#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aaz h SER 14 N 0.00 0.85 -2.37 0.55 0.87 -2.03 -3.30 113.55 108.13 2aaz h SER 14 Ca 0.00 0.02 -0.59 0.00 -1.23 0.00 0.00 61.79 59.99 2aaz h SER 14 Cb 0.00 -0.16 -0.39 0.00 -0.44 0.00 0.00 62.40 61.41 2aaz h SER 14 CO 0.00 0.52 -0.93 -3.20 -0.53 0.00 0.00 176.83 172.69 2aaz n ASN 15 N -4.52 0.38 0.26 6.23 5.15 -1.26 -4.98 115.26 116.52 2aaz n ASN 15 Ca 0.15 -2.62 0.18 0.00 -0.60 0.00 0.00 54.58 51.69 2aaz n ASN 15 Cb 0.27 -0.61 0.89 0.00 -0.53 0.00 0.00 39.78 39.80 2aaz n ASN 15 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2aaz h PRO 16 N 5.15 0.00 -0.01 1.20 0.13 -2.04 -1.29 132.00 135.14 2aaz h PRO 16 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 2aaz h PRO 16 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 2aaz h PRO 16 CO 0.46 0.00 -0.00 -0.25 -0.23 0.00 0.00 178.00 177.98 2aaz n ASP 17 N -3.32 1.00 -4.69 1.44 8.00 -1.26 -4.88 116.55 112.84 2aaz n ASP 17 Ca 0.00 -1.32 -0.43 0.00 0.71 0.00 0.00 54.79 53.75 2aaz n ASP 17 Cb 0.33 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.40 2aaz n ASP 17 CO 0.00 0.00 0.00 1.57 -0.39 0.00 0.00 177.20 178.38 2aaz n HIS 18 N -0.23 2.57 0.14 1.24 -0.00 -0.49 -4.84 115.22 113.62 2aaz n HIS 18 Ca 0.20 -0.06 0.18 0.00 0.46 0.00 0.00 57.72 58.50 2aaz n HIS 18 Cb 0.28 -2.70 0.77 0.00 -0.12 0.00 0.00 29.99 28.22 2aaz n HIS 18 CO 0.00 0.00 0.00 0.93 0.46 0.00 0.00 176.34 177.73 2aaz h GLU 19 N 8.07 0.00 0.00 1.57 5.08 -1.91 -1.66 114.58 125.73 2aaz h GLU 19 Ca -0.46 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.89 2aaz h GLU 19 Cb 1.23 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.48 2aaz h GLU 19 CO 0.94 0.00 -0.05 1.49 -1.00 0.00 0.00 179.01 180.39 2aaz h GLU 20 N 0.00 0.00 0.00 2.33 4.81 -1.96 -1.94 114.58 117.81 2aaz h GLU 20 Ca 0.14 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 2aaz h GLU 20 Cb 0.70 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.08 2aaz h GLU 20 CO -0.00 0.05 -0.03 1.88 -0.73 0.00 0.00 179.01 180.18 2aaz h TYR 21 N 0.00 0.00 -0.37 0.92 -1.99 -1.66 -1.54 116.97 112.34 2aaz h TYR 21 Ca -0.00 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.73 2aaz h TYR 21 Cb 0.25 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.97 2aaz h TYR 21 CO 0.00 0.03 0.21 1.96 -0.00 0.00 0.00 178.16 180.37 2aaz h GLN 22 N 0.00 0.50 -0.07 4.88 4.20 -1.55 0.50 115.11 123.57 2aaz h GLN 22 Ca -0.00 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 2aaz h GLN 22 Cb 0.18 -0.10 -0.00 0.00 0.30 0.00 0.00 27.48 27.86 2aaz h GLN 22 CO 0.00 0.39 -0.01 -0.92 -0.67 0.00 0.00 178.83 177.62 2aaz h TYR 23 N 0.47 0.14 -0.54 2.96 5.03 -1.47 -2.20 116.97 121.36 2aaz h TYR 23 Ca 0.13 -0.03 -0.03 0.00 2.58 0.00 0.00 58.73 61.38 2aaz h TYR 23 Cb 0.02 -0.04 -0.02 0.00 1.55 0.00 0.00 36.73 38.24 2aaz h TYR 23 CO -0.03 0.43 0.21 -0.07 -1.32 0.00 0.00 178.16 177.37 2aaz h LEU 24 N -0.19 0.75 -0.88 2.82 3.38 -1.23 -2.55 115.31 117.42 2aaz h LEU 24 Ca 0.02 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 2aaz h LEU 24 Cb 0.38 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 2aaz h LEU 24 CO 0.01 0.72 0.17 0.44 0.09 0.00 0.00 178.44 179.87 2aaz h ASP 25 N 0.74 0.94 -0.53 -0.43 3.45 -0.02 -1.86 116.42 118.71 2aaz h ASP 25 Ca 0.18 -0.18 -0.07 0.00 0.43 0.00 0.00 57.03 57.39 2aaz h ASP 25 Cb 0.21 -0.25 -0.02 0.00 -0.56 0.00 0.00 39.33 38.71 2aaz h ASP 25 CO -0.01 0.90 0.07 0.25 -1.57 0.00 0.00 179.24 178.87 2aaz h LEU 26 N 0.96 0.86 -0.52 1.55 5.85 -1.24 -0.34 115.31 122.43 2aaz h LEU 26 Ca 0.21 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 2aaz h LEU 26 Cb 0.32 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 2aaz h LEU 26 CO -0.00 0.92 0.29 0.40 -0.34 0.00 0.00 178.44 179.70 2aaz h ILE 27 N 0.78 1.17 -0.60 4.05 2.04 -1.25 0.93 117.51 124.63 2aaz h ILE 27 Ca 0.16 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.59 2aaz h ILE 27 Cb 0.43 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 2aaz h ILE 27 CO 0.01 0.18 0.39 -0.09 0.00 0.00 0.00 178.15 178.64 2aaz h ARG 28 N 0.69 0.80 -0.40 2.37 2.43 -1.07 -1.25 114.38 117.95 2aaz h ARG 28 Ca 0.18 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 2aaz h ARG 28 Cb 0.04 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 2aaz h ARG 28 CO -0.03 0.55 0.18 -0.09 -1.51 0.00 0.00 179.97 179.07 2aaz h ARG 29 N 0.82 0.58 -0.68 0.20 2.43 -0.52 -0.56 114.38 116.64 2aaz h ARG 29 Ca 0.22 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 59.30 2aaz h ARG 29 Cb -0.07 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.35 2aaz h ARG 29 CO -0.05 0.51 0.41 0.82 -1.51 0.00 0.00 179.97 180.16 2aaz h ILE 30 N 0.50 1.20 -0.48 1.20 2.04 -0.52 0.19 117.51 121.64 2aaz h ILE 30 Ca 0.14 -0.44 -0.04 0.00 1.00 0.00 0.00 64.86 65.51 2aaz h ILE 30 Cb 0.13 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 36.46 2aaz h ILE 30 CO -0.02 0.20 0.12 0.40 0.00 0.00 0.00 178.15 178.86 2aaz h ILE 31 N 0.92 1.24 0.35 -0.67 2.04 -1.06 0.25 117.51 120.58 2aaz h ILE 31 Ca 0.24 -0.82 -0.02 0.00 1.00 0.00 0.00 64.86 65.27 2aaz h ILE 31 Cb -0.02 0.86 0.00 0.00 -0.74 0.00 0.00 36.82 36.92 2aaz h ILE 31 CO -0.05 0.29 -0.17 0.78 0.00 0.00 0.00 178.15 179.01 2aaz h ASN 32 N 0.65 -0.39 -0.10 1.72 -0.26 -0.57 -3.39 115.58 113.24 2aaz h ASN 32 Ca 0.15 -0.16 0.00 0.00 -0.56 0.00 0.00 56.30 55.73 2aaz h ASN 32 Cb 0.31 0.10 0.00 0.00 -1.06 0.00 0.00 38.32 37.68 2aaz h ASN 32 CO 0.00 0.03 0.00 1.33 -1.06 0.00 0.00 177.43 177.73 2aaz n VAL 33 N -5.12 0.59 -1.01 2.81 0.24 0.63 -5.05 118.33 111.42 2aaz n VAL 33 Ca -0.09 -0.79 -0.32 0.00 -2.04 0.00 0.00 64.34 61.10 2aaz n VAL 33 Cb 0.27 0.76 0.13 0.00 -1.47 0.00 0.00 33.84 33.53 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 -0.78 1.79 -0.14 7.63 0.00 0.89 -4.99 107.32 111.74 2aaz s GLY 34 Ca 0.09 0.53 -0.16 0.00 0.00 0.00 0.00 44.72 45.19 2aaz s GLY 34 CO 0.07 0.93 0.37 1.85 0.00 0.00 0.00 173.10 176.32 2aaz s GLU 35 N -4.61 4.27 -0.06 2.90 2.12 -0.12 -4.68 118.70 118.52 2aaz s GLU 35 Ca 0.66 0.26 -0.30 0.00 0.36 0.00 0.00 54.97 55.95 2aaz s GLU 35 Cb -0.22 -3.42 -0.03 0.00 0.26 0.00 0.00 34.13 30.72 2aaz s GLU 35 CO 0.55 0.23 1.26 0.08 -0.54 0.00 0.00 175.26 176.83 2aaz s VAL 36 N 0.45 4.14 0.04 3.70 1.01 -1.26 -0.68 120.40 127.81 2aaz s VAL 36 Ca 0.21 1.47 -0.00 0.00 0.00 0.00 0.00 61.98 63.65 2aaz s VAL 36 Cb -0.14 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.26 2aaz s VAL 36 CO 0.07 -0.02 -0.03 -0.13 0.00 0.00 0.00 175.10 174.98 2aaz s ARG 37 N 2.47 0.48 0.66 2.72 0.52 0.31 -4.99 118.95 121.13 2aaz s ARG 37 Ca 0.57 -0.95 -0.10 0.00 -0.52 0.00 0.00 55.73 54.73 2aaz s ARG 37 Cb -0.26 0.15 0.01 0.00 0.52 0.00 0.00 34.95 35.37 2aaz s ARG 37 CO 0.22 -0.08 1.04 -2.14 0.02 0.00 0.00 175.30 174.35 2aaz s PRO 38 N -2.83 2.96 0.27 3.54 0.02 -1.26 -1.45 135.00 136.25 2aaz s PRO 38 Ca -0.03 0.37 -0.16 0.00 0.02 0.00 0.00 61.00 61.19 2aaz s PRO 38 Cb -0.00 -2.10 0.01 0.00 0.02 0.00 0.00 34.50 32.43 2aaz s PRO 38 CO -0.06 -0.89 0.60 0.16 -0.33 0.00 0.00 177.00 176.48 2aaz s ASP 39 N -4.32 -0.14 0.26 2.53 -4.77 -1.26 -4.79 116.67 104.18 2aaz s ASP 39 Ca 0.57 -0.81 -0.01 0.00 -3.30 0.00 0.00 52.55 49.00 2aaz s ASP 39 Cb -0.11 0.67 0.56 0.00 -1.09 0.00 0.00 42.92 42.95 2aaz s ASP 39 CO 0.50 -1.27 1.74 -0.09 0.70 0.00 0.00 175.17 176.76 2aaz h ARG 40 N 2.12 0.52 0.00 2.11 2.43 -2.01 -2.42 114.38 117.14 2aaz h ARG 40 Ca -0.23 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 58.85 2aaz h ARG 40 Cb 1.25 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.67 2aaz h ARG 40 CO 0.30 0.35 -0.30 1.79 -1.51 0.00 0.00 179.97 180.60 2aaz h THR 41 N 0.54 0.80 0.00 0.20 1.35 -1.92 -3.47 112.91 110.41 2aaz h THR 41 Ca 0.47 -1.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.12 2aaz h THR 41 Cb 0.73 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 2aaz h THR 41 CO -0.41 0.29 0.00 0.61 -0.25 0.00 0.00 175.52 175.76 2aaz n GLY 42 N -0.05 1.02 0.11 5.82 0.00 -0.91 -4.90 105.19 106.28 2aaz n GLY 42 Ca -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 0.82 0.00 2.61 1.35 -1.91 -3.47 112.91 112.30 2aaz h THR 43 Ca 0.00 -2.30 0.00 0.00 -0.55 0.00 0.00 66.41 63.56 2aaz h THR 43 Cb 0.00 2.32 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 2aaz h THR 43 CO 0.00 0.47 0.00 0.61 -0.25 0.00 0.00 175.52 176.35 2aaz n GLY 44 N 1.32 -0.49 3.46 5.82 0.00 -1.26 -4.53 105.19 109.50 2aaz n GLY 44 Ca -0.04 -1.57 -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 -3.05 0.00 -0.08 2.61 -4.23 -0.53 -1.64 115.64 108.72 2aaz s THR 45 Ca 0.00 -1.64 0.03 0.00 -1.18 0.00 0.00 61.69 58.90 2aaz s THR 45 Cb 0.00 -2.51 0.01 0.00 1.34 0.00 0.00 72.50 71.34 2aaz s THR 45 CO 0.00 0.00 -0.18 0.54 -0.54 0.00 0.00 174.62 174.44 2aaz s VAL 46 N -3.47 1.61 0.10 2.29 0.11 -0.63 -0.53 120.40 119.87 2aaz s VAL 46 Ca 0.31 -0.76 -0.06 0.00 -2.93 0.00 0.00 61.98 58.54 2aaz s VAL 46 Cb 0.01 -1.41 -0.02 0.00 -1.53 0.00 0.00 36.38 33.43 2aaz s VAL 46 CO 0.17 0.46 0.13 0.00 -3.33 0.00 0.00 175.10 172.53 2aaz s ALA 47 N 0.46 0.18 0.00 1.54 0.00 0.15 -1.11 121.76 122.98 2aaz s ALA 47 Ca -0.16 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 50.87 2aaz s ALA 47 Cb -0.17 0.57 -0.01 0.00 0.00 0.00 0.00 23.12 23.51 2aaz s ALA 47 CO 0.06 -0.50 -0.07 -0.51 0.00 0.00 0.00 175.76 174.74 2aaz s LEU 48 N -2.93 2.05 -0.15 0.00 1.43 -0.20 -0.95 118.68 117.94 2aaz s LEU 48 Ca 0.11 -0.19 -0.08 0.00 -1.03 0.00 0.00 54.13 52.94 2aaz s LEU 48 Cb 0.06 -0.35 -0.04 0.00 0.03 0.00 0.00 46.19 45.88 2aaz s LEU 48 CO -0.07 0.05 0.13 0.12 0.23 0.00 0.00 176.35 176.81 2aaz s PHE 49 N -0.33 3.51 -1.25 0.29 5.36 -1.26 -1.53 117.98 122.77 2aaz s PHE 49 Ca 0.01 0.43 -0.12 0.00 -0.96 0.00 0.00 56.93 56.29 2aaz s PHE 49 Cb -0.04 -2.00 -0.00 0.00 -0.34 0.00 0.00 43.02 40.63 2aaz s PHE 49 CO -0.00 0.57 0.65 0.00 -1.46 0.00 0.00 175.22 174.97 2aaz n ALA 50 N 2.52 -2.32 -1.51 11.12 0.00 -0.03 -4.98 120.51 125.31 2aaz n ALA 50 Ca -0.19 -0.25 -0.29 0.00 0.00 0.00 0.00 53.44 52.70 2aaz n ALA 50 Cb 0.54 -2.97 0.11 0.00 0.00 0.00 0.00 19.45 17.13 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 -6.22 1.65 0.43 0.00 0.04 -1.26 -4.93 135.00 124.69 2aaz s PRO 51 Ca 0.27 0.52 -0.23 0.00 0.04 0.00 0.00 61.00 61.60 2aaz s PRO 51 Cb -0.10 -1.88 -0.11 0.00 0.04 0.00 0.00 34.50 32.45 2aaz s PRO 51 CO 0.87 -1.90 0.81 -2.30 0.04 0.00 0.00 177.00 174.52 2aaz n PRO 52 N -3.60 0.98 -1.42 0.56 -0.02 -1.26 -4.60 135.00 125.63 2aaz n PRO 52 Ca 0.07 0.36 -0.31 0.00 -2.02 0.00 0.00 63.50 61.59 2aaz n PRO 52 Cb 0.57 -1.82 0.07 0.00 -0.02 0.00 0.00 33.50 32.31 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 -0.86 4.94 0.09 2.55 1.04 -1.26 -4.87 113.70 115.32 2aaz s SER 53 Ca 0.64 1.73 -0.05 0.00 0.48 0.00 0.00 55.95 58.75 2aaz s SER 53 Cb -0.57 -2.51 -0.05 0.00 0.10 0.00 0.00 66.02 62.99 2aaz s SER 53 CO 0.57 -1.74 0.32 -0.36 0.98 0.00 0.00 173.24 173.00 2aaz s PHE 54 N -2.96 3.52 -0.05 5.02 0.08 -0.27 -4.92 117.98 118.39 2aaz s PHE 54 Ca 0.60 0.51 0.01 0.00 0.12 0.00 0.00 56.93 58.17 2aaz s PHE 54 Cb -0.16 -1.96 0.02 0.00 -0.57 0.00 0.00 43.02 40.35 2aaz s PHE 54 CO 0.55 0.52 -0.08 1.03 -0.10 0.00 0.00 175.22 177.14 2aaz s ARG 55 N -2.35 1.19 -0.05 0.44 0.52 -1.26 -1.03 118.95 116.40 2aaz s ARG 55 Ca 0.36 -0.23 0.02 0.00 -0.52 0.00 0.00 55.73 55.36 2aaz s ARG 55 Cb -0.13 -1.09 0.01 0.00 0.52 0.00 0.00 34.95 34.27 2aaz s ARG 55 CO 0.23 -0.05 -0.11 -0.06 0.02 0.00 0.00 175.30 175.33 2aaz s PHE 56 N 0.85 1.31 0.13 -0.53 0.08 -0.03 -4.98 117.98 114.81 2aaz s PHE 56 Ca -0.12 -0.44 -0.30 0.00 0.12 0.00 0.00 56.93 56.19 2aaz s PHE 56 Cb -0.15 -0.96 -0.06 0.00 -0.57 0.00 0.00 43.02 41.27 2aaz s PHE 56 CO 0.01 -0.23 0.99 0.45 -0.10 0.00 0.00 175.22 176.35 2aaz s SER 57 N 0.57 7.45 -0.00 1.36 0.15 -1.26 -1.11 113.70 120.86 2aaz s SER 57 Ca -0.12 1.87 0.10 0.00 0.70 0.00 0.00 55.95 58.50 2aaz s SER 57 Cb -0.14 -2.59 0.29 0.00 -1.71 0.00 0.00 66.02 61.87 2aaz s SER 57 CO 0.03 -0.10 1.24 0.18 1.20 0.00 0.00 173.24 175.79 2aaz n LEU 58 N 2.67 2.89 -4.78 3.45 4.77 0.33 -4.76 117.00 121.57 2aaz n LEU 58 Ca 0.02 -2.01 -0.31 0.00 -0.03 0.00 0.00 56.01 53.68 2aaz n LEU 58 Cb 0.48 -0.22 0.08 0.00 -2.33 0.00 0.00 43.42 41.43 2aaz n LEU 58 CO 0.52 0.72 0.71 0.00 -1.33 0.00 0.00 177.39 178.00 2aaz s ALA 59 N -1.03 2.37 -1.46 -1.18 0.00 -1.23 -3.54 121.76 115.70 2aaz s ALA 59 Ca 0.22 0.27 -0.11 0.00 0.00 0.00 0.00 51.96 52.33 2aaz s ALA 59 Cb 0.12 -3.26 0.05 0.00 0.00 0.00 0.00 23.12 20.03 2aaz s ALA 59 CO 0.15 -1.59 1.06 -0.25 0.00 0.00 0.00 175.76 175.13 2aaz n ASP 60 N -3.30 -5.36 -1.91 0.00 8.00 -1.26 -1.82 116.55 110.90 2aaz n ASP 60 Ca 0.09 -0.68 -0.18 0.00 0.71 0.00 0.00 54.79 54.73 2aaz n ASP 60 Cb 0.53 -4.37 -0.05 0.00 -0.02 0.00 0.00 41.12 37.22 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 -2.92 -4.94 -4.75 -2.24 4.13 -1.25 -4.89 115.26 98.40 2aaz n ASN 61 Ca 0.02 0.27 -0.41 0.00 1.68 0.00 0.00 54.58 56.15 2aaz n ASN 61 Cb 0.54 -4.30 -0.04 0.00 -1.54 0.00 0.00 39.78 34.45 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 -2.68 3.53 -0.23 3.41 2.01 -0.76 -0.05 115.64 120.86 2aaz s THR 62 Ca 0.00 1.40 0.02 0.00 0.31 0.00 0.00 61.69 63.42 2aaz s THR 62 Cb 0.00 -3.89 0.05 0.00 0.01 0.00 0.00 72.50 68.67 2aaz s THR 62 CO 0.00 0.28 -0.12 -0.22 -0.69 0.00 0.00 174.62 173.86 2aaz s LEU 63 N -0.82 2.97 -0.98 4.42 2.96 -0.61 -4.59 118.68 122.02 2aaz s LEU 63 Ca 0.49 -1.16 -0.15 0.00 -0.22 0.00 0.00 54.13 53.08 2aaz s LEU 63 Cb -0.32 -1.47 -0.09 0.00 0.50 0.00 0.00 46.19 44.80 2aaz s LEU 63 CO 0.39 -0.15 2.10 -0.81 -1.32 0.00 0.00 176.35 176.56 2aaz n PRO 64 N 4.52 2.03 -3.22 0.98 -0.04 -1.26 -3.79 135.00 134.22 2aaz n PRO 64 Ca -0.15 -1.89 -0.42 0.00 -0.04 0.00 0.00 63.50 60.99 2aaz n PRO 64 Cb 0.44 -2.85 -0.08 0.00 -0.04 0.00 0.00 33.50 30.98 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 0.99 4.50 0.25 1.53 2.96 -1.26 -4.29 118.68 123.35 2aaz s LEU 65 Ca 0.52 -0.25 -0.29 0.00 -0.22 0.00 0.00 54.13 53.88 2aaz s LEU 65 Cb 0.13 -2.58 -0.15 0.00 0.50 0.00 0.00 46.19 44.09 2aaz s LEU 65 CO 0.03 -0.59 0.94 0.18 -1.32 0.00 0.00 176.35 175.59 2aaz n LEU 66 N 5.86 1.12 -0.00 -0.68 4.77 -1.26 -4.72 117.00 122.08 2aaz n LEU 66 Ca -0.04 1.16 0.06 0.00 -0.03 0.00 0.00 56.01 57.16 2aaz n LEU 66 Cb 0.48 -1.20 -0.08 0.00 -2.33 0.00 0.00 43.42 40.29 2aaz n LEU 66 CO 0.48 -1.71 -0.30 0.35 -1.33 0.00 0.00 177.39 174.88 2aaz n THR 67 N 0.40 0.00 1.26 -5.08 -2.24 -1.26 -4.47 114.28 102.88 2aaz n THR 67 Ca 0.12 -0.25 0.10 0.00 -2.27 0.00 0.00 64.05 61.76 2aaz n THR 67 Cb 0.29 0.66 0.59 0.00 -2.10 0.00 0.00 70.33 69.78 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 -1.56 0.00 -3.47 4.28 -2.24 -1.26 -0.70 114.28 109.33 2aaz n THR 68 Ca 0.00 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.63 2aaz n THR 68 Cb 0.24 -0.68 -0.04 0.00 -2.10 0.00 0.00 70.33 67.75 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 1.17 -0.13 -0.78 -2.85 -1.26 -4.65 119.74 109.24 2aaz s LYS 69 Ca 0.30 -0.12 -0.29 0.00 -1.00 0.00 0.00 55.97 54.85 2aaz s LYS 69 Cb 0.14 0.55 -0.02 0.00 -2.06 0.00 0.00 37.83 36.44 2aaz s LYS 69 CO 0.23 -0.45 1.24 0.50 0.10 0.00 0.00 175.35 176.98 2aaz s ARG 70 N -2.53 4.27 -0.15 1.78 3.52 -1.09 -4.56 118.95 120.19 2aaz s ARG 70 Ca -0.05 1.66 -0.08 0.00 -0.13 0.00 0.00 55.73 57.14 2aaz s ARG 70 Cb -0.01 -3.70 -0.04 0.00 -1.56 0.00 0.00 34.95 29.64 2aaz s ARG 70 CO -0.02 -0.63 0.14 0.08 -0.81 0.00 0.00 175.30 174.05 2aaz s VAL 71 N 3.13 5.47 -1.11 7.11 1.01 -1.26 -4.76 120.40 129.99 2aaz s VAL 71 Ca 0.55 0.20 -0.22 0.00 0.00 0.00 0.00 61.98 62.51 2aaz s VAL 71 Cb -0.22 -3.42 -0.08 0.00 0.00 0.00 0.00 36.38 32.66 2aaz s VAL 71 CO 0.17 0.56 1.92 0.33 0.00 0.00 0.00 175.10 178.07 2aaz n PHE 72 N 2.47 2.81 -0.17 5.22 -0.00 -1.26 -4.79 117.46 121.75 2aaz n PHE 72 Ca -0.19 -1.78 -0.01 0.00 -0.00 0.00 0.00 57.45 55.47 2aaz n PHE 72 Cb 0.54 -2.41 0.08 0.00 -0.00 0.00 0.00 39.48 37.69 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 15.85 -0.15 -1.42 -2.13 5.85 -2.00 -1.21 115.31 130.10 2aaz h LEU 73 Ca 0.31 0.12 0.04 0.00 0.84 0.00 0.00 57.88 59.19 2aaz h LEU 73 Cb 0.85 0.20 -0.04 0.00 0.37 0.00 0.00 40.66 42.04 2aaz h LEU 73 CO 1.46 -0.05 0.43 -0.09 -0.34 0.00 0.00 178.44 179.85 2aaz h ARG 74 N 0.16 0.72 -0.35 1.25 2.43 -2.00 -0.96 114.38 115.63 2aaz h ARG 74 Ca 0.28 -0.04 -0.11 0.00 -0.81 0.00 0.00 59.98 59.29 2aaz h ARG 74 Cb 0.42 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 2aaz h ARG 74 CO -0.42 0.48 -0.24 0.78 -1.51 0.00 0.00 179.97 179.05 2aaz h GLY 75 N 0.75 0.77 0.79 2.80 0.00 -1.64 -0.33 103.07 106.21 2aaz h GLY 75 Ca 0.26 -0.66 -0.00 0.00 0.00 0.00 0.00 47.33 46.93 2aaz h GLY 75 CO -0.08 0.60 -0.05 -2.08 0.00 0.00 0.00 176.54 174.94 2aaz h VAL 76 N 0.61 1.03 -0.09 4.60 2.07 -0.68 -1.18 116.25 122.62 2aaz h VAL 76 Ca 0.08 -0.47 0.02 0.00 0.82 0.00 0.00 66.70 67.15 2aaz h VAL 76 Cb 0.74 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 2aaz h VAL 76 CO 0.06 0.12 -0.01 0.40 0.02 0.00 0.00 177.57 178.15 2aaz h ILE 77 N -0.34 0.93 -0.28 4.57 2.04 -1.14 -1.31 117.51 121.97 2aaz h ILE 77 Ca -0.01 -0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.89 2aaz h ILE 77 Cb 0.29 0.91 -0.04 0.00 -0.74 0.00 0.00 36.82 37.24 2aaz h ILE 77 CO 0.02 0.00 0.02 0.00 0.00 0.00 0.00 178.15 178.20 2aaz h ALA 78 N 1.08 0.27 -0.84 1.87 0.00 -1.00 -1.02 119.26 119.61 2aaz h ALA 78 Ca 0.04 0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.04 2aaz h ALA 78 Cb 0.06 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 2aaz h ALA 78 CO -0.08 -0.39 0.55 1.49 0.00 0.00 0.00 179.25 180.82 2aaz h GLU 79 N 0.11 1.06 -0.29 0.00 4.81 -1.02 -1.48 114.58 117.78 2aaz h GLU 79 Ca 0.13 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.28 2aaz h GLU 79 Cb 0.16 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 2aaz h GLU 79 CO -0.20 0.70 0.10 1.25 -0.73 0.00 0.00 179.01 180.13 2aaz h LEU 80 N 1.09 0.42 -1.61 1.64 5.85 -0.63 0.05 115.31 122.12 2aaz h LEU 80 Ca 0.32 -0.19 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 2aaz h LEU 80 Cb -0.05 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.86 2aaz h LEU 80 CO -0.09 0.50 -0.19 -0.07 -0.34 0.00 0.00 178.44 178.25 2aaz h LEU 81 N 0.31 0.00 -0.09 2.25 3.38 -1.03 -0.69 115.31 119.44 2aaz h LEU 81 Ca 0.09 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 2aaz h LEU 81 Cb 0.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 2aaz h LEU 81 CO -0.00 0.19 -0.14 -0.25 0.09 0.00 0.00 178.44 178.32 2aaz h TRP 82 N 0.00 0.31 0.25 1.13 7.01 -0.75 -1.71 115.95 122.19 2aaz h TRP 82 Ca -0.00 -0.11 0.01 0.00 2.11 0.00 0.00 58.89 60.90 2aaz h TRP 82 Cb 0.49 -0.06 -0.03 0.00 -2.10 0.00 0.00 29.16 27.46 2aaz h TRP 82 CO 0.00 0.73 -0.31 0.74 -2.79 0.00 0.00 178.44 176.81 2aaz h PHE 83 N -0.19 -0.84 -0.92 2.65 0.04 -0.27 -2.51 116.94 114.90 2aaz h PHE 83 Ca 0.01 0.01 0.19 0.00 2.80 0.00 0.00 57.97 60.98 2aaz h PHE 83 Cb 0.70 0.34 -0.11 0.00 2.20 0.00 0.00 35.95 39.08 2aaz h PHE 83 CO 0.10 -0.44 0.49 0.28 -0.60 0.00 0.00 178.31 178.14 2aaz h VAL 84 N -0.62 0.63 0.00 -0.55 2.07 -1.15 0.17 116.25 116.80 2aaz h VAL 84 Ca -0.00 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.31 2aaz h VAL 84 Cb 0.59 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 2aaz h VAL 84 CO -0.10 0.11 0.00 0.77 0.02 0.00 0.00 177.57 178.37 2aaz h SER 85 N 0.60 0.00 0.00 0.57 4.64 -0.87 -3.46 113.55 115.03 2aaz h SER 85 Ca 0.54 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.86 2aaz h SER 85 Cb 0.89 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.98 2aaz h SER 85 CO -0.42 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.15 2aaz n GLY 86 N -0.34 0.78 3.77 -0.77 0.00 0.59 -5.01 105.19 104.20 2aaz n GLY 86 Ca 0.01 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 0.17 0.85 -3.31 0.00 -2.24 -1.26 -4.54 114.28 103.95 2aaz n THR 88 Ca 0.04 -0.93 -0.42 0.00 -2.27 0.00 0.00 64.05 60.47 2aaz n THR 88 Cb 0.47 0.46 -0.09 0.00 -2.10 0.00 0.00 70.33 69.08 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 -1.17 6.22 0.62 3.42 3.68 -1.26 -2.58 116.67 125.61 2aaz s ASP 89 Ca 0.07 -0.40 0.39 0.00 2.13 0.00 0.00 52.55 54.74 2aaz s ASP 89 Cb 0.06 -2.23 2.03 0.00 -1.45 0.00 0.00 42.92 41.33 2aaz s ASP 89 CO 0.01 -0.51 2.24 0.00 0.13 0.00 0.00 175.17 177.04 2aaz h ALA 90 N 8.61 1.07 0.00 3.66 0.00 -1.21 -1.78 119.26 129.61 2aaz h ALA 90 Ca -0.28 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 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 0.77 0.02 -0.03 0.87 0.00 0.00 0.00 179.25 180.87 2aaz h LYS 91 N 0.00 0.00 0.00 0.00 1.79 -1.89 0.59 116.57 117.06 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 0.16 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.81 2aaz h LYS 91 CO 0.00 0.03 0.00 0.52 -1.08 0.00 0.00 179.45 178.93 2aaz h MET 92 N 0.00 0.00 0.03 3.15 2.86 -1.71 -0.71 114.93 118.55 2aaz h MET 92 Ca -0.00 0.00 -0.37 0.00 -2.06 0.00 0.00 59.70 57.27 2aaz h MET 92 Cb 0.20 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.81 2aaz h MET 92 CO 0.00 0.00 -2.07 1.28 1.06 0.00 0.00 176.91 177.18 2aaz n LEU 93 N -2.86 2.29 0.22 1.22 4.77 0.11 -4.17 117.00 118.58 2aaz n LEU 93 Ca 0.01 0.24 0.06 0.00 -0.03 0.00 0.00 56.01 56.29 2aaz n LEU 93 Cb 0.31 -0.94 0.52 0.00 -2.33 0.00 0.00 43.42 40.97 2aaz n LEU 93 CO 0.26 0.63 0.87 0.77 -1.33 0.00 0.00 177.39 178.59 2aaz h SER 94 N -0.57 0.00 0.82 -1.43 4.64 -0.38 1.00 113.55 117.63 2aaz h SER 94 Ca -0.53 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.78 2aaz h SER 94 Cb 1.68 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.76 2aaz h SER 94 CO -0.19 0.21 -0.08 0.77 -0.87 0.00 0.00 176.83 176.68 2aaz h SER 95 N 0.00 0.00 -0.41 4.97 4.64 -1.31 -1.79 113.55 119.65 2aaz h SER 95 Ca -0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.29 2aaz h SER 95 Cb 0.40 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 2aaz h SER 95 CO 0.03 0.08 0.02 0.00 -0.87 0.00 0.00 176.83 176.08 2aaz n GLN 96 N -3.24 3.62 -1.09 4.77 10.64 -0.63 -4.94 117.38 126.51 2aaz n GLN 96 Ca -0.00 -2.99 0.00 0.00 -1.83 0.00 0.00 57.00 52.18 2aaz n GLN 96 Cb 0.31 -2.02 0.00 0.00 -0.86 0.00 0.00 30.24 27.67 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 -0.13 0.42 3.09 2.61 0.00 -0.67 -5.04 105.19 105.47 2aaz n GLY 97 Ca 0.26 -1.02 -0.32 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.00 2.29 -0.20 1.61 1.01 0.25 -4.98 120.40 118.38 2aaz s VAL 98 Ca 0.00 -1.55 0.16 0.00 0.00 0.00 0.00 61.98 60.59 2aaz s VAL 98 Cb 0.00 -2.32 0.59 0.00 0.00 0.00 0.00 36.38 34.66 2aaz s VAL 98 CO 0.00 -0.00 1.50 0.61 0.00 0.00 0.00 175.10 177.21 2aaz n GLY 99 N 4.47 3.87 0.30 4.51 0.00 -1.26 -1.67 105.19 115.41 2aaz n GLY 99 Ca -0.14 -1.03 0.14 0.00 0.00 0.00 0.00 46.02 44.98 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 2.21 0.66 -0.40 -0.61 3.07 -1.95 -1.53 117.51 118.96 2aaz h ILE 100 Ca 0.01 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.42 2aaz h ILE 100 Cb 1.58 0.96 0.00 0.00 -0.27 0.00 0.00 36.82 39.09 2aaz h ILE 100 CO 0.29 0.00 0.00 0.79 -1.05 0.00 0.00 178.15 178.18 2aaz n TRP 101 N -4.06 0.52 -0.01 0.16 7.02 -1.26 -4.46 117.44 115.34 2aaz n TRP 101 Ca -0.01 -0.32 -0.02 0.00 -1.02 0.00 0.00 57.50 56.13 2aaz n TRP 101 Cb 0.16 -0.01 0.25 0.00 -2.42 0.00 0.00 31.31 29.29 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 3.65 0.53 -0.34 -0.99 3.45 -1.60 -1.80 116.42 119.31 2aaz h ASP 102 Ca 0.00 -0.12 -0.02 0.00 0.43 0.00 0.00 57.03 57.32 2aaz h ASP 102 Cb 0.87 -0.14 -0.02 0.00 -0.56 0.00 0.00 39.33 39.49 2aaz h ASP 102 CO 0.00 0.64 0.15 1.23 -1.57 0.00 0.00 179.24 179.69 2aaz h GLY 103 N 0.90 0.54 0.29 2.75 0.00 -1.78 -1.56 103.07 104.22 2aaz h GLY 103 Ca 0.10 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.15 2aaz h GLY 103 CO 0.02 0.27 -0.19 0.70 0.00 0.00 0.00 176.54 177.34 2aaz n ASN 104 N -4.71 0.96 -0.55 0.19 4.13 -1.19 -3.71 115.26 110.38 2aaz n ASN 104 Ca -0.01 -0.90 0.09 0.00 1.68 0.00 0.00 54.58 55.43 2aaz n ASN 104 Cb 0.13 0.07 0.04 0.00 -1.54 0.00 0.00 39.78 38.48 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 1.30 0.17 3.75 7.41 0.00 -0.68 -4.53 105.19 112.61 2aaz n GLY 105 Ca 0.14 -0.50 -0.37 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.71 5.31 0.32 1.61 1.04 -0.60 -0.14 113.70 119.53 2aaz s SER 106 Ca 0.17 2.48 0.05 0.00 0.48 0.00 0.00 55.95 59.13 2aaz s SER 106 Cb 0.14 -2.61 0.67 0.00 0.10 0.00 0.00 66.02 64.32 2aaz s SER 106 CO 0.32 -1.52 1.87 0.50 0.98 0.00 0.00 173.24 175.39 2aaz h LYS 107 N 1.16 0.84 -0.50 4.02 1.63 -1.93 -1.03 116.57 120.75 2aaz h LYS 107 Ca -0.50 -0.05 -0.03 0.00 -0.85 0.00 0.00 60.65 59.21 2aaz h LYS 107 Cb 1.29 -0.19 -0.02 0.00 -0.60 0.00 0.00 32.23 32.71 2aaz h LYS 107 CO 0.56 0.55 0.18 0.93 -3.45 0.00 0.00 179.45 178.22 2aaz h GLU 108 N 0.86 0.77 -0.12 1.90 5.08 -1.95 -2.31 114.58 118.80 2aaz h GLU 108 Ca 0.44 -0.15 -0.07 0.00 -1.00 0.00 0.00 59.36 58.58 2aaz h GLU 108 Cb 0.51 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.64 2aaz h GLU 108 CO -0.21 0.70 -0.20 0.35 -1.00 0.00 0.00 179.01 178.65 2aaz h PHE 109 N 0.68 0.43 -0.38 4.33 3.57 -1.64 -2.40 116.94 121.52 2aaz h PHE 109 Ca 0.16 -0.15 0.06 0.00 3.53 0.00 0.00 57.97 61.58 2aaz h PHE 109 Cb 0.23 -0.08 -0.06 0.00 2.79 0.00 0.00 35.95 38.83 2aaz h PHE 109 CO 0.01 0.81 0.03 -0.07 -2.23 0.00 0.00 178.31 176.86 2aaz h LEU 110 N -0.07 -0.09 -1.42 0.59 3.38 -1.22 -0.16 115.31 116.33 2aaz h LEU 110 Ca 0.01 0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 2aaz h LEU 110 Cb 0.78 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 2aaz h LEU 110 CO 0.05 -0.01 -0.03 -0.33 0.09 0.00 0.00 178.44 178.21 2aaz h GLU 111 N 0.14 0.35 -0.57 1.13 5.08 -1.45 0.42 114.58 119.68 2aaz h GLU 111 Ca 0.18 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 2aaz h GLU 111 Cb 0.24 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 2aaz h GLU 111 CO -0.28 0.40 0.18 -0.22 -1.00 0.00 0.00 179.01 178.09 2aaz h LYS 112 N 0.34 0.85 -0.68 2.33 3.64 -0.54 -2.71 116.57 119.80 2aaz h LYS 112 Ca 0.08 -0.15 -0.06 0.00 -1.27 0.00 0.00 60.65 59.25 2aaz h LYS 112 Cb 0.27 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.92 2aaz h LYS 112 CO 0.01 0.73 0.07 1.33 -2.27 0.00 0.00 179.45 179.32 2aaz n VAL 113 N -4.30 2.49 -1.19 2.00 0.24 -0.52 -4.91 118.33 112.14 2aaz n VAL 113 Ca 0.04 -1.28 -0.02 0.00 -2.04 0.00 0.00 64.34 61.04 2aaz n VAL 113 Cb 0.20 -0.34 -0.01 0.00 -1.47 0.00 0.00 33.84 32.22 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 0.36 0.53 2.18 7.63 0.00 -1.02 -4.95 105.19 109.92 2aaz n GLY 114 Ca 0.28 -0.95 -0.26 0.00 0.00 0.00 0.00 46.02 45.09 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 -0.29 5.19 0.26 0.99 4.77 0.14 -4.78 117.00 123.28 2aaz n LEU 115 Ca -0.03 -4.82 0.17 0.00 -0.03 0.00 0.00 56.01 51.30 2aaz n LEU 115 Cb 0.14 -0.44 0.80 0.00 -2.33 0.00 0.00 43.42 41.58 2aaz n LEU 115 CO 0.04 2.08 1.01 1.23 -1.33 0.00 0.00 177.39 180.41 2aaz h GLY 116 N 2.28 0.00 1.14 -0.72 0.00 -1.81 -2.68 103.07 101.28 2aaz h GLY 116 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 2aaz h GLY 116 CO 0.87 0.00 0.00 -2.39 0.00 0.00 0.00 176.54 175.02 2aaz n HIS 117 N -2.85 0.00 -3.93 5.60 1.44 -1.26 -4.81 115.22 109.41 2aaz n HIS 117 Ca -0.00 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.41 2aaz n HIS 117 Cb 0.19 -0.07 -0.04 0.00 0.12 0.00 0.00 29.99 30.20 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 -2.14 3.44 0.57 -1.40 0.52 -1.01 -5.09 118.95 113.85 2aaz s ARG 118 Ca 0.39 -0.48 -0.15 0.00 -0.52 0.00 0.00 55.73 54.97 2aaz s ARG 118 Cb 0.20 -3.02 -0.05 0.00 0.52 0.00 0.00 34.95 32.59 2aaz s ARG 118 CO 0.35 0.59 1.02 -0.98 0.02 0.00 0.00 175.30 176.30 2aaz s ARG 119 N -2.70 3.62 0.23 3.54 1.70 -1.26 -4.95 118.95 119.12 2aaz s ARG 119 Ca 0.35 1.01 -0.31 0.00 -0.47 0.00 0.00 55.73 56.31 2aaz s ARG 119 Cb -0.12 -2.08 -0.14 0.00 -0.57 0.00 0.00 34.95 32.03 2aaz s ARG 119 CO 0.28 -0.55 1.38 -1.91 -1.08 0.00 0.00 175.30 173.42 2aaz n GLU 120 N -1.99 1.91 0.00 3.89 2.13 -1.26 -1.90 120.64 123.42 2aaz n GLU 120 Ca 0.07 0.68 0.00 0.00 0.66 0.00 0.00 57.16 58.57 2aaz n GLU 120 Cb 0.54 -2.32 0.00 0.00 0.27 0.00 0.00 31.44 29.93 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 2.17 2.44 3.52 8.31 0.00 0.80 -4.86 105.19 117.57 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 -1.54 6.42 0.50 1.61 -1.08 -0.80 -0.60 116.67 121.19 2aaz s ASP 122 Ca 0.00 -1.33 0.31 0.00 -0.52 0.00 0.00 52.55 51.01 2aaz s ASP 122 Cb 0.00 -2.51 1.20 0.00 -1.46 0.00 0.00 42.92 40.15 2aaz s ASP 122 CO 0.00 -1.46 1.91 -0.07 0.52 0.00 0.00 175.17 176.07 2aaz h LEU 123 N 12.12 0.00 0.00 -1.34 3.38 -1.82 -3.46 115.31 124.19 2aaz h LEU 123 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2aaz h LEU 123 Cb 1.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.78 2aaz h LEU 123 CO 1.30 0.00 0.00 0.61 0.09 0.00 0.00 178.44 180.44 2aaz n GLY 124 N 0.17 -1.54 2.52 0.83 0.00 -1.26 -1.05 105.19 104.86 2aaz n GLY 124 Ca 0.01 -2.07 -0.32 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 2.81 -0.32 1.61 -0.04 -1.26 -4.79 135.00 133.01 2aaz n PRO 125 Ca 0.00 -1.90 -0.01 0.00 -0.04 0.00 0.00 63.50 61.55 2aaz n PRO 125 Cb 0.00 -2.70 0.01 0.00 -0.04 0.00 0.00 33.50 30.77 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 4.12 0.00 0.00 0.52 0.24 -1.26 -4.46 118.33 117.49 2aaz n VAL 126 Ca 0.60 -0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.86 2aaz n VAL 126 Cb 0.21 -1.73 0.00 0.00 -1.47 0.00 0.00 33.84 30.86 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 -1.80 0.00 -0.32 6.34 4.01 -1.26 -0.65 117.16 123.48 2aaz n TYR 127 Ca 0.01 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.89 2aaz n TYR 127 Cb 0.02 0.00 0.33 0.00 -0.31 0.00 0.00 39.34 39.38 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 1.68 0.94 2.72 0.00 -1.80 -0.68 103.07 105.93 2aaz h GLY 128 Ca 0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 47.33 47.06 2aaz h GLY 128 CO 0.00 -0.22 0.14 -2.75 0.00 0.00 0.00 176.54 173.70 2aaz h PHE 129 N 0.51 0.63 -0.63 5.60 3.04 -0.88 -2.32 116.94 122.90 2aaz h PHE 129 Ca 0.58 -0.06 -0.09 0.00 3.98 0.00 0.00 57.97 62.38 2aaz h PHE 129 Cb 1.07 -0.19 -0.02 0.00 2.56 0.00 0.00 35.95 39.37 2aaz h PHE 129 CO -0.07 0.58 0.03 1.96 -2.02 0.00 0.00 178.31 178.78 2aaz h GLN 130 N 0.50 1.09 -0.87 1.11 1.08 -1.03 0.36 115.11 117.36 2aaz h GLN 130 Ca 0.13 -0.33 0.03 0.00 -1.45 0.00 0.00 58.65 57.03 2aaz h GLN 130 Cb 0.24 -0.11 -0.05 0.00 -0.05 0.00 0.00 27.48 27.51 2aaz h GLN 130 CO -0.01 1.04 0.56 -1.49 -0.95 0.00 0.00 178.83 177.99 2aaz h TRP 131 N 1.00 1.06 0.00 2.96 4.06 -1.01 -2.42 115.95 121.60 2aaz h TRP 131 Ca 0.18 0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.16 2aaz h TRP 131 Cb 0.53 -0.35 0.00 0.00 -1.00 0.00 0.00 29.16 28.34 2aaz h TRP 131 CO 0.04 0.62 -1.12 0.54 -3.56 0.00 0.00 178.44 174.95 2aaz n ARG 132 N -4.53 1.48 -1.81 0.49 5.12 -0.89 -1.35 116.66 115.18 2aaz n ARG 132 Ca 0.10 -0.06 0.03 0.00 -1.93 0.00 0.00 57.85 55.99 2aaz n ARG 132 Cb 0.07 -1.24 0.03 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 -1.64 0.29 -1.62 -1.55 8.25 0.13 -3.54 115.22 115.53 2aaz n HIS 133 Ca 0.00 -0.89 -0.52 0.00 -0.26 0.00 0.00 57.72 56.06 2aaz n HIS 133 Cb 0.29 -0.16 -0.06 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 0.23 1.70 0.00 4.41 -0.00 -0.91 -1.09 117.46 121.80 2aaz n PHE 134 Ca 0.06 0.56 0.00 0.00 -0.00 0.00 0.00 57.45 58.07 2aaz n PHE 134 Cb 1.06 -2.38 0.00 0.00 -0.00 0.00 0.00 39.48 38.16 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 2.87 3.36 3.74 7.13 0.00 -1.26 -0.37 105.19 120.65 2aaz n GLY 135 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.58 2.08 -0.08 4.61 0.00 -0.25 -4.90 121.76 120.63 2aaz s ALA 136 Ca 0.00 0.47 -0.27 0.00 0.00 0.00 0.00 51.96 52.15 2aaz s ALA 136 Cb 0.00 -3.35 -0.02 0.00 0.00 0.00 0.00 23.12 19.75 2aaz s ALA 136 CO 0.00 -1.95 0.90 -2.00 0.00 0.00 0.00 175.76 172.71 2aaz s GLU 137 N -4.59 4.43 -0.15 0.00 2.12 -1.26 -5.02 118.70 114.24 2aaz s GLU 137 Ca 0.65 1.21 -0.15 0.00 0.36 0.00 0.00 54.97 57.04 2aaz s GLU 137 Cb -0.20 -3.51 -0.05 0.00 0.26 0.00 0.00 34.13 30.63 2aaz s GLU 137 CO 0.53 -0.17 0.33 -0.47 -0.54 0.00 0.00 175.26 174.94 2aaz s TYR 138 N 1.52 3.48 0.00 5.30 5.04 -1.26 -4.98 117.35 126.44 2aaz s TYR 138 Ca 0.45 0.66 0.00 0.00 -2.44 0.00 0.00 57.07 55.74 2aaz s TYR 138 Cb -0.19 -2.38 0.00 0.00 0.35 0.00 0.00 41.96 39.74 2aaz s TYR 138 CO 0.19 0.23 0.00 0.25 -1.34 0.00 0.00 175.55 174.89 2aaz n THR 139 N 3.56 0.00 -3.97 4.34 -2.24 -1.26 -5.08 114.28 109.62 2aaz n THR 139 Ca -0.11 0.16 -0.07 0.00 -2.27 0.00 0.00 64.05 61.77 2aaz n THR 139 Cb 0.52 -1.10 -0.02 0.00 -2.10 0.00 0.00 70.33 67.63 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 -1.86 -0.36 0.06 3.42 3.85 -1.26 -5.04 116.55 115.36 2aaz n ASP 140 Ca 0.00 -1.78 0.11 0.00 -0.71 0.00 0.00 54.79 52.40 2aaz n ASP 140 Cb 0.00 0.76 0.43 0.00 -1.35 0.00 0.00 41.12 40.96 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 -2.14 1.85 1.20 2.12 0.00 -1.26 -2.65 120.51 119.63 2aaz n ALA 141 Ca -0.05 -0.01 0.13 0.00 0.00 0.00 0.00 53.44 53.51 2aaz n ALA 141 Cb 0.22 -1.35 0.27 0.00 0.00 0.00 0.00 19.45 18.59 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 -1.86 1.58 -4.64 0.00 10.43 -1.26 -4.81 116.55 115.99 2aaz n ASP 142 Ca 0.04 -1.28 -0.36 0.00 2.57 0.00 0.00 54.79 55.76 2aaz n ASP 142 Cb 0.25 0.19 0.09 0.00 1.84 0.00 0.00 41.12 43.49 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 1.33 -0.25 3.45 0.44 0.00 -1.09 -4.94 105.19 104.13 2aaz n GLY 143 Ca 0.13 -0.33 -0.44 0.00 0.00 0.00 0.00 46.02 45.38 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 -4.87 116.67 118.86 2aaz s ASP 144 Ca 0.75 -0.90 0.11 0.00 0.43 0.00 0.00 52.55 52.94 2aaz s ASP 144 Cb -0.34 -2.30 0.12 0.00 -0.30 0.00 0.00 42.92 40.09 2aaz s ASP 144 CO 0.49 -0.93 0.91 -1.22 -0.17 0.00 0.00 175.17 174.25 2aaz n TYR 145 N 6.29 0.05 -1.66 -5.34 4.01 -1.26 -4.96 117.16 114.29 2aaz n TYR 145 Ca -0.06 -0.05 -0.49 0.00 -0.16 0.00 0.00 57.90 57.13 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 0.64 1.80 -0.96 -0.72 4.81 -1.26 -0.27 118.16 122.20 2aaz n LYS 146 Ca 0.07 0.65 0.00 0.00 -0.87 0.00 0.00 58.31 58.17 2aaz n LYS 146 Cb 0.30 -2.40 0.00 0.00 0.02 0.00 0.00 35.03 32.95 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 3.50 0.45 3.61 3.14 0.00 -1.26 -5.01 105.19 109.62 2aaz n GLY 147 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.50 2.63 0.17 1.61 1.02 0.63 -5.02 119.74 120.27 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 -2.55 0.00 0.00 -0.52 0.00 0.00 37.83 34.76 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 1.64 -2.21 3.67 -3.33 0.00 -1.26 -4.39 105.19 99.30 2aaz n GLY 149 Ca -0.16 -1.50 -0.39 0.00 0.00 0.00 0.00 46.02 43.98 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 -0.93 5.12 -1.05 1.61 1.01 0.50 -4.74 120.40 121.91 2aaz s VAL 150 Ca 0.00 0.95 -0.16 0.00 0.00 0.00 0.00 61.98 62.77 2aaz s VAL 150 Cb 0.00 -3.84 0.15 0.00 0.00 0.00 0.00 36.38 32.70 2aaz s VAL 150 CO 0.00 0.21 1.26 -0.62 0.00 0.00 0.00 175.10 175.94 2aaz s ASP 151 N 1.04 6.84 0.26 3.32 3.68 -1.23 -2.19 116.67 128.39 2aaz s ASP 151 Ca 0.24 -2.50 -0.04 0.00 2.13 0.00 0.00 52.55 52.38 2aaz s ASP 151 Cb -0.15 -2.39 0.32 0.00 -1.45 0.00 0.00 42.92 39.24 2aaz s ASP 151 CO 0.10 -0.90 1.91 1.56 0.13 0.00 0.00 175.17 177.97 2aaz h GLN 152 N 8.03 1.18 -0.00 4.34 4.20 -1.48 -2.53 115.11 128.86 2aaz h GLN 152 Ca 0.23 -0.11 -0.00 0.00 0.06 0.00 0.00 58.65 58.83 2aaz h GLN 152 Cb 0.96 -0.25 -0.00 0.00 0.30 0.00 0.00 27.48 28.49 2aaz h GLN 152 CO 1.16 0.83 0.00 1.25 -0.67 0.00 0.00 178.83 181.40 2aaz h LEU 153 N 1.20 0.00 -1.14 1.46 5.85 -1.84 -0.61 115.31 120.24 2aaz h LEU 153 Ca 0.31 -0.12 -0.06 0.00 0.84 0.00 0.00 57.88 58.85 2aaz h LEU 153 Cb -0.05 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 2aaz h LEU 153 CO -0.06 0.13 -0.04 -0.61 -0.34 0.00 0.00 178.44 177.52 2aaz h GLN 154 N -0.12 0.55 -0.70 1.25 5.75 -1.87 -1.90 115.11 118.08 2aaz h GLN 154 Ca 0.00 -0.14 -0.05 0.00 -0.15 0.00 0.00 58.65 58.32 2aaz h GLN 154 Cb 0.12 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 28.57 2aaz h GLN 154 CO -0.00 0.61 0.24 -0.09 -2.65 0.00 0.00 178.83 176.94 2aaz h ARG 155 N 0.52 1.07 -0.57 1.69 9.65 -1.16 -0.32 114.38 125.26 2aaz h ARG 155 Ca 0.11 -0.21 -0.01 0.00 -1.10 0.00 0.00 59.98 58.77 2aaz h ARG 155 Cb 0.40 -0.17 -0.03 0.00 -1.39 0.00 0.00 29.97 28.79 2aaz h ARG 155 CO 0.02 0.89 0.33 0.28 2.80 0.00 0.00 179.97 184.29 2aaz h VAL 156 N 1.03 1.18 0.06 0.20 2.07 -0.41 -0.09 116.25 120.29 2aaz h VAL 156 Ca 0.23 -0.43 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 2aaz h VAL 156 Cb 0.26 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 2aaz h VAL 156 CO -0.01 0.19 -0.03 0.40 0.02 0.00 0.00 177.57 178.14 2aaz h ILE 157 N 0.77 0.98 -0.91 4.57 1.08 -0.77 -1.39 117.51 121.84 2aaz h ILE 157 Ca 0.20 -0.15 0.01 0.00 -0.39 0.00 0.00 64.86 64.53 2aaz h ILE 157 Cb 0.02 1.08 -0.05 0.00 -3.07 0.00 0.00 36.82 34.81 2aaz h ILE 157 CO -0.03 0.04 0.60 0.44 -0.69 0.00 0.00 178.15 178.50 2aaz h ASP 158 N -0.15 1.03 -0.35 1.72 3.45 -0.91 -2.37 116.42 118.84 2aaz h ASP 158 Ca -0.01 -0.02 -0.14 0.00 0.43 0.00 0.00 57.03 57.29 2aaz h ASP 158 Cb 0.13 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 38.63 2aaz h ASP 158 CO 0.01 0.74 -0.30 0.74 -1.57 0.00 0.00 179.24 178.87 2aaz h THR 159 N 1.22 1.27 -0.74 0.35 2.02 -0.86 -0.55 112.91 115.62 2aaz h THR 159 Ca 0.34 -1.46 -0.06 0.00 0.77 0.00 0.00 66.41 66.00 2aaz h THR 159 Cb -0.12 1.28 -0.03 0.00 -1.74 0.00 0.00 68.15 67.54 2aaz h THR 159 CO -0.08 0.49 0.24 0.40 0.37 0.00 0.00 175.52 176.93 2aaz h ILE 160 N 0.74 1.26 -0.03 3.11 2.04 -0.99 0.19 117.51 123.83 2aaz h ILE 160 Ca 0.08 -0.89 -0.26 0.00 1.00 0.00 0.00 64.86 64.79 2aaz h ILE 160 Cb 0.86 0.44 0.02 0.00 -0.74 0.00 0.00 36.82 37.40 2aaz h ILE 160 CO 0.08 0.35 -0.98 0.11 0.00 0.00 0.00 178.15 177.70 2aaz h LYS 161 N 1.09 0.70 0.00 2.37 1.57 -1.30 -3.31 116.57 117.70 2aaz h LYS 161 Ca 0.24 -0.71 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 2aaz h LYS 161 Cb 0.30 0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.80 2aaz h LYS 161 CO -0.01 1.30 -1.26 0.09 -0.57 0.00 0.00 179.45 179.00 2aaz n ASN 162 N -3.86 1.14 -2.83 0.86 3.02 -0.23 -4.78 115.26 108.58 2aaz n ASN 162 Ca -0.10 -0.38 -0.11 0.00 -0.03 0.00 0.00 54.58 53.96 2aaz n ASN 162 Cb 0.85 1.39 0.05 0.00 -0.61 0.00 0.00 39.78 41.46 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 -1.73 -1.90 -0.15 6.41 5.15 0.61 -5.02 115.26 118.62 2aaz n ASN 163 Ca -0.00 -3.42 0.23 0.00 -0.60 0.00 0.00 54.58 50.79 2aaz n ASN 163 Cb 0.33 1.38 0.65 0.00 -0.53 0.00 0.00 39.78 41.60 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 -0.00 1.20 0.13 -1.48 -1.42 132.00 133.91 2aaz h PRO 164 Ca -0.08 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 2aaz h PRO 164 Cb 1.05 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2aaz h PRO 164 CO 0.26 0.08 0.00 0.25 -0.23 0.00 0.00 178.00 178.36 2aaz n THR 165 N -4.37 0.00 -1.63 1.56 -2.24 -1.26 -4.23 114.28 102.11 2aaz n THR 165 Ca 0.16 -0.05 -0.39 0.00 -2.27 0.00 0.00 64.05 61.51 2aaz n THR 165 Cb 0.79 -0.31 0.04 0.00 -2.10 0.00 0.00 70.33 68.75 2aaz n THR 165 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2aaz n ASP 166 N -0.77 1.10 -1.01 3.42 -0.08 -0.54 -4.91 116.55 113.77 2aaz n ASP 166 Ca 0.22 0.87 0.08 0.00 -1.51 0.00 0.00 54.79 54.46 2aaz n ASP 166 Cb 0.15 -1.40 0.25 0.00 2.34 0.00 0.00 41.12 42.45 2aaz n ASP 166 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2aaz n ARG 167 N -0.75 3.12 -0.51 -0.67 1.74 -1.26 -4.50 116.66 113.83 2aaz n ARG 167 Ca 0.12 -2.52 0.06 0.00 -0.77 0.00 0.00 57.85 54.74 2aaz n ARG 167 Cb 0.45 -1.61 0.20 0.00 -1.02 0.00 0.00 32.46 30.48 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 0.47 1.55 -2.40 5.56 3.00 -1.26 -4.92 116.66 118.65 2aaz n ARG 168 Ca 0.19 -3.17 -0.41 0.00 -0.01 0.00 0.00 57.85 54.45 2aaz n ARG 168 Cb 0.69 -1.61 -0.01 0.00 0.00 0.00 0.00 32.46 31.53 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 -1.18 3.60 -4.89 0.55 5.41 -1.26 -4.91 119.36 116.68 2aaz n ILE 169 Ca 0.19 -3.68 -0.31 0.00 1.00 0.00 0.00 62.75 59.94 2aaz n ILE 169 Cb 0.69 -2.35 -0.14 0.00 -0.71 0.00 0.00 39.64 37.13 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 5.03 2.65 -0.21 1.39 -1.09 -1.26 -1.48 121.20 126.24 2aaz s ILE 170 Ca 0.55 -1.05 -0.00 0.00 -2.23 0.00 0.00 60.65 57.92 2aaz s ILE 170 Cb 0.05 -2.05 0.05 0.00 -1.58 0.00 0.00 42.46 38.93 2aaz s ILE 170 CO 0.07 0.47 -0.04 -0.22 -1.23 0.00 0.00 174.94 173.99 2aaz s LEU 171 N -1.03 2.05 0.02 2.97 2.96 -0.61 -4.87 118.68 120.17 2aaz s LEU 171 Ca 0.12 -0.97 0.04 0.00 -0.22 0.00 0.00 54.13 53.11 2aaz s LEU 171 Cb -0.10 -1.00 -0.02 0.00 0.50 0.00 0.00 46.19 45.57 2aaz s LEU 171 CO 0.02 -0.23 -0.12 -0.55 -1.32 0.00 0.00 176.35 174.15 2aaz s SER 172 N 1.54 1.41 0.00 3.68 0.15 -1.26 -1.02 113.70 118.20 2aaz s SER 172 Ca -0.03 -0.35 0.10 0.00 0.70 0.00 0.00 55.95 56.37 2aaz s SER 172 Cb -0.17 -0.11 -0.03 0.00 -1.71 0.00 0.00 66.02 64.00 2aaz s SER 172 CO -0.07 0.05 0.59 0.00 1.20 0.00 0.00 173.24 175.01 2aaz n ALA 173 N 2.25 2.98 -2.25 5.45 0.00 -0.50 -4.34 120.51 124.11 2aaz n ALA 173 Ca -0.17 -0.40 -0.42 0.00 0.00 0.00 0.00 53.44 52.45 2aaz n ALA 173 Cb 0.55 -0.37 -0.03 0.00 0.00 0.00 0.00 19.45 19.61 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 -1.55 2.62 -0.33 0.00 -0.11 -1.18 -4.83 118.94 113.56 2aaz s TRP 174 Ca 0.07 0.73 -0.00 0.00 1.22 0.00 0.00 56.10 58.12 2aaz s TRP 174 Cb 0.08 -3.67 0.13 0.00 -1.50 0.00 0.00 33.47 28.52 2aaz s TRP 174 CO 0.31 -2.52 0.25 1.21 -4.62 0.00 0.00 176.95 171.57 2aaz s ASN 175 N 2.31 2.43 0.45 5.86 3.84 -1.26 -5.02 114.94 123.56 2aaz s ASN 175 Ca 0.63 -1.55 0.23 0.00 0.21 0.00 0.00 52.86 52.37 2aaz s ASN 175 Cb -0.28 0.02 1.23 0.00 -0.55 0.00 0.00 41.25 41.66 2aaz s ASN 175 CO 0.23 -0.34 1.83 -0.65 -2.79 0.00 0.00 177.10 175.37 2aaz h PRO 176 N 7.60 0.26 -0.30 0.43 0.11 -2.01 -0.83 132.00 137.26 2aaz h PRO 176 Ca -0.04 -0.02 -0.18 0.00 0.11 0.00 0.00 66.00 65.87 2aaz h PRO 176 Cb 1.02 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.07 2aaz h PRO 176 CO 0.30 0.17 -0.51 -0.22 -0.21 0.00 0.00 178.00 177.54 2aaz h LYS 177 N 0.27 0.87 0.00 1.05 3.64 -2.02 -3.30 116.57 117.09 2aaz h LYS 177 Ca 0.51 -0.54 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2aaz h LYS 177 Cb 1.52 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.40 2aaz h LYS 177 CO -0.16 1.18 -0.30 -0.25 -2.27 0.00 0.00 179.45 177.65 2aaz n ASP 178 N -4.04 0.68 -0.32 4.20 8.00 -0.42 -4.46 116.55 120.20 2aaz n ASP 178 Ca -0.04 0.32 -0.00 0.00 0.71 0.00 0.00 54.79 55.78 2aaz n ASP 178 Cb 0.61 -0.30 0.06 0.00 -0.02 0.00 0.00 41.12 41.47 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 -1.18 -1.81 0.64 3.38 -1.37 0.17 115.31 115.14 2aaz h LEU 179 Ca 0.00 0.28 0.00 0.00 0.09 0.00 0.00 57.88 58.25 2aaz h LEU 179 Cb 0.71 0.65 0.00 0.00 0.09 0.00 0.00 40.66 42.11 2aaz h LEU 179 CO 0.00 -0.30 0.00 1.55 0.09 0.00 0.00 178.44 179.78 2aaz h PRO 180 N -0.04 0.00 -0.00 1.13 0.13 -1.83 0.29 132.00 131.67 2aaz h PRO 180 Ca 0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.48 2aaz h PRO 180 Cb 0.61 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.74 2aaz h PRO 180 CO -0.90 0.00 -0.34 1.28 -0.23 0.00 0.00 178.00 177.81 2aaz n LEU 181 N -2.52 0.65 -4.77 1.56 4.77 0.58 -4.87 117.00 112.40 2aaz n LEU 181 Ca -0.01 -0.06 -0.38 0.00 -0.03 0.00 0.00 56.01 55.52 2aaz n LEU 181 Cb 0.07 -0.21 -0.06 0.00 -2.33 0.00 0.00 43.42 40.89 2aaz n LEU 181 CO 0.14 0.14 0.17 -0.04 -1.33 0.00 0.00 177.39 176.47 2aaz s MET 182 N -2.76 4.19 0.47 3.23 -1.94 0.09 -4.31 119.30 118.26 2aaz s MET 182 Ca 0.18 0.50 0.13 0.00 -1.71 0.00 0.00 55.69 54.79 2aaz s MET 182 Cb 0.18 -3.34 1.08 0.00 2.01 0.00 0.00 34.83 34.77 2aaz s MET 182 CO 0.60 0.40 2.08 0.00 -0.01 0.00 0.00 175.02 178.09 2aaz h ALA 183 N 5.72 1.83 -2.61 3.03 0.00 -1.39 -3.42 119.26 122.43 2aaz h ALA 183 Ca -0.46 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.29 2aaz h ALA 183 Cb 1.20 -0.05 -0.24 0.00 0.00 0.00 0.00 17.79 18.69 2aaz h ALA 183 CO 0.69 0.13 -0.21 -1.17 0.00 0.00 0.00 179.25 178.69 2aaz s LEU 184 N -9.07 0.10 0.52 0.00 2.96 -1.26 -5.05 118.68 106.88 2aaz s LEU 184 Ca -0.06 0.93 -0.20 0.00 -0.22 0.00 0.00 54.13 54.59 2aaz s LEU 184 Cb 0.17 1.53 -0.07 0.00 0.50 0.00 0.00 46.19 48.32 2aaz s LEU 184 CO 0.69 -0.17 1.11 -2.84 -1.32 0.00 0.00 176.35 173.83 2aaz s PRO 185 N 0.66 3.52 0.22 0.98 0.02 -1.26 -4.94 135.00 134.20 2aaz s PRO 185 Ca -0.03 1.58 -0.32 0.00 0.02 0.00 0.00 61.00 62.25 2aaz s PRO 185 Cb -0.05 -2.09 -0.14 0.00 0.02 0.00 0.00 34.50 32.25 2aaz s PRO 185 CO -0.04 -0.71 1.37 -2.30 -0.33 0.00 0.00 177.00 174.98 2aaz n PRO 186 N -1.10 1.87 -0.09 5.54 -0.02 -1.26 -4.93 135.00 135.01 2aaz n PRO 186 Ca 0.10 0.67 -0.15 0.00 -2.02 0.00 0.00 63.50 62.10 2aaz n PRO 186 Cb 0.51 -2.29 -0.08 0.00 -0.02 0.00 0.00 33.50 31.62 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 -2.32 2.75 -0.38 0.00 0.00 -1.26 -1.49 115.29 112.58 2aaz s HIS 188 Ca -0.24 -0.77 0.23 0.00 -3.00 0.00 0.00 55.06 51.28 2aaz s HIS 188 Cb 0.05 -4.36 0.36 0.00 -4.00 0.00 0.00 32.58 24.62 2aaz s HIS 188 CO 0.45 -1.68 1.61 0.00 -1.00 0.00 0.00 174.74 174.12 2aaz h MET 189 N 9.43 0.00 -1.22 -0.38 -0.00 -1.69 -3.44 114.93 117.63 2aaz h MET 189 Ca -0.11 0.00 0.33 0.00 -0.00 0.00 0.00 59.70 59.92 2aaz h MET 189 Cb 1.05 0.00 -0.17 0.00 -0.00 0.00 0.00 31.60 32.48 2aaz h MET 189 CO 1.20 0.05 0.91 -0.59 -0.00 0.00 0.00 176.91 178.49 2aaz s PHE 190 N -3.21 -0.04 0.07 -0.10 -0.12 -1.24 -1.41 117.98 111.93 2aaz s PHE 190 Ca 0.06 0.01 -0.08 0.00 -0.05 0.00 0.00 56.93 56.87 2aaz s PHE 190 Cb 0.05 0.51 -0.00 0.00 -0.63 0.00 0.00 43.02 42.95 2aaz s PHE 190 CO 0.67 -0.11 0.17 0.00 -0.05 0.00 0.00 175.22 175.90 2aaz s GLN 192 N -3.57 1.55 0.07 0.00 0.74 0.89 -1.57 119.66 117.78 2aaz s GLN 192 Ca 0.03 -0.48 0.01 0.00 0.05 0.00 0.00 55.36 54.97 2aaz s GLN 192 Cb 0.04 -1.35 -0.04 0.00 1.10 0.00 0.00 33.01 32.76 2aaz s GLN 192 CO -0.09 0.15 0.17 -0.06 -0.55 0.00 0.00 175.29 174.91 2aaz s PHE 193 N 0.24 3.40 -0.01 1.67 0.40 -0.55 -0.82 117.98 122.31 2aaz s PHE 193 Ca -0.06 0.18 0.01 0.00 -0.60 0.00 0.00 56.93 56.46 2aaz s PHE 193 Cb -0.12 -1.70 0.00 0.00 0.51 0.00 0.00 43.02 41.71 2aaz s PHE 193 CO 0.02 0.56 -0.03 0.12 0.70 0.00 0.00 175.22 176.60 2aaz s PHE 194 N -1.48 0.30 -0.17 0.36 2.19 -0.55 -4.62 117.98 114.00 2aaz s PHE 194 Ca 0.33 -0.05 0.01 0.00 0.33 0.00 0.00 56.93 57.55 2aaz s PHE 194 Cb -0.13 -0.23 0.02 0.00 -1.31 0.00 0.00 43.02 41.37 2aaz s PHE 194 CO 0.26 -0.03 -0.19 0.08 1.83 0.00 0.00 175.22 177.16 2aaz s VAL 195 N 0.15 2.16 -0.09 3.12 1.01 -1.26 -0.75 120.40 124.74 2aaz s VAL 195 Ca -0.01 -0.92 -0.19 0.00 0.00 0.00 0.00 61.98 60.86 2aaz s VAL 195 Cb -0.04 -1.90 -0.04 0.00 0.00 0.00 0.00 36.38 34.40 2aaz s VAL 195 CO -0.00 0.53 0.52 -0.44 0.00 0.00 0.00 175.10 175.71 2aaz s SER 196 N 1.18 6.78 0.58 3.32 0.01 0.31 -4.76 113.70 121.11 2aaz s SER 196 Ca 0.02 0.93 -0.17 0.00 1.31 0.00 0.00 55.95 58.04 2aaz s SER 196 Cb -0.14 -2.31 -0.04 0.00 0.21 0.00 0.00 66.02 63.74 2aaz s SER 196 CO -0.09 0.02 1.06 -0.76 0.41 0.00 0.00 173.24 173.88 2aaz s LEU 197 N 0.43 3.56 0.24 2.44 1.43 -1.26 -1.65 118.68 123.88 2aaz s LEU 197 Ca 0.28 1.88 -0.31 0.00 -1.03 0.00 0.00 54.13 54.95 2aaz s LEU 197 Cb -0.16 -4.54 -0.12 0.00 0.03 0.00 0.00 46.19 41.40 2aaz s LEU 197 CO 0.13 -1.15 1.62 -2.65 0.23 0.00 0.00 176.35 174.53 2aaz n PRO 198 N -1.85 2.59 -1.44 1.29 -0.02 -1.26 -4.84 135.00 129.47 2aaz n PRO 198 Ca 0.09 0.93 -0.36 0.00 -2.02 0.00 0.00 63.50 62.14 2aaz n PRO 198 Cb 0.53 -2.72 0.09 0.00 -0.02 0.00 0.00 33.50 31.37 2aaz n PRO 198 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2aaz n PRO 199 N 2.94 0.66 -0.17 0.52 -0.02 -1.26 -4.79 135.00 132.89 2aaz n PRO 199 Ca 0.13 0.28 -0.02 0.00 -2.02 0.00 0.00 63.50 61.86 2aaz n PRO 199 Cb 0.34 -2.34 0.07 0.00 -0.02 0.00 0.00 33.50 31.56 2aaz n PRO 199 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2aaz h ALA 200 N -0.08 0.61 0.00 3.55 0.00 -2.00 -2.81 119.26 118.54 2aaz h ALA 200 Ca -0.48 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2aaz h ALA 200 Cb 1.33 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.20 2aaz h ALA 200 CO 0.49 -0.25 -0.02 -0.40 0.00 0.00 0.00 179.25 179.07 2aaz n ASP 201 N -5.05 4.19 0.00 0.00 5.75 -1.26 -3.61 116.55 116.57 2aaz n ASP 201 Ca 0.06 -2.12 0.00 0.00 -0.01 0.00 0.00 54.79 52.72 2aaz n ASP 201 Cb 0.23 -0.91 0.00 0.00 -1.03 0.00 0.00 41.12 39.41 2aaz n ASP 201 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 2aaz n SER 202 N 1.71 0.00 0.00 -1.12 3.41 -1.07 -5.03 113.62 111.52 2aaz n SER 202 Ca 0.03 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.71 2aaz n SER 202 Cb 0.42 0.00 0.35 0.00 -0.26 0.00 0.00 64.21 64.73 2aaz n SER 202 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 2aaz n PRO 203 N 0.00 0.29 0.14 4.33 -0.04 -1.18 -2.32 135.00 136.23 2aaz n PRO 203 Ca 0.00 0.08 0.08 0.00 -0.04 0.00 0.00 63.50 63.63 2aaz n PRO 203 Cb 0.00 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.01 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 2.07 0.00 -1.57 0.55 0.00 -1.93 -3.47 103.07 98.71 2aaz h GLY 204 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 2aaz h GLY 204 CO 0.00 0.00 0.18 1.44 0.00 0.00 0.00 176.54 178.16 2aaz n SER 205 N -2.97 0.40 -4.77 0.19 7.64 -0.98 -4.98 113.62 108.15 2aaz n SER 205 Ca 0.00 0.50 -0.39 0.00 1.01 0.00 0.00 58.87 60.00 2aaz n SER 205 Cb 0.62 -1.46 -0.06 0.00 -1.01 0.00 0.00 64.21 62.30 2aaz n SER 205 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2aaz s LYS 206 N -4.19 4.69 0.66 1.43 1.02 -1.26 -4.73 119.74 117.35 2aaz s LYS 206 Ca 0.69 1.35 -0.17 0.00 0.02 0.00 0.00 55.97 57.86 2aaz s LYS 206 Cb -0.26 -3.08 -0.00 0.00 -0.52 0.00 0.00 37.83 33.96 2aaz s LYS 206 CO 0.55 0.43 1.25 -2.14 -0.92 0.00 0.00 175.35 174.52 2aaz s PRO 207 N -1.53 2.53 -0.09 -1.68 0.02 -1.26 -4.59 135.00 128.40 2aaz s PRO 207 Ca 0.44 1.91 -0.14 0.00 0.02 0.00 0.00 61.00 63.22 2aaz s PRO 207 Cb -0.22 -1.86 -0.05 0.00 0.02 0.00 0.00 34.50 32.38 2aaz s PRO 207 CO 0.28 -1.58 0.35 0.15 -0.33 0.00 0.00 177.00 175.87 2aaz s LYS 208 N -3.53 4.05 -0.17 5.54 1.02 -0.66 -0.35 119.74 125.64 2aaz s LYS 208 Ca 0.79 0.26 -0.05 0.00 0.02 0.00 0.00 55.97 56.98 2aaz s LYS 208 Cb -0.33 -3.32 -0.03 0.00 -0.52 0.00 0.00 37.83 33.63 2aaz s LYS 208 CO 0.40 0.46 -0.01 -1.17 -0.92 0.00 0.00 175.35 174.11 2aaz s LEU 209 N -0.27 3.41 0.23 3.17 2.96 0.28 -0.53 118.68 127.93 2aaz s LEU 209 Ca 0.21 -0.08 0.09 0.00 -0.22 0.00 0.00 54.13 54.13 2aaz s LEU 209 Cb -0.15 -1.84 -0.05 0.00 0.50 0.00 0.00 46.19 44.66 2aaz s LEU 209 CO 0.09 0.16 -0.16 -0.44 -1.32 0.00 0.00 176.35 174.67 2aaz s SER 210 N 0.44 2.94 -0.06 3.68 0.01 0.07 0.20 113.70 120.98 2aaz s SER 210 Ca -0.02 -1.03 -0.02 0.00 1.31 0.00 0.00 55.95 56.19 2aaz s SER 210 Cb -0.14 -0.20 0.03 0.00 0.21 0.00 0.00 66.02 65.93 2aaz s SER 210 CO 0.02 -0.10 0.12 0.00 0.41 0.00 0.00 173.24 173.69 2aaz s LEU 212 N 1.07 2.26 -0.01 0.00 0.20 0.00 0.15 118.68 122.35 2aaz s LEU 212 Ca -0.08 -0.55 0.08 0.00 0.69 0.00 0.00 54.13 54.27 2aaz s LEU 212 Cb -0.11 -1.49 -0.02 0.00 -0.43 0.00 0.00 46.19 44.14 2aaz s LEU 212 CO -0.05 0.08 -0.26 -0.32 -0.29 0.00 0.00 176.35 175.52 2aaz s MET 213 N 0.82 2.04 -0.16 1.98 -2.45 0.05 -0.07 119.30 121.51 2aaz s MET 213 Ca -0.06 -0.93 -0.01 0.00 -1.25 0.00 0.00 55.69 53.43 2aaz s MET 213 Cb -0.15 -2.00 -0.01 0.00 1.25 0.00 0.00 34.83 33.92 2aaz s MET 213 CO -0.01 0.55 -0.10 -0.47 1.05 0.00 0.00 175.02 176.03 2aaz s TYR 214 N -0.62 2.87 -0.22 4.11 5.04 -0.48 -0.99 117.35 127.07 2aaz s TYR 214 Ca 0.10 -0.76 -0.01 0.00 -2.44 0.00 0.00 57.07 53.96 2aaz s TYR 214 Cb -0.10 -1.93 0.02 0.00 0.35 0.00 0.00 41.96 40.30 2aaz s TYR 214 CO -0.01 -0.33 -0.11 -1.14 -1.34 0.00 0.00 175.55 172.62 2aaz s GLN 215 N 0.74 2.96 0.29 4.97 0.74 -0.24 -2.41 119.66 126.70 2aaz s GLN 215 Ca -0.04 -0.88 0.04 0.00 0.05 0.00 0.00 55.36 54.53 2aaz s GLN 215 Cb -0.15 -2.83 0.43 0.00 1.10 0.00 0.00 33.01 31.56 2aaz s GLN 215 CO 0.02 -0.30 1.70 0.07 -0.55 0.00 0.00 175.29 176.23 2aaz h ARG 216 N 7.99 0.35 -3.71 1.67 0.11 -1.57 0.11 114.38 119.33 2aaz h ARG 216 Ca -0.38 -0.15 -0.37 0.00 0.10 0.00 0.00 59.98 59.18 2aaz h ARG 216 Cb 1.13 -0.01 -0.35 0.00 1.11 0.00 0.00 29.97 31.85 2aaz h ARG 216 CO 0.60 0.66 -0.75 0.45 0.10 0.00 0.00 179.97 181.02 2aaz s SER 217 N -6.86 0.71 -0.17 0.08 0.15 -1.26 -0.14 113.70 106.21 2aaz s SER 217 Ca -0.06 -0.03 -0.01 0.00 0.70 0.00 0.00 55.95 56.55 2aaz s SER 217 Cb 0.13 -0.27 0.05 0.00 -1.71 0.00 0.00 66.02 64.22 2aaz s SER 217 CO 0.78 -0.12 -0.02 0.00 1.20 0.00 0.00 173.24 175.08 2aaz s ASP 219 N 1.70 6.25 0.27 0.00 3.68 -1.26 -1.63 116.67 125.68 2aaz s ASP 219 Ca -0.00 -1.08 -0.04 0.00 2.13 0.00 0.00 52.55 53.56 2aaz s ASP 219 Cb -0.16 -2.45 0.36 0.00 -1.45 0.00 0.00 42.92 39.22 2aaz s ASP 219 CO -0.07 -1.46 1.92 -0.07 0.13 0.00 0.00 175.17 175.62 2aaz h LEU 220 N 11.59 1.07 0.50 -1.34 4.07 -1.76 0.97 115.31 130.41 2aaz h LEU 220 Ca -0.19 -0.02 -0.02 0.00 0.08 0.00 0.00 57.88 57.73 2aaz h LEU 220 Cb 1.06 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 42.55 2aaz h LEU 220 CO 1.20 0.74 -0.24 1.23 -1.08 0.00 0.00 178.44 180.30 2aaz h GLY 221 N 1.24 -0.70 0.02 0.83 0.00 -1.90 -3.38 103.07 99.17 2aaz h GLY 221 Ca 0.37 0.26 -0.42 0.00 0.00 0.00 0.00 47.33 47.54 2aaz h GLY 221 CO -0.11 -0.26 -2.48 1.04 0.00 0.00 0.00 176.54 174.74 2aaz n LEU 222 N -5.33 2.49 0.02 3.11 4.77 -1.20 -4.69 117.00 116.17 2aaz n LEU 222 Ca -0.12 0.10 -0.10 0.00 -0.03 0.00 0.00 56.01 55.87 2aaz n LEU 222 Cb 0.31 -0.88 -0.07 0.00 -2.33 0.00 0.00 43.42 40.45 2aaz n LEU 222 CO 0.34 0.76 0.33 1.23 -1.33 0.00 0.00 177.39 178.73 2aaz h GLY 223 N 0.57 -0.16 -0.15 -0.72 0.00 -1.11 -3.37 103.07 98.13 2aaz h GLY 223 Ca -0.63 0.06 0.24 0.00 0.00 0.00 0.00 47.33 47.00 2aaz h GLY 223 CO -0.24 -0.06 0.55 -2.08 0.00 0.00 0.00 176.54 174.71 2aaz h VAL 224 N -0.91 0.53 -0.75 4.60 2.07 -1.34 0.25 116.25 120.70 2aaz h VAL 224 Ca -0.02 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.32 2aaz h VAL 224 Cb 0.52 -0.07 -0.04 0.00 -1.52 0.00 0.00 31.29 30.19 2aaz h VAL 224 CO 0.03 0.10 0.48 -0.65 0.02 0.00 0.00 177.57 177.54 2aaz h PRO 225 N 0.55 1.00 -0.08 1.57 0.11 -1.76 -0.23 132.00 133.15 2aaz h PRO 225 Ca 0.62 -0.07 -0.06 0.00 0.11 0.00 0.00 66.00 66.60 2aaz h PRO 225 Cb 1.18 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.07 2aaz h PRO 225 CO -0.48 0.68 -0.19 0.74 -0.21 0.00 0.00 178.00 178.53 2aaz h PHE 226 N 1.02 0.35 -0.67 0.65 -1.00 -0.77 -3.00 116.94 113.51 2aaz h PHE 226 Ca 0.27 -0.13 0.08 0.00 2.81 0.00 0.00 57.97 60.99 2aaz h PHE 226 Cb -0.09 -0.06 -0.06 0.00 3.61 0.00 0.00 35.95 39.35 2aaz h PHE 226 CO 0.00 0.80 0.34 -0.91 -1.61 0.00 0.00 178.31 176.94 2aaz h ASN 227 N -0.21 0.47 -0.06 2.17 -0.26 -0.56 0.31 115.58 117.45 2aaz h ASN 227 Ca -0.00 0.05 -0.00 0.00 -0.56 0.00 0.00 56.30 55.78 2aaz h ASN 227 Cb 0.80 -0.04 -0.00 0.00 -1.06 0.00 0.00 38.32 38.01 2aaz h ASN 227 CO 0.04 0.29 0.03 0.40 -1.06 0.00 0.00 177.43 177.13 2aaz h ILE 228 N 0.61 1.08 -0.50 2.81 2.04 -1.11 -1.93 117.51 120.52 2aaz h ILE 228 Ca 0.32 -0.24 -0.12 0.00 1.00 0.00 0.00 64.86 65.81 2aaz h ILE 228 Cb 0.27 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 2aaz h ILE 228 CO -0.23 0.07 -0.17 0.00 0.00 0.00 0.00 178.15 177.82 2aaz h ALA 229 N 0.93 0.75 0.29 1.87 0.00 -1.32 -2.37 119.26 119.41 2aaz h ALA 229 Ca 0.02 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 2aaz h ALA 229 Cb 0.09 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2aaz h ALA 229 CO -0.00 0.67 -0.22 1.03 0.00 0.00 0.00 179.25 180.72 2aaz h SER 230 N 0.86 -0.58 0.27 0.00 0.87 -0.25 0.57 113.55 115.29 2aaz h SER 230 Ca 0.12 0.05 -0.09 0.00 -1.23 0.00 0.00 61.79 60.63 2aaz h SER 230 Cb 0.74 0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.87 2aaz h SER 230 CO 0.06 -0.34 -0.38 1.88 -0.53 0.00 0.00 176.83 177.51 2aaz h TYR 231 N -0.52 0.18 -0.47 2.24 0.05 -1.37 0.93 116.97 118.01 2aaz h TYR 231 Ca -0.02 -0.04 -0.03 0.00 0.05 0.00 0.00 58.73 58.69 2aaz h TYR 231 Cb 0.46 -0.04 -0.02 0.00 1.01 0.00 0.00 36.73 38.13 2aaz h TYR 231 CO -0.13 0.52 0.19 0.00 -1.05 0.00 0.00 178.16 177.69 2aaz h ALA 232 N 1.47 0.62 -0.60 3.88 0.00 -1.23 -0.77 119.26 122.63 2aaz h ALA 232 Ca 0.01 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 2aaz h ALA 232 Cb 0.74 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2aaz h ALA 232 CO 0.06 0.23 0.10 -0.07 0.00 0.00 0.00 179.25 179.56 2aaz h LEU 233 N 0.62 0.95 -0.60 0.00 3.38 -0.26 -1.83 115.31 117.57 2aaz h LEU 233 Ca 0.16 -0.26 0.03 0.00 0.09 0.00 0.00 57.88 57.90 2aaz h LEU 233 Cb 0.20 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 2aaz h LEU 233 CO -0.01 0.97 0.36 0.25 0.09 0.00 0.00 178.44 180.09 2aaz h LEU 234 N 0.90 0.57 -0.80 1.67 5.85 -0.50 0.54 115.31 123.53 2aaz h LEU 234 Ca 0.18 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.87 2aaz h LEU 234 Cb 0.42 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.31 2aaz h LEU 234 CO 0.01 0.39 0.33 0.74 -0.34 0.00 0.00 178.44 179.58 2aaz h THR 235 N 0.70 1.26 -0.46 1.05 2.02 -0.90 0.68 112.91 117.25 2aaz h THR 235 Ca 0.25 -0.81 -0.02 0.00 0.77 0.00 0.00 66.41 66.61 2aaz h THR 235 Cb 0.06 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 66.74 2aaz h THR 235 CO -0.12 0.33 0.22 0.45 0.37 0.00 0.00 175.52 176.77 2aaz h HIS 236 N 1.16 0.67 0.09 3.16 3.86 -0.68 -0.20 115.15 123.21 2aaz h HIS 236 Ca 0.27 -0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.45 2aaz h HIS 236 Cb 0.20 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.45 2aaz h HIS 236 CO 0.02 0.54 -0.09 0.52 0.86 0.00 0.00 177.93 179.78 2aaz h MET 237 N 0.61 -0.20 -0.64 2.45 2.07 -0.30 -1.87 114.93 117.05 2aaz h MET 237 Ca 0.16 0.01 -0.02 0.00 -2.07 0.00 0.00 59.70 57.78 2aaz h MET 237 Cb 0.12 0.05 -0.03 0.00 -1.87 0.00 0.00 31.60 29.87 2aaz h MET 237 CO -0.02 -0.13 0.30 0.82 1.07 0.00 0.00 176.91 178.95 2aaz h ILE 238 N -0.21 1.21 -0.96 -1.22 2.04 -0.77 -2.07 117.51 115.53 2aaz h ILE 238 Ca 0.01 -0.59 0.00 0.00 1.00 0.00 0.00 64.86 65.28 2aaz h ILE 238 Cb 0.20 0.39 -0.05 0.00 -0.74 0.00 0.00 36.82 36.63 2aaz h ILE 238 CO -0.03 0.25 0.61 0.00 0.00 0.00 0.00 178.15 178.97 2aaz h ALA 239 N 1.43 1.22 -0.24 1.87 0.00 -0.64 -0.82 119.26 122.08 2aaz h ALA 239 Ca 0.22 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2aaz h ALA 239 Cb 0.10 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 2aaz h ALA 239 CO -0.03 0.65 0.06 1.25 0.00 0.00 0.00 179.25 181.18 2aaz h LEU 240 N 1.31 0.37 -1.23 0.00 5.85 -0.67 -0.76 115.31 120.19 2aaz h LEU 240 Ca 0.35 -0.23 -0.07 0.00 0.84 0.00 0.00 57.88 58.77 2aaz h LEU 240 Cb -0.10 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.82 2aaz h LEU 240 CO -0.07 0.51 -0.32 0.40 -0.34 0.00 0.00 178.44 178.62 2aaz h ILE 241 N 0.21 0.91 -0.50 4.05 1.08 -1.17 -3.15 117.51 118.95 2aaz h ILE 241 Ca 0.08 -1.25 0.00 0.00 -0.39 0.00 0.00 64.86 63.30 2aaz h ILE 241 Cb 0.28 1.74 0.00 0.00 -3.07 0.00 0.00 36.82 35.77 2aaz h ILE 241 CO 0.00 0.31 0.00 0.35 -0.69 0.00 0.00 178.15 178.12 2aaz n THR 242 N -3.70 0.75 -3.59 -0.27 -2.24 -0.34 -4.96 114.28 99.92 2aaz n THR 242 Ca -0.01 -0.87 -0.25 0.00 -2.27 0.00 0.00 64.05 60.64 2aaz n THR 242 Cb 0.42 0.74 0.06 0.00 -2.10 0.00 0.00 70.33 69.45 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 1.38 -5.93 -4.66 3.42 10.43 -0.71 -4.80 116.55 115.67 2aaz n ASP 243 Ca 0.20 -0.56 -0.26 0.00 2.57 0.00 0.00 54.79 56.74 2aaz n ASP 243 Cb 0.57 -4.70 -0.09 0.00 1.84 0.00 0.00 41.12 38.74 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 -3.28 2.24 -0.23 -3.53 -4.23 -0.37 -4.47 115.64 101.76 2aaz s THR 244 Ca 0.57 -1.89 -0.06 0.00 -1.18 0.00 0.00 61.69 59.12 2aaz s THR 244 Cb -0.26 -2.94 -0.02 0.00 1.34 0.00 0.00 72.50 70.62 2aaz s THR 244 CO 0.70 -0.05 0.02 -0.70 -0.54 0.00 0.00 174.62 174.05 2aaz s GLU 245 N -3.78 3.55 0.25 3.99 2.56 0.53 -4.47 118.70 121.34 2aaz s GLU 245 Ca 0.37 -0.53 -0.31 0.00 0.00 0.00 0.00 54.97 54.50 2aaz s GLU 245 Cb 0.05 -3.19 -0.13 0.00 2.00 0.00 0.00 34.13 32.87 2aaz s GLU 245 CO 0.20 -0.17 1.50 -0.35 -0.56 0.00 0.00 175.26 175.88 2aaz n PRO 246 N 4.81 2.32 0.04 4.30 -0.04 -1.26 -0.55 135.00 144.61 2aaz n PRO 246 Ca -0.17 0.83 0.00 0.00 -0.04 0.00 0.00 63.50 64.12 2aaz n PRO 246 Cb 0.51 -2.54 0.00 0.00 -0.04 0.00 0.00 33.50 31.43 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 2.19 -0.01 -3.85 0.54 -0.00 0.13 -3.83 115.22 110.39 2aaz n HIS 247 Ca 0.11 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.18 2aaz n HIS 247 Cb 0.33 0.00 -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 -1.82 0.44 -0.11 1.57 2.12 -1.22 -0.51 118.70 119.17 2aaz s GLU 248 Ca 0.00 -0.26 0.02 0.00 0.36 0.00 0.00 54.97 55.09 2aaz s GLU 248 Cb 0.00 0.19 0.01 0.00 0.26 0.00 0.00 34.13 34.59 2aaz s GLU 248 CO 0.00 -0.10 -0.17 0.12 -0.54 0.00 0.00 175.26 174.57 2aaz s PHE 249 N -1.08 2.10 -0.07 5.30 5.36 -0.27 -1.12 117.98 128.20 2aaz s PHE 249 Ca -0.12 -0.97 0.04 0.00 -0.96 0.00 0.00 56.93 54.92 2aaz s PHE 249 Cb -0.06 -1.48 -0.02 0.00 -0.34 0.00 0.00 43.02 41.12 2aaz s PHE 249 CO 0.01 -0.48 -0.20 0.42 -1.46 0.00 0.00 175.22 173.52 2aaz s ILE 250 N 0.87 2.53 -0.19 3.12 1.09 0.12 -0.85 121.20 127.89 2aaz s ILE 250 Ca -0.08 -0.90 0.01 0.00 -1.10 0.00 0.00 60.65 58.58 2aaz s ILE 250 Cb -0.15 -1.97 0.04 0.00 -1.06 0.00 0.00 42.46 39.32 2aaz s ILE 250 CO -0.00 0.57 -0.11 -0.22 -0.10 0.00 0.00 174.94 175.08 2aaz s LEU 251 N -0.27 2.15 -0.18 2.97 2.96 -0.20 -0.77 118.68 125.35 2aaz s LEU 251 Ca 0.01 -0.81 -0.06 0.00 -0.22 0.00 0.00 54.13 53.05 2aaz s LEU 251 Cb -0.13 -1.21 -0.04 0.00 0.50 0.00 0.00 46.19 45.31 2aaz s LEU 251 CO 0.03 -0.13 0.03 -1.58 -1.32 0.00 0.00 176.35 173.38 2aaz s GLN 252 N 1.42 3.87 0.10 1.98 2.00 -0.16 -1.12 119.66 127.74 2aaz s GLN 252 Ca -0.00 -0.41 0.03 0.00 -2.00 0.00 0.00 55.36 52.99 2aaz s GLN 252 Cb -0.16 -3.12 -0.04 0.00 0.80 0.00 0.00 33.01 30.49 2aaz s GLN 252 CO -0.09 0.24 0.10 -1.64 -0.50 0.00 0.00 175.29 173.41 2aaz s MET 253 N 0.42 2.93 0.00 1.67 -1.94 -1.26 -1.08 119.30 120.03 2aaz s MET 253 Ca 0.01 -0.71 0.00 0.00 -1.71 0.00 0.00 55.69 53.27 2aaz s MET 253 Cb -0.13 -2.73 0.00 0.00 2.01 0.00 0.00 34.83 33.98 2aaz s MET 253 CO 0.01 0.55 0.00 0.41 -0.01 0.00 0.00 175.02 175.98 2aaz n GLY 254 N 0.24 -0.10 3.55 -0.03 0.00 0.37 -3.65 105.19 105.58 2aaz n GLY 254 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.99 6.23 -0.34 1.61 3.68 0.80 -0.85 116.67 126.81 2aaz s ASP 255 Ca 0.00 -0.68 -0.17 0.00 2.13 0.00 0.00 52.55 53.83 2aaz s ASP 255 Cb 0.00 -2.56 -0.01 0.00 -1.45 0.00 0.00 42.92 38.90 2aaz s ASP 255 CO 0.00 -1.75 0.46 0.00 0.13 0.00 0.00 175.17 174.01 2aaz s ALA 256 N 5.50 3.49 0.08 3.66 0.00 -0.58 -0.71 121.76 133.21 2aaz s ALA 256 Ca 0.37 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 51.30 2aaz s ALA 256 Cb -0.07 -2.93 -0.04 0.00 0.00 0.00 0.00 23.12 20.08 2aaz s ALA 256 CO 0.10 -1.11 -0.03 -3.38 0.00 0.00 0.00 175.76 171.33 2aaz s HIS 257 N 2.26 0.74 -0.16 0.00 -0.00 -0.65 -1.04 115.29 116.44 2aaz s HIS 257 Ca 0.17 -1.03 0.00 0.00 -0.00 0.00 0.00 55.06 54.20 2aaz s HIS 257 Cb -0.16 -0.47 0.03 0.00 -0.00 0.00 0.00 32.58 31.98 2aaz s HIS 257 CO 0.12 -0.30 -0.13 0.08 -0.00 0.00 0.00 174.74 174.51 2aaz s VAL 258 N -3.81 1.58 0.56 -5.38 1.01 -0.27 -1.80 120.40 112.29 2aaz s VAL 258 Ca 0.12 -0.73 -0.21 0.00 0.00 0.00 0.00 61.98 61.16 2aaz s VAL 258 Cb 0.07 -1.54 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 2aaz s VAL 258 CO -0.06 0.37 1.30 -0.31 0.00 0.00 0.00 175.10 176.40 2aaz s TYR 259 N 1.47 2.34 0.27 5.22 1.51 -1.26 -1.60 117.35 125.29 2aaz s TYR 259 Ca 0.03 1.44 0.00 0.00 -1.01 0.00 0.00 57.07 57.53 2aaz s TYR 259 Cb -0.14 -3.67 0.55 0.00 -0.11 0.00 0.00 41.96 38.58 2aaz s TYR 259 CO -0.10 -2.61 1.80 0.00 -1.11 0.00 0.00 175.55 173.53 2aaz h ARG 260 N 1.27 0.81 -0.08 -0.62 2.47 -1.55 0.42 114.38 117.10 2aaz h ARG 260 Ca -0.51 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.16 2aaz h ARG 260 Cb 1.30 -0.18 0.00 0.00 -1.65 0.00 0.00 29.97 29.44 2aaz h ARG 260 CO 0.56 0.54 0.00 -0.40 0.56 0.00 0.00 179.97 181.23 2aaz n ASP 261 N -4.72 0.45 -0.00 7.04 5.75 -1.26 -3.17 116.55 120.64 2aaz n ASP 261 Ca 0.18 -1.93 0.06 0.00 -0.01 0.00 0.00 54.79 53.10 2aaz n ASP 261 Cb 0.39 -0.05 -0.09 0.00 -1.03 0.00 0.00 41.12 40.34 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 -0.29 0.00 0.07 2.11 8.25 0.13 -4.67 115.22 120.81 2aaz n HIS 262 Ca 0.05 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.38 2aaz n HIS 262 Cb 0.08 -0.18 -0.06 0.00 1.12 0.00 0.00 29.99 30.95 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 0.21 -0.46 1.59 2.07 -1.49 -0.75 116.25 117.42 2aaz h VAL 263 Ca 0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 2aaz h VAL 263 Cb 0.47 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 2aaz h VAL 263 CO 0.00 0.00 0.22 -0.33 0.02 0.00 0.00 177.57 177.48 2aaz h GLU 264 N -0.54 0.66 -0.89 1.57 4.39 -1.84 -2.04 114.58 115.88 2aaz h GLU 264 Ca 0.05 -0.10 -0.01 0.00 0.34 0.00 0.00 59.36 59.64 2aaz h GLU 264 Cb 0.62 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 29.11 2aaz h GLU 264 CO -0.29 0.56 0.51 -1.35 -1.16 0.00 0.00 179.01 177.28 2aaz h PRO 265 N 0.60 1.23 -0.09 2.33 0.11 -1.79 -2.56 132.00 131.84 2aaz h PRO 265 Ca 0.16 -0.13 -0.08 0.00 0.11 0.00 0.00 66.00 66.06 2aaz h PRO 265 Cb 0.12 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 30.97 2aaz h PRO 265 CO -0.02 0.88 -0.31 -0.07 -0.21 0.00 0.00 178.00 178.27 2aaz h LEU 266 N 1.24 0.16 -1.58 2.35 3.38 -0.94 -2.60 115.31 117.34 2aaz h LEU 266 Ca 0.32 -0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.25 2aaz h LEU 266 Cb -0.01 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2aaz h LEU 266 CO -0.05 0.48 0.30 0.11 0.09 0.00 0.00 178.44 179.37 2aaz h LYS 267 N 0.15 0.56 -0.53 1.13 1.57 -0.94 0.15 116.57 118.65 2aaz h LYS 267 Ca 0.02 -0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 58.64 2aaz h LYS 267 Cb 0.63 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 2aaz h LYS 267 CO 0.05 0.37 -0.14 1.15 -0.57 0.00 0.00 179.45 180.30 2aaz h THR 268 N 0.57 1.27 -0.36 -0.16 2.02 -1.43 -3.00 112.91 111.82 2aaz h THR 268 Ca 0.17 -1.31 -0.11 0.00 0.77 0.00 0.00 66.41 65.93 2aaz h THR 268 Cb 0.00 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 2aaz h THR 268 CO -0.04 0.46 -0.23 -0.61 0.37 0.00 0.00 175.52 175.47 2aaz h GLN 269 N 0.91 0.72 -0.01 6.66 4.15 -0.94 -2.97 115.11 123.62 2aaz h GLN 269 Ca 0.13 -0.29 0.00 0.00 0.77 0.00 0.00 58.65 59.27 2aaz h GLN 269 Cb 0.72 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.38 2aaz h GLN 269 CO 0.06 0.89 0.05 -0.07 -1.93 0.00 0.00 178.83 177.82 2aaz h LEU 270 N 0.63 0.00 -0.00 -2.39 3.38 -0.64 -1.13 115.31 115.15 2aaz h LEU 270 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2aaz h LEU 270 Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 2aaz h LEU 270 CO 0.06 0.00 0.00 -0.62 0.09 0.00 0.00 178.44 177.97 2aaz n GLU 271 N -3.31 0.15 -3.30 1.13 1.02 -1.12 -4.87 120.64 110.34 2aaz n GLU 271 Ca -0.03 0.12 -0.38 0.00 -0.02 0.00 0.00 57.16 56.86 2aaz n GLU 271 Cb 0.12 -1.68 -0.06 0.00 -0.02 0.00 0.00 31.44 29.80 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 -3.06 4.13 -0.12 3.49 0.52 -0.43 -5.07 118.95 118.41 2aaz s ARG 272 Ca 0.12 0.66 -0.19 0.00 -0.52 0.00 0.00 55.73 55.80 2aaz s ARG 272 Cb 0.15 -3.15 -0.04 0.00 0.52 0.00 0.00 34.95 32.43 2aaz s ARG 272 CO 0.57 0.60 0.53 -2.00 0.02 0.00 0.00 175.30 175.01 2aaz s GLU 273 N -1.34 4.33 0.66 3.54 2.12 -1.26 -4.96 118.70 121.79 2aaz s GLU 273 Ca 0.31 0.53 -0.18 0.00 0.36 0.00 0.00 54.97 55.99 2aaz s GLU 273 Cb -0.18 -3.46 -0.00 0.00 0.26 0.00 0.00 34.13 30.74 2aaz s GLU 273 CO 0.19 0.08 1.27 -2.14 -0.54 0.00 0.00 175.26 174.11 2aaz s PRO 274 N 0.86 2.52 0.20 4.30 0.02 -1.26 -4.86 135.00 136.77 2aaz s PRO 274 Ca 0.28 1.97 0.06 0.00 0.02 0.00 0.00 61.00 63.33 2aaz s PRO 274 Cb -0.16 -1.85 -0.04 0.00 0.02 0.00 0.00 34.50 32.48 2aaz s PRO 274 CO 0.11 -1.60 0.20 1.03 -0.33 0.00 0.00 177.00 176.41 2aaz s ARG 275 N -3.48 3.02 0.36 5.54 3.00 -1.26 -5.04 118.95 121.09 2aaz s ARG 275 Ca 0.80 -0.90 -0.27 0.00 0.00 0.00 0.00 55.73 55.36 2aaz s ARG 275 Cb -0.35 -2.67 -0.12 0.00 0.00 0.00 0.00 34.95 31.81 2aaz s ARG 275 CO 0.40 0.45 1.24 -0.25 0.00 0.00 0.00 175.30 177.14 2aaz n ASP 276 N -0.79 2.48 -4.74 0.23 8.00 -1.26 -4.80 116.55 115.67 2aaz n ASP 276 Ca -0.08 1.17 -0.35 0.00 0.71 0.00 0.00 54.79 56.24 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 -1.13 2.22 0.98 1.24 0.08 -1.26 -4.74 117.98 115.38 2aaz s PHE 277 Ca 0.57 1.56 -0.16 0.00 0.12 0.00 0.00 56.93 59.03 2aaz s PHE 277 Cb -0.57 -3.46 0.19 0.00 -0.57 0.00 0.00 43.02 38.61 2aaz s PHE 277 CO 0.61 -2.42 1.24 -1.25 -0.10 0.00 0.00 175.22 173.30 2aaz s PRO 278 N -3.70 0.53 0.16 0.24 0.04 -1.25 -4.85 135.00 126.17 2aaz s PRO 278 Ca 0.75 -0.19 0.11 0.00 0.04 0.00 0.00 61.00 61.72 2aaz s PRO 278 Cb -0.29 -1.81 -0.04 0.00 0.04 0.00 0.00 34.50 32.39 2aaz s PRO 278 CO 0.41 -2.52 -0.26 0.15 0.04 0.00 0.00 177.00 174.82 2aaz s LYS 279 N -5.68 1.45 -0.12 4.56 1.02 -0.28 -1.58 119.74 119.12 2aaz s LYS 279 Ca 0.71 -1.43 -0.04 0.00 0.02 0.00 0.00 55.97 55.23 2aaz s LYS 279 Cb -0.07 -1.88 -0.03 0.00 -0.52 0.00 0.00 37.83 35.33 2aaz s LYS 279 CO 0.53 0.43 0.01 -1.17 -0.92 0.00 0.00 175.35 174.23 2aaz s LEU 280 N -2.34 3.60 0.08 3.17 2.96 0.92 -1.07 118.68 126.01 2aaz s LEU 280 Ca 0.17 0.10 0.03 0.00 -0.22 0.00 0.00 54.13 54.21 2aaz s LEU 280 Cb -0.09 -1.85 -0.03 0.00 0.50 0.00 0.00 46.19 44.71 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 -0.41 0.74 -0.15 1.98 -0.14 0.22 -4.83 119.74 117.16 2aaz s LYS 281 Ca 0.08 -1.06 -0.08 0.00 -1.36 0.00 0.00 55.97 53.55 2aaz s LYS 281 Cb -0.12 -0.41 -0.04 0.00 -1.68 0.00 0.00 37.83 35.58 2aaz s LYS 281 CO 0.02 0.06 0.14 -1.58 -0.76 0.00 0.00 175.35 173.22 2aaz s TRP 282 N -2.30 3.53 -0.70 3.18 0.52 -1.26 -0.93 118.94 120.98 2aaz s TRP 282 Ca 0.02 0.46 0.25 0.00 0.02 0.00 0.00 56.10 56.85 2aaz s TRP 282 Cb -0.04 -2.02 0.88 0.00 -1.15 0.00 0.00 33.47 31.14 2aaz s TRP 282 CO -0.01 0.57 1.77 0.00 0.02 0.00 0.00 176.95 179.30 2aaz n ALA 283 N 2.54 2.12 -2.29 0.98 0.00 -0.03 -4.85 120.51 118.99 2aaz n ALA 283 Ca -0.19 -0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.10 2aaz n ALA 283 Cb 0.54 -1.45 -0.10 0.00 0.00 0.00 0.00 19.45 18.44 2aaz n ALA 283 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2aaz s ARG 284 N -3.14 1.36 0.59 0.00 0.52 -1.26 -5.05 118.95 111.96 2aaz s ARG 284 Ca 0.09 -1.73 -0.03 0.00 -0.52 0.00 0.00 55.73 53.54 2aaz s ARG 284 Cb 0.12 -0.14 0.03 0.00 0.52 0.00 0.00 34.95 35.48 2aaz s ARG 284 CO 0.54 -0.32 0.86 -1.54 0.02 0.00 0.00 175.30 174.86 2aaz s SER 285 N -3.28 5.34 0.20 0.23 1.04 -1.26 -4.90 113.70 111.08 2aaz s SER 285 Ca 0.38 0.39 -0.10 0.00 0.48 0.00 0.00 55.95 57.10 2aaz s SER 285 Cb 0.08 -1.31 0.21 0.00 0.10 0.00 0.00 66.02 65.09 2aaz s SER 285 CO 0.13 -1.17 1.80 0.50 0.98 0.00 0.00 173.24 175.49 2aaz h LYS 286 N -0.13 0.61 -0.62 4.02 3.64 -1.98 -0.29 116.57 121.82 2aaz h LYS 286 Ca -0.44 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 58.89 2aaz h LYS 286 Cb 1.28 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.94 2aaz h LYS 286 CO 0.58 0.40 0.36 0.93 -2.27 0.00 0.00 179.45 179.45 2aaz h GLU 287 N 0.62 0.85 -0.28 1.90 3.07 -1.94 0.33 114.58 119.14 2aaz h GLU 287 Ca 0.27 -0.09 -0.04 0.00 -0.50 0.00 0.00 59.36 59.01 2aaz h GLU 287 Cb 0.17 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 2aaz h GLU 287 CO -0.18 0.63 0.03 0.93 -1.40 0.00 0.00 179.01 179.02 2aaz h GLU 288 N 0.84 0.47 -0.65 2.33 5.08 -1.77 -2.89 114.58 117.99 2aaz h GLU 288 Ca 0.22 -0.13 -0.08 0.00 -1.00 0.00 0.00 59.36 58.37 2aaz h GLU 288 Cb 0.01 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 2aaz h GLU 288 CO -0.04 0.59 0.08 0.82 -1.00 0.00 0.00 179.01 179.47 2aaz h ILE 289 N 0.27 1.26 0.00 3.13 2.04 -0.90 -3.47 117.51 119.84 2aaz h ILE 289 Ca 0.08 -1.06 0.00 0.00 1.00 0.00 0.00 64.86 64.89 2aaz h ILE 289 Cb 0.36 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 2aaz h ILE 289 CO 0.01 0.39 0.00 0.61 0.00 0.00 0.00 178.15 179.16 2aaz n GLY 290 N -0.57 2.25 1.33 5.37 0.00 0.12 -4.07 105.19 109.61 2aaz n GLY 290 Ca 0.04 -0.15 -0.08 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 4.45 -0.33 0.31 1.61 5.68 -1.26 -4.88 116.55 122.12 2aaz n ASP 291 Ca 0.00 -1.89 0.21 0.00 -0.50 0.00 0.00 54.79 52.61 2aaz n ASP 291 Cb 0.00 0.74 1.09 0.00 -1.14 0.00 0.00 41.12 41.81 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 1.44 0.00 -0.24 2.12 6.09 -1.94 -0.61 117.51 124.36 2aaz h ILE 292 Ca -0.10 -0.04 0.00 0.00 -1.37 0.00 0.00 64.86 63.35 2aaz h ILE 292 Cb 0.49 0.97 0.00 0.00 0.47 0.00 0.00 36.82 38.76 2aaz h ILE 292 CO 0.14 0.00 0.00 0.47 -3.07 0.00 0.00 178.15 175.69 2aaz n ASP 293 N -2.96 2.57 -1.18 2.19 8.00 -1.26 -4.29 116.55 119.62 2aaz n ASP 293 Ca -0.02 -1.85 0.12 0.00 0.71 0.00 0.00 54.79 53.74 2aaz n ASP 293 Cb 0.09 -0.15 0.22 0.00 -0.02 0.00 0.00 41.12 41.26 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 1.32 1.81 3.80 0.44 0.00 -0.24 -4.99 105.19 107.33 2aaz n GLY 294 Ca 0.17 -0.75 -0.34 0.00 0.00 0.00 0.00 46.02 45.11 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 -1.45 3.17 0.10 1.61 0.40 -1.26 -4.79 117.98 115.76 2aaz s PHE 295 Ca 0.40 1.60 0.05 0.00 -0.60 0.00 0.00 56.93 58.38 2aaz s PHE 295 Cb 0.23 -2.98 -0.03 0.00 0.51 0.00 0.00 43.02 40.75 2aaz s PHE 295 CO 0.32 -0.49 -0.13 0.15 0.70 0.00 0.00 175.22 175.77 2aaz s LYS 296 N -3.11 0.90 0.22 0.44 1.02 -1.26 -5.05 119.74 112.90 2aaz s LYS 296 Ca 0.64 -1.11 -0.09 0.00 0.02 0.00 0.00 55.97 55.43 2aaz s LYS 296 Cb -0.14 -0.79 0.32 0.00 -0.52 0.00 0.00 37.83 36.70 2aaz s LYS 296 CO 0.18 0.16 1.69 0.28 -0.92 0.00 0.00 175.35 176.74 2aaz h VAL 297 N 3.83 0.58 0.00 3.17 2.07 -1.98 0.80 116.25 124.73 2aaz h VAL 297 Ca -0.40 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.05 2aaz h VAL 297 Cb 1.19 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 2aaz h VAL 297 CO 0.47 0.04 0.00 -1.84 0.02 0.00 0.00 177.57 176.26 2aaz n GLU 298 N -5.17 0.05 0.17 1.57 0.00 -1.26 -1.98 120.64 114.02 2aaz n GLU 298 Ca 0.10 0.30 0.06 0.00 0.00 0.00 0.00 57.16 57.61 2aaz n GLU 298 Cb 0.35 -1.50 0.19 0.00 0.00 0.00 0.00 31.44 30.48 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 -2.73 -1.84 3.32 -1.23 -3.43 116.42 110.51 2aaz h ASP 299 Ca 0.00 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 56.46 2aaz h ASP 299 Cb 0.07 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 39.51 2aaz h ASP 299 CO 0.00 0.37 0.77 -0.36 -1.72 0.00 0.00 179.24 178.29 2aaz s PHE 300 N -3.23 2.56 -0.50 4.55 0.40 -0.84 -0.85 117.98 120.07 2aaz s PHE 300 Ca 0.03 -0.17 -0.13 0.00 -0.60 0.00 0.00 56.93 56.07 2aaz s PHE 300 Cb 0.08 -4.38 0.12 0.00 0.51 0.00 0.00 43.02 39.35 2aaz s PHE 300 CO 0.70 -1.73 0.42 0.08 0.70 0.00 0.00 175.22 175.40 2aaz s VAL 301 N 4.70 4.73 -0.34 -0.44 1.01 -0.11 -4.98 120.40 124.96 2aaz s VAL 301 Ca 0.30 -1.61 -0.17 0.00 0.00 0.00 0.00 61.98 60.51 2aaz s VAL 301 Cb -0.12 -4.05 -0.01 0.00 0.00 0.00 0.00 36.38 32.20 2aaz s VAL 301 CO 0.15 -0.80 0.45 -0.69 0.00 0.00 0.00 175.10 174.21 2aaz s VAL 302 N 1.49 5.08 0.06 2.92 1.01 -1.26 -0.61 120.40 129.09 2aaz s VAL 302 Ca 0.04 0.25 0.07 0.00 0.00 0.00 0.00 61.98 62.34 2aaz s VAL 302 Cb -0.28 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 2aaz s VAL 302 CO 0.01 -0.14 -0.13 -1.83 0.00 0.00 0.00 175.10 173.01 2aaz s GLU 303 N 2.23 2.14 0.00 2.72 -1.05 -0.23 -4.64 118.70 119.88 2aaz s GLU 303 Ca 0.16 -0.97 0.00 0.00 -0.15 0.00 0.00 54.97 54.01 2aaz s GLU 303 Cb -0.16 -2.28 0.00 0.00 -0.44 0.00 0.00 34.13 31.25 2aaz s GLU 303 CO 0.12 0.53 0.00 0.41 0.95 0.00 0.00 175.26 177.28 2aaz n GLY 304 N 1.17 0.46 3.63 -3.83 0.00 -1.26 -1.13 105.19 104.24 2aaz n GLY 304 Ca -0.15 -0.69 -0.43 0.00 0.00 0.00 0.00 46.02 44.75 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 2.98 -0.52 1.61 6.04 -1.26 -4.34 117.35 119.86 2aaz s TYR 305 Ca 0.00 1.07 0.06 0.00 0.04 0.00 0.00 57.07 58.24 2aaz s TYR 305 Cb 0.00 -3.79 0.22 0.00 -1.04 0.00 0.00 41.96 37.34 2aaz s TYR 305 CO 0.00 -1.11 0.53 1.63 -1.54 0.00 0.00 175.55 175.06 2aaz n LYS 306 N 7.05 1.28 -2.28 4.97 5.02 -1.26 -5.08 118.16 127.86 2aaz n LYS 306 Ca 0.13 -3.84 -0.28 0.00 -2.02 0.00 0.00 58.31 52.31 2aaz n LYS 306 Cb 0.47 -1.80 0.03 0.00 -0.02 0.00 0.00 35.03 33.71 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 -1.29 3.03 0.40 1.97 0.04 -1.26 -4.72 135.00 133.16 2aaz s PRO 307 Ca 0.34 0.17 -0.07 0.00 0.04 0.00 0.00 61.00 61.48 2aaz s PRO 307 Cb 0.09 -2.22 0.09 0.00 0.04 0.00 0.00 34.50 32.51 2aaz s PRO 307 CO -0.12 -0.71 0.54 0.91 0.04 0.00 0.00 177.00 177.67 2aaz n TRP 308 N -2.65 -3.98 -1.00 0.56 7.02 0.12 -4.89 117.44 112.63 2aaz n TRP 308 Ca 0.05 -0.48 -0.30 0.00 -1.02 0.00 0.00 57.50 55.74 2aaz n TRP 308 Cb 0.57 -0.42 0.15 0.00 -2.42 0.00 0.00 31.31 29.20 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 -4.17 1.63 0.65 6.99 0.00 -1.26 -2.68 107.32 108.48 2aaz s GLY 309 Ca 0.31 0.15 -0.15 0.00 0.00 0.00 0.00 44.72 45.02 2aaz s GLY 309 CO 0.21 0.62 1.11 -1.59 0.00 0.00 0.00 173.10 173.46 2aaz s LYS 310 N -4.79 2.87 -0.18 2.90 -2.85 -1.26 -2.96 119.74 113.47 2aaz s LYS 310 Ca 0.64 1.39 0.00 0.00 -1.00 0.00 0.00 55.97 57.01 2aaz s LYS 310 Cb -0.20 -1.96 0.04 0.00 -2.06 0.00 0.00 37.83 33.65 2aaz s LYS 310 CO 0.58 -1.19 -0.08 0.42 0.10 0.00 0.00 175.35 175.17 2aaz s ILE 311 N -2.31 1.39 0.07 3.79 1.01 -1.26 -4.88 121.20 119.01 2aaz s ILE 311 Ca 0.67 -0.79 -0.31 0.00 0.00 0.00 0.00 60.65 60.22 2aaz s ILE 311 Cb -0.20 -1.49 -0.06 0.00 0.01 0.00 0.00 42.46 40.71 2aaz s ILE 311 CO 0.40 0.19 1.27 -1.81 0.00 0.00 0.00 174.94 174.99 2aaz s ASP 312 N 1.51 6.98 -0.09 3.58 1.01 -1.26 -5.02 116.67 123.39 2aaz s ASP 312 Ca 0.00 2.12 -0.04 0.00 0.71 0.00 0.00 52.55 55.34 2aaz s ASP 312 Cb -0.15 -2.58 0.05 0.00 1.01 0.00 0.00 42.92 41.24 2aaz s ASP 312 CO -0.08 -0.54 0.20 -0.04 0.21 0.00 0.00 175.17 174.92 2aaz s MET 313 N 1.16 0.14 0.19 8.23 -1.94 -1.26 -4.89 119.30 120.93 2aaz s MET 313 Ca 0.61 0.50 -0.28 0.00 -1.71 0.00 0.00 55.69 54.81 2aaz s MET 313 Cb -0.32 -0.15 -0.08 0.00 2.01 0.00 0.00 34.83 36.29 2aaz s MET 313 CO 0.29 -0.19 0.87 0.21 -0.01 0.00 0.00 175.02 176.19 2aaz s LYS 314 N 1.45 4.72 -0.02 2.03 2.20 -1.26 -5.04 119.74 123.82 2aaz s LYS 314 Ca -0.07 1.34 -0.19 0.00 -0.36 0.00 0.00 55.97 56.70 2aaz s LYS 314 Cb -0.11 -3.28 -0.05 0.00 -1.51 0.00 0.00 37.83 32.87 2aaz s LYS 314 CO -0.07 0.50 0.53 1.41 -0.36 0.00 0.00 175.35 177.36 2aaz s MET 315 N -1.02 4.23 -0.31 4.03 -2.45 -1.26 -4.97 119.30 117.55 2aaz s MET 315 Ca 0.39 0.60 -0.18 0.00 -1.25 0.00 0.00 55.69 55.26 2aaz s MET 315 Cb -0.24 -3.33 -0.02 0.00 1.25 0.00 0.00 34.83 32.49 2aaz s MET 315 CO 0.29 0.41 0.49 -1.12 1.05 0.00 0.00 175.02 176.15 2aaz s SER 316 N -0.28 6.34 0.00 1.11 0.01 -1.26 -5.16 113.70 114.46 2aaz s SER 316 Ca 0.28 0.19 0.15 0.00 1.31 0.00 0.00 55.95 57.88 2aaz s SER 316 Cb -0.17 -2.26 0.90 0.00 0.21 0.00 0.00 66.02 64.69 2aaz s SER 316 CO 0.15 -0.38 1.31 0.00 0.41 0.00 0.00 173.24 174.73