2.30 1.04 0.00 0.00 0.00 176.54 175.09 2aaz n LEU 222 N -5.09 2.56 0.11 3.11 4.77 -1.18 -4.73 117.00 116.55 2aaz n LEU 222 Ca -0.09 0.02 -0.08 0.00 -0.03 0.00 0.00 56.01 55.82 2aaz n LEU 222 Cb 0.25 -0.76 -0.05 0.00 -2.33 0.00 0.00 43.42 40.53 2aaz n LEU 222 CO 0.31 0.75 0.26 1.23 -1.33 0.00 0.00 177.39 178.62 2aaz h GLY 223 N 0.88 -0.38 -0.40 -0.72 0.00 -0.64 -3.37 103.07 98.44 2aaz h GLY 223 Ca -0.54 0.14 0.26 0.00 0.00 0.00 0.00 47.33 47.19 2aaz h GLY 223 CO -0.17 -0.14 0.40 -2.08 0.00 0.00 0.00 176.54 174.55 2aaz h VAL 224 N -1.02 0.36 -0.90 4.60 2.07 -1.40 0.88 116.25 120.83 2aaz h VAL 224 Ca -0.04 -0.11 0.05 0.00 0.82 0.00 0.00 66.70 67.43 2aaz h VAL 224 Cb 0.42 0.02 -0.06 0.00 -1.52 0.00 0.00 31.29 30.15 2aaz h VAL 224 CO 0.06 0.06 0.57 -0.65 0.02 0.00 0.00 177.57 177.62 2aaz h PRO 225 N 0.31 1.02 -0.04 1.57 0.11 -1.76 -0.79 132.00 132.42 2aaz h PRO 225 Ca 0.62 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.65 2aaz h PRO 225 Cb 1.29 -0.23 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 2aaz h PRO 225 CO -0.60 0.68 -0.05 0.74 -0.21 0.00 0.00 178.00 178.56 2aaz h PHE 226 N 1.05 0.13 -0.55 0.65 -1.00 -1.04 -3.06 116.94 113.13 2aaz h PHE 226 Ca 0.38 -0.04 0.08 0.00 2.81 0.00 0.00 57.97 61.20 2aaz h PHE 226 Cb 0.13 -0.03 -0.06 0.00 3.61 0.00 0.00 35.95 39.59 2aaz h PHE 226 CO -0.02 0.58 0.20 -0.91 -1.61 0.00 0.00 178.31 176.55 2aaz h ASN 227 N -0.35 0.20 0.08 2.17 -0.26 -0.90 0.29 115.58 116.80 2aaz h ASN 227 Ca 0.01 0.07 -0.00 0.00 -0.56 0.00 0.00 56.30 55.82 2aaz h ASN 227 Cb 0.56 0.05 -0.00 0.00 -1.06 0.00 0.00 38.32 37.87 2aaz h ASN 227 CO 0.01 0.13 -0.05 0.40 -1.06 0.00 0.00 177.43 176.86 2aaz h ILE 228 N 0.38 0.88 -0.49 2.81 2.04 -1.22 -2.02 117.51 119.89 2aaz h ILE 228 Ca 0.27 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 66.03 2aaz h ILE 228 Cb 0.31 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.26 2aaz h ILE 228 CO -0.28 0.00 -0.09 0.00 0.00 0.00 0.00 178.15 177.78 2aaz h ALA 229 N 0.79 0.91 0.50 1.87 0.00 -1.37 -2.37 119.26 119.58 2aaz h ALA 229 Ca -0.00 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 2aaz h ALA 229 Cb 0.12 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2aaz h ALA 229 CO -0.00 0.63 -0.30 1.03 0.00 0.00 0.00 179.25 180.61 2aaz h SER 230 N 0.80 -0.74 0.72 0.00 0.87 -0.23 0.02 113.55 114.99 2aaz h SER 230 Ca 0.13 0.04 -0.06 0.00 -1.23 0.00 0.00 61.79 60.68 2aaz h SER 230 Cb 0.61 0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.77 2aaz h SER 230 CO 0.04 -0.47 -0.28 1.88 -0.53 0.00 0.00 176.83 177.47 2aaz h TYR 231 N -0.75 0.00 -0.36 2.24 0.05 -1.41 -0.05 116.97 116.69 2aaz h TYR 231 Ca -0.06 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.62 2aaz h TYR 231 Cb 0.61 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.34 2aaz h TYR 231 CO -0.09 0.28 -0.19 0.00 -1.05 0.00 0.00 178.16 177.11 2aaz h ALA 232 N 1.72 0.50 -0.53 3.88 0.00 -1.20 -1.79 119.26 121.84 2aaz h ALA 232 Ca -0.00 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.46 2aaz h ALA 232 Cb 0.71 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2aaz h ALA 232 CO 0.04 0.45 -0.03 -0.07 0.00 0.00 0.00 179.25 179.64 2aaz h LEU 233 N 0.54 0.94 -0.84 0.00 3.38 -0.50 -2.06 115.31 116.77 2aaz h LEU 233 Ca 0.08 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 57.75 2aaz h LEU 233 Cb 0.74 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.19 2aaz h LEU 233 CO 0.06 1.03 0.55 0.25 0.09 0.00 0.00 178.44 180.41 2aaz h LEU 234 N 0.82 0.93 -0.73 1.67 5.85 -0.88 0.30 115.31 123.28 2aaz h LEU 234 Ca 0.15 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.78 2aaz h LEU 234 Cb 0.57 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 2aaz h LEU 234 CO 0.03 0.65 0.16 0.74 -0.34 0.00 0.00 178.44 179.69 2aaz h THR 235 N 1.09 1.26 -0.61 1.05 2.02 -1.10 -0.26 112.91 116.36 2aaz h THR 235 Ca 0.33 -0.99 -0.06 0.00 0.77 0.00 0.00 66.41 66.46 2aaz h THR 235 Cb -0.05 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 66.88 2aaz h THR 235 CO -0.10 0.38 0.15 0.45 0.37 0.00 0.00 175.52 176.78 2aaz h HIS 236 N 1.07 1.02 0.37 3.16 3.86 -0.64 -0.36 115.15 123.63 2aaz h HIS 236 Ca 0.22 -0.12 -0.02 0.00 -1.16 0.00 0.00 60.37 59.29 2aaz h HIS 236 Cb 0.38 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 28.57 2aaz h HIS 236 CO 0.03 0.86 -0.18 0.52 0.86 0.00 0.00 177.93 180.02 2aaz h MET 237 N 0.89 -0.48 -0.46 2.45 2.07 -0.55 -2.24 114.93 116.60 2aaz h MET 237 Ca 0.19 0.03 0.01 0.00 -2.07 0.00 0.00 59.70 57.86 2aaz h MET 237 Cb 0.35 0.11 -0.02 0.00 -1.87 0.00 0.00 31.60 30.16 2aaz h MET 237 CO 0.00 -0.27 0.30 0.82 1.07 0.00 0.00 176.91 178.83 2aaz h ILE 238 N -0.58 1.11 -0.64 -1.22 2.04 -0.99 -1.97 117.51 115.25 2aaz h ILE 238 Ca -0.05 -0.21 -0.04 0.00 1.00 0.00 0.00 64.86 65.56 2aaz h ILE 238 Cb 0.43 0.45 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 2aaz h ILE 238 CO 0.08 0.11 0.24 0.00 0.00 0.00 0.00 178.15 178.59 2aaz h ALA 239 N 1.72 0.83 -0.48 1.87 0.00 -0.83 -1.11 119.26 121.26 2aaz h ALA 239 Ca 0.17 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2aaz h ALA 239 Cb -0.04 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2aaz h ALA 239 CO -0.04 0.46 0.17 1.25 0.00 0.00 0.00 179.25 181.10 2aaz h LEU 240 N 0.90 0.68 -0.80 0.00 5.85 -0.76 -0.16 115.31 121.02 2aaz h LEU 240 Ca 0.21 -0.19 -0.11 0.00 0.84 0.00 0.00 57.88 58.63 2aaz h LEU 240 Cb 0.23 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 2aaz h LEU 240 CO -0.01 0.68 -0.54 0.40 -0.34 0.00 0.00 178.44 178.63 2aaz h ILE 241 N 0.64 1.25 -0.47 4.05 1.08 -1.32 -3.21 117.51 119.54 2aaz h ILE 241 Ca 0.16 -1.93 0.00 0.00 -0.39 0.00 0.00 64.86 62.70 2aaz h ILE 241 Cb 0.23 2.08 0.00 0.00 -3.07 0.00 0.00 36.82 36.06 2aaz h ILE 241 CO -0.01 0.53 0.00 0.35 -0.69 0.00 0.00 178.15 178.33 2aaz n THR 242 N -3.70 0.62 -3.36 -0.27 -2.24 -0.43 -4.96 114.28 99.93 2aaz n THR 242 Ca -0.01 -0.81 -0.24 0.00 -2.27 0.00 0.00 64.05 60.73 2aaz n THR 242 Cb 0.58 0.88 0.06 0.00 -2.10 0.00 0.00 70.33 69.75 2aaz n THR 242 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2aaz n ASP 243 N 1.52 -6.21 -4.64 3.42 10.43 -0.51 -4.81 116.55 115.76 2aaz n ASP 243 Ca 0.20 -0.44 -0.25 0.00 2.57 0.00 0.00 54.79 56.87 2aaz n ASP 243 Cb 0.61 -4.94 -0.09 0.00 1.84 0.00 0.00 41.12 38.54 2aaz n ASP 243 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 2aaz s THR 244 N -3.26 2.53 -0.25 -3.53 -4.23 -0.19 -4.47 115.64 102.25 2aaz s THR 244 Ca 0.47 -1.96 -0.07 0.00 -1.18 0.00 0.00 61.69 58.95 2aaz s THR 244 Cb -0.21 -2.82 -0.03 0.00 1.34 0.00 0.00 72.50 70.78 2aaz s THR 244 CO 0.58 -0.17 0.06 -0.70 -0.54 0.00 0.00 174.62 173.86 2aaz s GLU 245 N -3.73 3.63 0.26 3.99 2.56 0.52 -4.42 118.70 121.51 2aaz s GLU 245 Ca 0.35 -0.49 -0.31 0.00 0.00 0.00 0.00 54.97 54.52 2aaz s GLU 245 Cb 0.01 -3.30 -0.13 0.00 2.00 0.00 0.00 34.13 32.71 2aaz s GLU 245 CO 0.19 -0.19 1.48 -0.35 -0.56 0.00 0.00 175.26 175.83 2aaz n PRO 246 N 4.92 2.30 0.03 4.30 -0.04 -1.26 -0.43 135.00 144.81 2aaz n PRO 246 Ca -0.16 0.82 -0.00 0.00 -0.04 0.00 0.00 63.50 64.11 2aaz n PRO 246 Cb 0.51 -2.53 -0.00 0.00 -0.04 0.00 0.00 33.50 31.45 2aaz n PRO 246 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 2aaz n HIS 247 N 2.01 0.00 -3.89 0.54 -0.00 0.14 -3.77 115.22 110.25 2aaz n HIS 247 Ca 0.10 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.18 2aaz n HIS 247 Cb 0.34 -0.01 -0.10 0.00 -0.12 0.00 0.00 29.99 30.10 2aaz n HIS 247 CO 0.00 0.00 0.00 -2.00 0.46 0.00 0.00 176.34 174.80 2aaz s GLU 248 N -1.66 0.47 -0.11 1.57 2.12 -1.22 -0.26 118.70 119.60 2aaz s GLU 248 Ca -0.00 -0.44 0.01 0.00 0.36 0.00 0.00 54.97 54.90 2aaz s GLU 248 Cb 0.00 0.19 0.02 0.00 0.26 0.00 0.00 34.13 34.60 2aaz s GLU 248 CO 0.01 -0.11 -0.14 0.12 -0.54 0.00 0.00 175.26 174.59 2aaz s PHE 249 N -1.46 1.94 -0.07 5.30 5.36 0.10 -0.90 117.98 128.25 2aaz s PHE 249 Ca -0.14 -0.94 0.02 0.00 -0.96 0.00 0.00 56.93 54.91 2aaz s PHE 249 Cb -0.08 -1.42 -0.02 0.00 -0.34 0.00 0.00 43.02 41.16 2aaz s PHE 249 CO 0.01 -0.50 -0.13 0.42 -1.46 0.00 0.00 175.22 173.56 2aaz s ILE 250 N 1.10 3.13 -0.22 3.12 1.09 0.16 -0.73 121.20 128.86 2aaz s ILE 250 Ca -0.04 -0.68 0.00 0.00 -1.10 0.00 0.00 60.65 58.83 2aaz s ILE 250 Cb -0.14 -2.25 0.06 0.00 -1.06 0.00 0.00 42.46 39.06 2aaz s ILE 250 CO -0.03 0.57 -0.05 -0.22 -0.10 0.00 0.00 174.94 175.12 2aaz s LEU 251 N -0.47 2.30 -0.19 2.97 2.96 -0.25 -0.74 118.68 125.25 2aaz s LEU 251 Ca 0.06 -1.07 -0.09 0.00 -0.22 0.00 0.00 54.13 52.81 2aaz s LEU 251 Cb -0.12 -1.09 -0.05 0.00 0.50 0.00 0.00 46.19 45.43 2aaz s LEU 251 CO 0.02 -0.23 0.12 -1.58 -1.32 0.00 0.00 176.35 173.36 2aaz s GLN 252 N 1.47 4.06 0.06 1.98 2.00 -0.27 -1.20 119.66 127.77 2aaz s GLN 252 Ca -0.04 -0.22 0.04 0.00 -2.00 0.00 0.00 55.36 53.13 2aaz s GLN 252 Cb -0.18 -3.37 -0.04 0.00 0.80 0.00 0.00 33.01 30.22 2aaz s GLN 252 CO -0.07 0.36 0.01 -1.64 -0.50 0.00 0.00 175.29 173.45 2aaz s MET 253 N 0.17 2.64 0.00 1.67 -1.94 -1.26 -0.97 119.30 119.61 2aaz s MET 253 Ca 0.09 -0.76 0.00 0.00 -1.71 0.00 0.00 55.69 53.30 2aaz s MET 253 Cb -0.11 -2.59 0.00 0.00 2.01 0.00 0.00 34.83 34.14 2aaz s MET 253 CO -0.01 0.57 0.00 0.41 -0.01 0.00 0.00 175.02 175.98 2aaz n GLY 254 N 0.80 -0.03 3.45 -0.03 0.00 0.85 -3.60 105.19 106.62 2aaz n GLY 254 Ca -0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.47 2aaz n GLY 254 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2aaz s ASP 255 N -1.00 6.32 -0.34 1.61 3.68 0.12 -0.51 116.67 126.54 2aaz s ASP 255 Ca 0.00 -1.38 -0.19 0.00 2.13 0.00 0.00 52.55 53.11 2aaz s ASP 255 Cb 0.00 -2.40 -0.00 0.00 -1.45 0.00 0.00 42.92 39.06 2aaz s ASP 255 CO 0.00 -1.29 0.55 0.00 0.13 0.00 0.00 175.17 174.56 2aaz s ALA 256 N 3.50 3.48 0.13 3.66 0.00 -0.64 -0.61 121.76 131.28 2aaz s ALA 256 Ca 0.25 -0.93 0.01 0.00 0.00 0.00 0.00 51.96 51.28 2aaz s ALA 256 Cb -0.13 -3.05 -0.04 0.00 0.00 0.00 0.00 23.12 19.89 2aaz s ALA 256 CO 0.03 -1.21 -0.01 -3.38 0.00 0.00 0.00 175.76 171.19 2aaz s HIS 257 N 2.47 1.00 -0.15 0.00 -0.00 -0.67 -1.18 115.29 116.77 2aaz s HIS 257 Ca 0.20 -1.04 -0.00 0.00 -0.00 0.00 0.00 55.06 54.23 2aaz s HIS 257 Cb -0.15 -0.58 0.03 0.00 -0.00 0.00 0.00 32.58 31.88 2aaz s HIS 257 CO 0.13 -0.27 -0.09 0.08 -0.00 0.00 0.00 174.74 174.60 2aaz s VAL 258 N -3.74 1.28 0.54 -5.38 1.01 -0.49 -2.17 120.40 111.45 2aaz s VAL 258 Ca 0.19 -0.60 -0.22 0.00 0.00 0.00 0.00 61.98 61.36 2aaz s VAL 258 Cb 0.06 -1.34 -0.05 0.00 0.00 0.00 0.00 36.38 35.06 2aaz s VAL 258 CO 0.00 0.28 1.32 -0.31 0.00 0.00 0.00 175.10 176.39 2aaz s TYR 259 N 1.58 2.37 0.28 5.22 1.51 -1.26 -1.99 117.35 125.07 2aaz s TYR 259 Ca 0.03 1.41 0.03 0.00 -1.01 0.00 0.00 57.07 57.52 2aaz s TYR 259 Cb -0.14 -3.72 0.66 0.00 -0.11 0.00 0.00 41.96 38.64 2aaz s TYR 259 CO -0.09 -2.66 1.74 0.00 -1.11 0.00 0.00 175.55 173.43 2aaz h ARG 260 N 1.51 0.57 -0.19 -0.62 2.47 -1.66 0.64 114.38 117.11 2aaz h ARG 260 Ca -0.51 -0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.18 2aaz h ARG 260 Cb 1.29 -0.13 0.00 0.00 -1.65 0.00 0.00 29.97 29.48 2aaz h ARG 260 CO 0.58 0.38 0.00 -0.40 0.56 0.00 0.00 179.97 181.08 2aaz n ASP 261 N -4.90 0.69 -0.00 7.04 5.75 -1.26 -3.25 116.55 120.61 2aaz n ASP 261 Ca 0.20 -2.01 0.05 0.00 -0.01 0.00 0.00 54.79 53.02 2aaz n ASP 261 Cb 0.55 -0.12 -0.07 0.00 -1.03 0.00 0.00 41.12 40.45 2aaz n ASP 261 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2aaz n HIS 262 N -0.16 0.00 0.06 2.11 8.25 0.21 -4.70 115.22 120.99 2aaz n HIS 262 Ca 0.04 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.36 2aaz n HIS 262 Cb 0.12 -0.15 -0.07 0.00 1.12 0.00 0.00 29.99 31.01 2aaz n HIS 262 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2aaz h VAL 263 N 0.00 0.15 -0.31 1.59 2.07 -1.51 -0.57 116.25 117.68 2aaz h VAL 263 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2aaz h VAL 263 Cb 0.38 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 2aaz h VAL 263 CO 0.00 0.00 0.16 -0.33 0.02 0.00 0.00 177.57 177.42 2aaz h GLU 264 N -0.57 0.44 -0.79 1.57 4.39 -1.85 -1.83 114.58 115.94 2aaz h GLU 264 Ca 0.05 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2aaz h GLU 264 Cb 0.65 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 29.18 2aaz h GLU 264 CO -0.32 0.39 0.50 -1.35 -1.16 0.00 0.00 179.01 177.07 2aaz h PRO 265 N 0.37 1.06 -0.14 2.33 0.11 -1.80 -2.39 132.00 131.54 2aaz h PRO 265 Ca 0.11 -0.08 -0.11 0.00 0.11 0.00 0.00 66.00 66.03 2aaz h PRO 265 Cb 0.09 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 30.95 2aaz h PRO 265 CO -0.02 0.72 -0.38 -0.07 -0.21 0.00 0.00 178.00 178.05 2aaz h LEU 266 N 1.08 0.32 -1.77 2.35 3.38 -0.89 -2.73 115.31 117.05 2aaz h LEU 266 Ca 0.29 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 58.16 2aaz h LEU 266 Cb -0.08 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 2aaz h LEU 266 CO -0.06 0.67 0.20 0.11 0.09 0.00 0.00 178.44 179.45 2aaz h LYS 267 N 0.26 0.29 -0.44 1.13 1.57 -0.80 0.62 116.57 119.21 2aaz h LYS 267 Ca 0.03 -0.02 -0.15 0.00 -1.87 0.00 0.00 60.65 58.64 2aaz h LYS 267 Cb 0.78 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.02 2aaz h LYS 267 CO 0.06 0.19 -0.30 1.15 -0.57 0.00 0.00 179.45 179.98 2aaz h THR 268 N 0.30 1.27 -0.26 -0.16 2.02 -1.44 -3.06 112.91 111.58 2aaz h THR 268 Ca 0.12 -1.47 -0.12 0.00 0.77 0.00 0.00 66.41 65.71 2aaz h THR 268 Cb 0.12 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 2aaz h THR 268 CO -0.03 0.50 -0.33 -0.61 0.37 0.00 0.00 175.52 175.42 2aaz h GLN 269 N 0.82 0.56 0.00 6.66 4.15 -1.05 -2.90 115.11 123.35 2aaz h GLN 269 Ca 0.09 -0.25 0.00 0.00 0.77 0.00 0.00 58.65 59.25 2aaz h GLN 269 Cb 0.89 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.57 2aaz h GLN 269 CO 0.08 0.82 0.00 -0.07 -1.93 0.00 0.00 178.83 177.73 2aaz h LEU 270 N 0.48 0.00 0.00 -2.39 3.38 -0.85 -1.23 115.31 114.70 2aaz h LEU 270 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2aaz h LEU 270 Cb 0.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2aaz h LEU 270 CO 0.07 0.00 -0.19 -0.62 0.09 0.00 0.00 178.44 177.79 2aaz n GLU 271 N -2.77 0.24 -3.23 1.13 1.02 -1.09 -4.88 120.64 111.07 2aaz n GLU 271 Ca -0.02 0.16 -0.39 0.00 -0.02 0.00 0.00 57.16 56.89 2aaz n GLU 271 Cb 0.10 -1.74 -0.06 0.00 -0.02 0.00 0.00 31.44 29.72 2aaz n GLU 271 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2aaz s ARG 272 N -3.11 4.26 -0.15 3.49 0.52 -0.47 -5.06 118.95 118.43 2aaz s ARG 272 Ca 0.10 0.80 -0.19 0.00 -0.52 0.00 0.00 55.73 55.91 2aaz s ARG 272 Cb 0.13 -3.25 -0.04 0.00 0.52 0.00 0.00 34.95 32.32 2aaz s ARG 272 CO 0.63 0.61 0.53 -2.00 0.02 0.00 0.00 175.30 175.10 2aaz s GLU 273 N -1.05 4.28 0.61 3.54 2.12 -1.26 -4.96 118.70 121.99 2aaz s GLU 273 Ca 0.30 0.50 -0.19 0.00 0.36 0.00 0.00 54.97 55.94 2aaz s GLU 273 Cb -0.20 -3.50 -0.02 0.00 0.26 0.00 0.00 34.13 30.67 2aaz s GLU 273 CO 0.20 -0.01 1.30 -2.30 -0.54 0.00 0.00 175.26 173.91 2aaz n PRO 274 N 4.24 1.30 -4.04 4.30 -0.02 -1.26 -4.88 135.00 134.64 2aaz n PRO 274 Ca -0.05 0.50 -0.24 0.00 -2.02 0.00 0.00 63.50 61.68 2aaz n PRO 274 Cb 0.51 -2.53 -0.04 0.00 -0.02 0.00 0.00 33.50 31.42 2aaz n PRO 274 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2aaz s ARG 275 N -3.19 3.12 0.32 -0.52 3.00 -1.26 -5.05 118.95 115.36 2aaz s ARG 275 Ca 0.79 -0.84 -0.29 0.00 0.00 0.00 0.00 55.73 55.40 2aaz s ARG 275 Cb -0.39 -2.74 -0.13 0.00 0.00 0.00 0.00 34.95 31.69 2aaz s ARG 275 CO 0.43 0.46 1.30 -0.25 0.00 0.00 0.00 175.30 177.24 2aaz n ASP 276 N -0.78 2.67 -4.73 0.23 8.00 -1.26 -4.80 116.55 115.87 2aaz n ASP 276 Ca -0.08 1.19 -0.37 0.00 0.71 0.00 0.00 54.79 56.25 2aaz n ASP 276 Cb 0.56 -1.46 0.07 0.00 -0.02 0.00 0.00 41.12 40.27 2aaz n ASP 276 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2aaz s PHE 277 N -0.86 2.10 0.92 1.24 0.08 -1.26 -4.74 117.98 115.45 2aaz s PHE 277 Ca 0.58 1.50 -0.14 0.00 0.12 0.00 0.00 56.93 58.99 2aaz s PHE 277 Cb -0.59 -3.66 0.15 0.00 -0.57 0.00 0.00 43.02 38.35 2aaz s PHE 277 CO 0.59 -2.84 1.22 -1.25 -0.10 0.00 0.00 175.22 172.85 2aaz s PRO 278 N -3.42 1.05 0.13 0.24 0.04 -1.25 -4.84 135.00 126.95 2aaz s PRO 278 Ca 0.81 -0.06 0.10 0.00 0.04 0.00 0.00 61.00 61.89 2aaz s PRO 278 Cb -0.36 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.28 2aaz s PRO 278 CO 0.39 -2.19 -0.23 0.15 0.04 0.00 0.00 177.00 175.16 2aaz s LYS 279 N -5.62 1.56 -0.14 4.56 1.02 -0.29 -1.59 119.74 119.24 2aaz s LYS 279 Ca 0.68 -1.29 -0.06 0.00 0.02 0.00 0.00 55.97 55.31 2aaz s LYS 279 Cb -0.09 -1.98 -0.04 0.00 -0.52 0.00 0.00 37.83 35.20 2aaz s LYS 279 CO 0.52 0.46 0.07 -1.17 -0.92 0.00 0.00 175.35 174.31 2aaz s LEU 280 N -2.13 3.94 0.07 3.17 2.96 0.59 -1.31 118.68 125.96 2aaz s LEU 280 Ca 0.16 0.22 0.03 0.00 -0.22 0.00 0.00 54.13 54.32 2aaz s LEU 280 Cb -0.10 -1.96 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 2aaz s LEU 280 CO 0.08 0.30 -0.09 -0.54 -1.32 0.00 0.00 176.35 174.78 2aaz s LYS 281 N -0.40 0.68 -0.15 1.98 -0.14 0.11 -4.84 119.74 116.98 2aaz s LYS 281 Ca 0.10 -0.97 -0.08 0.00 -1.36 0.00 0.00 55.97 53.66 2aaz s LYS 281 Cb -0.12 -0.39 -0.04 0.00 -1.68 0.00 0.00 37.83 35.60 2aaz s LYS 281 CO 0.02 0.06 0.12 -1.58 -0.76 0.00 0.00 175.35 173.21 2aaz s TRP 282 N -2.00 3.47 -0.36 3.18 0.52 -1.26 -0.61 118.94 121.88 2aaz s TRP 282 Ca -0.02 0.39 0.27 0.00 0.02 0.00 0.00 56.10 56.75 2aaz s TRP 282 Cb -0.06 -2.03 0.81 0.00 -1.15 0.00 0.00 33.47 31.04 2aaz s TRP 282 CO -0.00 0.49 1.76 0.00 0.02 0.00 0.00 176.95 179.22 2aaz h ALA 283 N 5.80 1.00 -2.21 0.98 0.00 -1.29 -3.46 119.26 120.09 2aaz h ALA 283 Ca -0.48 0.00 -0.40 0.00 0.00 0.00 0.00 54.91 54.03 2aaz h ALA 283 Cb 1.19 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 18.84 2aaz h ALA 283 CO 0.66 0.00 -0.60 1.03 0.00 0.00 0.00 179.25 180.33 2aaz s ARG 284 N -3.33 1.52 0.63 0.00 0.52 -1.26 -5.06 118.95 111.97 2aaz s ARG 284 Ca 0.06 -1.84 -0.03 0.00 -0.52 0.00 0.00 55.73 53.40 2aaz s ARG 284 Cb 0.08 -0.46 0.05 0.00 0.52 0.00 0.00 34.95 35.13 2aaz s ARG 284 CO 0.58 -0.28 0.90 -1.54 0.02 0.00 0.00 175.30 174.99 2aaz s SER 285 N -3.39 5.06 0.19 0.23 1.04 -1.26 -4.91 113.70 110.66 2aaz s SER 285 Ca 0.37 0.27 -0.13 0.00 0.48 0.00 0.00 55.95 56.94 2aaz s SER 285 Cb 0.08 -1.04 0.13 0.00 0.10 0.00 0.00 66.02 65.28 2aaz s SER 285 CO 0.15 -1.37 1.82 0.50 0.98 0.00 0.00 173.24 175.32 2aaz h LYS 286 N -0.28 0.66 -0.63 4.02 3.64 -1.97 -1.15 116.57 120.85 2aaz h LYS 286 Ca -0.43 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 2aaz h LYS 286 Cb 1.30 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 32.95 2aaz h LYS 286 CO 0.57 0.43 0.40 0.93 -2.27 0.00 0.00 179.45 179.51 2aaz h GLU 287 N 0.68 0.85 -0.31 1.90 3.07 -1.94 0.19 114.58 119.01 2aaz h GLU 287 Ca 0.23 -0.06 -0.04 0.00 -0.50 0.00 0.00 59.36 58.99 2aaz h GLU 287 Cb 0.02 -0.18 -0.01 0.00 -0.84 0.00 0.00 28.75 27.74 2aaz h GLU 287 CO -0.10 0.58 0.04 0.93 -1.40 0.00 0.00 179.01 179.06 2aaz h GLU 288 N 0.86 0.52 -0.46 2.33 5.08 -1.85 -2.85 114.58 118.22 2aaz h GLU 288 Ca 0.23 -0.15 -0.08 0.00 -1.00 0.00 0.00 59.36 58.36 2aaz h GLU 288 Cb -0.06 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 2aaz h GLU 288 CO -0.05 0.63 -0.06 0.82 -1.00 0.00 0.00 179.01 179.35 2aaz h ILE 289 N 0.34 1.25 0.00 3.13 2.04 -1.02 -3.47 117.51 119.78 2aaz h ILE 289 Ca 0.09 -1.09 0.00 0.00 1.00 0.00 0.00 64.86 64.87 2aaz h ILE 289 Cb 0.36 0.96 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 2aaz h ILE 289 CO 0.01 0.38 0.00 0.61 0.00 0.00 0.00 178.15 179.15 2aaz n GLY 290 N -0.54 2.21 1.01 5.37 0.00 0.64 -4.00 105.19 109.88 2aaz n GLY 290 Ca 0.02 -0.14 -0.07 0.00 0.00 0.00 0.00 46.02 45.83 2aaz n GLY 290 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2aaz n ASP 291 N 4.94 0.40 0.33 1.61 5.68 -1.26 -4.87 116.55 123.38 2aaz n ASP 291 Ca 0.00 -1.67 0.21 0.00 -0.50 0.00 0.00 54.79 52.82 2aaz n ASP 291 Cb 0.00 0.42 1.13 0.00 -1.14 0.00 0.00 41.12 41.53 2aaz n ASP 291 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 2aaz h ILE 292 N 1.27 0.14 -0.27 2.12 6.09 -1.94 -1.10 117.51 123.82 2aaz h ILE 292 Ca -0.09 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.40 2aaz h ILE 292 Cb 0.37 0.98 0.00 0.00 0.47 0.00 0.00 36.82 38.65 2aaz h ILE 292 CO 0.13 0.00 0.00 0.47 -3.07 0.00 0.00 178.15 175.68 2aaz n ASP 293 N -3.27 2.50 -1.10 2.19 8.00 -1.26 -4.24 116.55 119.36 2aaz n ASP 293 Ca -0.03 -1.85 0.11 0.00 0.71 0.00 0.00 54.79 53.73 2aaz n ASP 293 Cb 0.09 -0.17 0.21 0.00 -0.02 0.00 0.00 41.12 41.23 2aaz n ASP 293 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2aaz n GLY 294 N 1.30 1.80 3.80 0.44 0.00 -0.41 -4.99 105.19 107.13 2aaz n GLY 294 Ca 0.17 -0.70 -0.34 0.00 0.00 0.00 0.00 46.02 45.16 2aaz n GLY 294 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2aaz s PHE 295 N -1.35 3.10 0.08 1.61 0.40 -1.26 -4.78 117.98 115.78 2aaz s PHE 295 Ca 0.37 1.59 0.04 0.00 -0.60 0.00 0.00 56.93 58.33 2aaz s PHE 295 Cb 0.22 -3.00 -0.03 0.00 0.51 0.00 0.00 43.02 40.72 2aaz s PHE 295 CO 0.30 -0.59 -0.11 0.15 0.70 0.00 0.00 175.22 175.66 2aaz s LYS 296 N -3.21 0.80 0.22 0.44 1.02 -1.26 -5.05 119.74 112.70 2aaz s LYS 296 Ca 0.66 -1.04 -0.09 0.00 0.02 0.00 0.00 55.97 55.52 2aaz s LYS 296 Cb -0.14 -0.63 0.34 0.00 -0.52 0.00 0.00 37.83 36.88 2aaz s LYS 296 CO 0.18 0.12 1.68 0.28 -0.92 0.00 0.00 175.35 176.68 2aaz h VAL 297 N 3.94 0.53 0.00 3.17 2.07 -1.97 0.88 116.25 124.86 2aaz h VAL 297 Ca -0.38 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.07 2aaz h VAL 297 Cb 1.19 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 2aaz h VAL 297 CO 0.47 0.03 0.00 -1.84 0.02 0.00 0.00 177.57 176.25 2aaz n GLU 298 N -5.22 0.04 0.14 1.57 0.00 -1.26 -2.09 120.64 113.82 2aaz n GLU 298 Ca 0.10 0.32 0.01 0.00 0.00 0.00 0.00 57.16 57.59 2aaz n GLU 298 Cb 0.38 -1.50 0.13 0.00 0.00 0.00 0.00 31.44 30.45 2aaz n GLU 298 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 2aaz h ASP 299 N 0.00 0.00 -2.91 -1.84 3.32 -1.21 -3.43 116.42 110.35 2aaz h ASP 299 Ca 0.00 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.50 2aaz h ASP 299 Cb 0.10 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.57 2aaz h ASP 299 CO 0.00 0.59 0.97 -0.36 -1.72 0.00 0.00 179.24 178.72 2aaz s PHE 300 N -3.27 2.51 -0.56 4.55 0.40 -0.89 -0.93 117.98 119.79 2aaz s PHE 300 Ca 0.01 0.21 -0.12 0.00 -0.60 0.00 0.00 56.93 56.43 2aaz s PHE 300 Cb 0.10 -4.52 0.14 0.00 0.51 0.00 0.00 43.02 39.25 2aaz s PHE 300 CO 0.74 -1.74 0.46 0.08 0.70 0.00 0.00 175.22 175.47 2aaz s VAL 301 N 5.13 4.71 -0.32 -0.44 1.01 0.23 -4.98 120.40 125.73 2aaz s VAL 301 Ca 0.39 -1.88 -0.17 0.00 0.00 0.00 0.00 61.98 60.33 2aaz s VAL 301 Cb -0.08 -4.04 -0.02 0.00 0.00 0.00 0.00 36.38 32.25 2aaz s VAL 301 CO 0.21 -0.85 0.44 -0.69 0.00 0.00 0.00 175.10 174.21 2aaz s VAL 302 N 1.17 5.10 0.07 2.92 1.01 -1.26 -0.72 120.40 128.68 2aaz s VAL 302 Ca 0.07 0.37 0.08 0.00 0.00 0.00 0.00 61.98 62.50 2aaz s VAL 302 Cb -0.25 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 2aaz s VAL 302 CO -0.01 -0.07 -0.18 -1.83 0.00 0.00 0.00 175.10 173.01 2aaz s GLU 303 N 2.22 1.96 0.00 2.72 -1.05 -0.43 -4.67 118.70 119.45 2aaz s GLU 303 Ca 0.16 -1.06 0.00 0.00 -0.15 0.00 0.00 54.97 53.93 2aaz s GLU 303 Cb -0.16 -2.16 0.00 0.00 -0.44 0.00 0.00 34.13 31.37 2aaz s GLU 303 CO 0.12 0.52 0.00 0.41 0.95 0.00 0.00 175.26 177.25 2aaz n GLY 304 N 1.27 0.54 3.63 -3.83 0.00 -1.26 -1.14 105.19 104.40 2aaz n GLY 304 Ca -0.16 -0.49 -0.43 0.00 0.00 0.00 0.00 46.02 44.94 2aaz n GLY 304 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2aaz s TYR 305 N -2.00 2.92 -0.50 1.61 6.04 -1.26 -4.34 117.35 119.81 2aaz s TYR 305 Ca 0.00 1.01 0.06 0.00 0.04 0.00 0.00 57.07 58.18 2aaz s TYR 305 Cb 0.00 -3.85 0.21 0.00 -1.04 0.00 0.00 41.96 37.27 2aaz s TYR 305 CO 0.00 -1.23 0.50 1.63 -1.54 0.00 0.00 175.55 174.91 2aaz n LYS 306 N 7.15 1.08 -2.23 4.97 5.02 -1.26 -5.08 118.16 127.81 2aaz n LYS 306 Ca 0.13 -3.71 -0.27 0.00 -2.02 0.00 0.00 58.31 52.45 2aaz n LYS 306 Cb 0.47 -1.76 0.05 0.00 -0.02 0.00 0.00 35.03 33.77 2aaz n LYS 306 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2aaz s PRO 307 N -1.06 2.53 0.36 1.97 0.04 -1.26 -4.72 135.00 132.86 2aaz s PRO 307 Ca 0.33 -0.08 -0.04 0.00 0.04 0.00 0.00 61.00 61.25 2aaz s PRO 307 Cb 0.08 -2.19 0.08 0.00 0.04 0.00 0.00 34.50 32.52 2aaz s PRO 307 CO -0.13 -1.03 0.49 0.91 0.04 0.00 0.00 177.00 177.28 2aaz n TRP 308 N -2.82 -3.70 -0.71 0.56 7.02 -0.19 -4.88 117.44 112.72 2aaz n TRP 308 Ca 0.07 -0.57 -0.30 0.00 -1.02 0.00 0.00 57.50 55.68 2aaz n TRP 308 Cb 0.59 -0.37 0.19 0.00 -2.42 0.00 0.00 31.31 29.30 2aaz n TRP 308 CO 0.00 0.00 0.00 0.20 -2.02 0.00 0.00 177.69 175.87 2aaz s GLY 309 N -3.93 1.63 0.68 6.99 0.00 -1.26 -2.78 107.32 108.65 2aaz s GLY 309 Ca 0.29 0.26 -0.13 0.00 0.00 0.00 0.00 44.72 45.15 2aaz s GLY 309 CO 0.20 0.79 1.08 -1.59 0.00 0.00 0.00 173.10 173.59 2aaz s LYS 310 N -4.62 2.82 -0.18 2.90 -2.85 -1.26 -3.07 119.74 113.49 2aaz s LYS 310 Ca 0.67 1.18 -0.01 0.00 -1.00 0.00 0.00 55.97 56.81 2aaz s LYS 310 Cb -0.23 -1.97 0.05 0.00 -2.06 0.00 0.00 37.83 33.62 2aaz s LYS 310 CO 0.60 -1.20 -0.04 0.42 0.10 0.00 0.00 175.35 175.23 2aaz s ILE 311 N -2.69 1.09 0.04 3.79 1.01 -1.26 -4.89 121.20 118.29 2aaz s ILE 311 Ca 0.62 -0.71 -0.31 0.00 0.00 0.00 0.00 60.65 60.26 2aaz s ILE 311 Cb -0.17 -1.32 -0.06 0.00 0.01 0.00 0.00 42.46 40.92 2aaz s ILE 311 CO 0.47 0.05 1.38 -1.81 0.00 0.00 0.00 174.94 175.03 2aaz s ASP 312 N 1.63 6.86 -0.08 3.58 1.01 -1.26 -5.01 116.67 123.40 2aaz s ASP 312 Ca -0.01 2.17 -0.04 0.00 0.71 0.00 0.00 52.55 55.39 2aaz s ASP 312 Cb -0.16 -2.57 0.04 0.00 1.01 0.00 0.00 42.92 41.24 2aaz s ASP 312 CO -0.07 -0.68 0.18 -0.04 0.21 0.00 0.00 175.17 174.77 2aaz s MET 313 N 1.90 0.11 0.19 8.23 -1.94 -1.26 -4.89 119.30 121.63 2aaz s MET 313 Ca 0.64 0.47 -0.29 0.00 -1.71 0.00 0.00 55.69 54.80 2aaz s MET 313 Cb -0.33 -0.18 -0.08 0.00 2.01 0.00 0.00 34.83 36.26 2aaz s MET 313 CO 0.28 -0.20 0.91 0.21 -0.01 0.00 0.00 175.02 176.21 2aaz s LYS 314 N 1.52 4.76 -0.02 2.03 2.20 -1.26 -5.03 119.74 123.94 2aaz s LYS 314 Ca -0.06 1.41 -0.19 0.00 -0.36 0.00 0.00 55.97 56.78 2aaz s LYS 314 Cb -0.11 -3.31 -0.05 0.00 -1.51 0.00 0.00 37.83 32.84 2aaz s LYS 314 CO -0.07 0.43 0.53 1.41 -0.36 0.00 0.00 175.35 177.30 2aaz s MET 315 N -0.81 4.24 -0.37 4.03 -2.45 -1.26 -4.97 119.30 117.71 2aaz s MET 315 Ca 0.42 0.62 -0.19 0.00 -1.25 0.00 0.00 55.69 55.29 2aaz s MET 315 Cb -0.25 -3.33 0.00 0.00 1.25 0.00 0.00 34.83 32.51 2aaz s MET 315 CO 0.30 0.41 0.53 -1.12 1.05 0.00 0.00 175.02 176.20 2aaz s SER 316 N -0.28 6.32 0.00 1.11 0.01 -1.26 -5.16 113.70 114.44 2aaz s SER 316 Ca 0.28 -0.10 0.09 0.00 1.31 0.00 0.00 55.95 57.53 2aaz s SER 316 Cb -0.17 -2.28 0.52 0.00 0.21 0.00 0.00 66.02 64.30 2aaz s SER 316 CO 0.15 -0.54 0.97 0.00 0.41 0.00 0.00 173.24 174.24