#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nsg s THR 2 N 0.00 3.24 0.40 2.03 -1.32 -1.26 -5.06 115.64 113.67 2nsg s THR 2 Ca 0.00 0.40 0.05 0.00 -1.21 0.00 0.00 61.69 60.94 2nsg s THR 2 Cb 0.00 -2.87 0.00 0.00 -1.51 0.00 0.00 72.50 68.12 2nsg s THR 2 CO 0.00 -0.53 0.56 0.42 -2.21 0.00 0.00 174.62 172.86 2nsg s THR 3 N -2.90 3.67 0.29 5.08 -4.23 -1.26 -4.88 115.64 111.41 2nsg s THR 3 Ca 0.61 -0.87 0.02 0.00 -1.18 0.00 0.00 61.69 60.28 2nsg s THR 3 Cb -0.17 -3.29 0.29 0.00 1.34 0.00 0.00 72.50 70.67 2nsg s THR 3 CO 0.56 -0.14 1.83 0.15 -0.54 0.00 0.00 174.62 176.48 2nsg h PHE 4 N 0.66 1.13 0.00 3.99 3.57 -1.96 -2.14 116.94 122.18 2nsg h PHE 4 Ca -0.44 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.08 2nsg h PHE 4 Cb 1.27 -0.35 -0.00 0.00 2.79 0.00 0.00 35.95 39.65 2nsg h PHE 4 CO 0.42 0.42 -0.03 0.45 -2.23 0.00 0.00 178.31 177.33 2nsg h HIS 5 N 0.95 0.00 -0.01 0.41 3.86 -1.95 -2.35 115.15 116.06 2nsg h HIS 5 Ca 0.51 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.72 2nsg h HIS 5 Cb 0.56 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.03 2nsg h HIS 5 CO -0.00 0.03 -0.25 -0.25 0.86 0.00 0.00 177.93 178.32 2nsg n ASP 6 N -3.97 1.46 -4.79 2.45 8.00 -0.81 -4.94 116.55 113.95 2nsg n ASP 6 Ca -0.03 -1.21 -0.32 0.00 0.71 0.00 0.00 54.79 53.94 2nsg n ASP 6 Cb 0.12 0.18 0.04 0.00 -0.02 0.00 0.00 41.12 41.44 2nsg n ASP 6 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2nsg s LEU 7 N -2.38 3.32 0.65 0.64 1.43 -0.89 -5.00 118.68 116.45 2nsg s LEU 7 Ca 0.26 1.85 -0.16 0.00 -1.03 0.00 0.00 54.13 55.04 2nsg s LEU 7 Cb 0.19 -4.53 -0.00 0.00 0.03 0.00 0.00 46.19 41.88 2nsg s LEU 7 CO 0.49 -1.52 1.16 -2.84 0.23 0.00 0.00 176.35 173.86 2nsg s PRO 8 N -4.39 2.72 0.22 1.29 0.02 -1.26 -4.83 135.00 128.78 2nsg s PRO 8 Ca 0.63 1.61 -0.07 0.00 0.02 0.00 0.00 61.00 63.19 2nsg s PRO 8 Cb -0.17 -1.92 0.36 0.00 0.02 0.00 0.00 34.50 32.78 2nsg s PRO 8 CO 0.45 -1.35 1.72 -0.07 -0.33 0.00 0.00 177.00 177.42 2nsg h LEU 9 N 0.26 0.16 -1.29 -5.54 3.38 -1.97 -1.78 115.31 108.54 2nsg h LEU 9 Ca -0.48 0.10 0.03 0.00 0.09 0.00 0.00 57.88 57.62 2nsg h LEU 9 Cb 1.27 0.10 -0.04 0.00 0.09 0.00 0.00 40.66 42.08 2nsg h LEU 9 CO 0.53 0.08 0.50 -0.33 0.09 0.00 0.00 178.44 179.31 2nsg h GLU 10 N 0.37 0.90 -0.06 1.13 4.39 -1.99 0.09 114.58 119.40 2nsg h GLU 10 Ca 0.35 -0.05 -0.14 0.00 0.34 0.00 0.00 59.36 59.86 2nsg h GLU 10 Cb 0.51 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 2nsg h GLU 10 CO -0.38 0.59 -0.60 0.93 -1.16 0.00 0.00 179.01 178.40 2nsg h GLU 11 N 0.92 0.21 -0.47 2.33 5.08 -1.71 -1.20 114.58 119.75 2nsg h GLU 11 Ca 0.30 -0.14 -0.12 0.00 -1.00 0.00 0.00 59.36 58.39 2nsg h GLU 11 Cb 0.04 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 2nsg h GLU 11 CO -0.09 0.75 -0.19 0.00 -1.00 0.00 0.00 179.01 178.48 2nsg h ARG 12 N 0.16 0.95 -0.49 2.33 3.08 -0.69 -1.66 114.38 118.06 2nsg h ARG 12 Ca -0.01 -0.40 -0.10 0.00 0.07 0.00 0.00 59.98 59.54 2nsg h ARG 12 Cb 1.09 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 31.09 2nsg h ARG 12 CO 0.09 1.07 -0.10 1.25 -1.07 0.00 0.00 179.97 181.21 2nsg h LEU 13 N 0.80 0.94 -0.78 3.04 5.85 -0.88 -1.97 115.31 122.31 2nsg h LEU 13 Ca 0.11 -0.35 -0.03 0.00 0.84 0.00 0.00 57.88 58.45 2nsg h LEU 13 Cb 0.76 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.50 2nsg h LEU 13 CO 0.06 1.07 0.37 0.74 -0.34 0.00 0.00 178.44 180.34 2nsg h THR 14 N 0.79 1.25 -0.35 1.05 2.02 -1.09 -0.72 112.91 115.86 2nsg h THR 14 Ca 0.13 -0.69 -0.10 0.00 0.77 0.00 0.00 66.41 66.52 2nsg h THR 14 Cb 0.65 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 2nsg h THR 14 CO 0.04 0.29 -0.18 -0.07 0.37 0.00 0.00 175.52 175.97 2nsg h LEU 15 N 1.09 0.64 -0.41 2.58 3.38 -1.13 0.92 115.31 122.40 2nsg h LEU 15 Ca 0.27 -0.21 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 2nsg h LEU 15 Cb 0.12 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2nsg h LEU 15 CO -0.03 0.83 -0.23 0.00 0.09 0.00 0.00 178.44 179.11 2nsg h ALA 16 N 1.22 0.57 -0.48 1.53 0.00 -0.94 -0.80 119.26 120.37 2nsg h ALA 16 Ca 0.09 -0.39 -0.14 0.00 0.00 0.00 0.00 54.91 54.48 2nsg h ALA 16 Cb 0.64 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2nsg h ALA 16 CO 0.04 0.56 -0.23 0.00 0.00 0.00 0.00 179.25 179.62 2nsg h ARG 17 N 0.68 1.00 -0.66 0.00 3.08 -0.91 -1.33 114.38 116.24 2nsg h ARG 17 Ca 0.09 -0.44 -0.07 0.00 0.07 0.00 0.00 59.98 59.63 2nsg h ARG 17 Cb 0.79 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.79 2nsg h ARG 17 CO 0.07 1.12 0.14 -0.07 -1.07 0.00 0.00 179.97 180.15 2nsg h LEU 18 N 0.86 1.02 -0.77 3.04 3.38 -0.74 -1.32 115.31 120.79 2nsg h LEU 18 Ca 0.11 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 2nsg h LEU 18 Cb 0.82 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 2nsg h LEU 18 CO 0.07 1.00 0.26 1.23 0.09 0.00 0.00 178.44 181.10 2nsg h GLY 19 N 1.00 1.26 0.91 0.83 0.00 -0.95 -0.94 103.07 105.19 2nsg h GLY 19 Ca 0.21 -0.73 -0.04 0.00 0.00 0.00 0.00 47.33 46.77 2nsg h GLY 19 CO 0.01 0.68 0.05 -0.84 0.00 0.00 0.00 176.54 176.44 2nsg h THR 20 N 1.13 1.24 -0.68 4.70 2.02 -0.97 0.80 112.91 121.15 2nsg h THR 20 Ca 0.25 -0.84 -0.04 0.00 0.77 0.00 0.00 66.41 66.55 2nsg h THR 20 Cb 0.28 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.78 2nsg h THR 20 CO -0.01 0.28 0.28 0.28 0.37 0.00 0.00 175.52 176.72 2nsg h SER 21 N 0.41 0.92 -0.08 4.18 0.02 -1.07 0.26 113.55 118.18 2nsg h SER 21 Ca 0.10 -0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 60.92 2nsg h SER 21 Cb 0.36 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.66 2nsg h SER 21 CO 0.01 0.82 0.03 -0.74 -1.14 0.00 0.00 176.83 175.80 2nsg h HIS 22 N 0.98 0.12 -0.36 3.45 6.17 -0.87 -0.77 115.15 123.86 2nsg h HIS 22 Ca 0.23 -0.01 0.00 0.00 0.71 0.00 0.00 60.37 61.31 2nsg h HIS 22 Cb 0.18 -0.03 -0.02 0.00 2.52 0.00 0.00 27.41 30.06 2nsg h HIS 22 CO 0.01 0.23 0.24 -0.92 0.71 0.00 0.00 177.93 178.20 2nsg h TYR 23 N -0.03 0.45 -0.22 5.26 3.20 -0.39 -2.57 116.97 122.68 2nsg h TYR 23 Ca 0.03 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 2nsg h TYR 23 Cb 0.16 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 2nsg h TYR 23 CO -0.02 0.29 0.03 0.77 -1.64 0.00 0.00 178.16 177.59 2nsg h SER 24 N 0.49 0.28 -0.31 -2.11 0.02 -0.33 -1.21 113.55 110.37 2nsg h SER 24 Ca 0.13 -0.03 -0.10 0.00 -0.84 0.00 0.00 61.79 60.96 2nsg h SER 24 Cb -0.06 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 62.40 2nsg h SER 24 CO -0.03 0.30 -0.13 0.03 -1.14 0.00 0.00 176.83 175.86 2nsg h ARG 25 N 0.31 0.75 -0.36 3.45 3.08 -0.75 -0.96 114.38 119.90 2nsg h ARG 25 Ca 0.07 -0.26 -0.14 0.00 0.07 0.00 0.00 59.98 59.73 2nsg h ARG 25 Cb 0.15 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.14 2nsg h ARG 25 CO -0.00 0.85 -0.31 1.96 -1.07 0.00 0.00 179.97 181.40 2nsg h GLN 26 N 0.67 0.85 -0.66 0.04 1.08 -1.00 -2.57 115.11 113.53 2nsg h GLN 26 Ca 0.11 -0.43 -0.04 0.00 -1.45 0.00 0.00 58.65 56.85 2nsg h GLN 26 Cb 0.61 0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 28.01 2nsg h GLN 26 CO 0.04 1.07 0.27 1.25 -0.95 0.00 0.00 178.83 180.50 2nsg h LEU 27 N 0.64 0.88 -1.33 1.46 5.85 -1.04 -1.59 115.31 120.17 2nsg h LEU 27 Ca 0.06 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.63 2nsg h LEU 27 Cb 0.89 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 2nsg h LEU 27 CO 0.08 0.78 0.08 -1.28 -0.34 0.00 0.00 178.44 177.75 2nsg h SER 28 N 0.94 0.48 0.81 1.25 0.87 -1.02 -2.27 113.55 114.62 2nsg h SER 28 Ca 0.22 -0.07 -0.09 0.00 -1.23 0.00 0.00 61.79 60.63 2nsg h SER 28 Cb 0.18 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.00 2nsg h SER 28 CO -0.02 0.50 -0.43 -0.07 -0.53 0.00 0.00 176.83 176.28 2nsg h LEU 29 N 0.52 0.00 -9.53 2.23 3.38 -0.89 -3.43 115.31 107.59 2nsg h LEU 29 Ca 0.12 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.56 2nsg h LEU 29 Cb 0.22 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 2nsg h LEU 29 CO -0.00 0.43 0.48 -0.69 0.09 0.00 0.00 178.44 178.74 2nsg s VAL 30 N -3.60 4.20 0.40 1.22 1.01 -0.85 -5.02 120.40 117.76 2nsg s VAL 30 Ca -0.00 1.69 -0.16 0.00 0.00 0.00 0.00 61.98 63.50 2nsg s VAL 30 Cb 0.11 -4.08 -0.09 0.00 0.00 0.00 0.00 36.38 32.32 2nsg s VAL 30 CO 0.70 0.19 0.85 -1.81 0.00 0.00 0.00 175.10 175.03 2nsg s ASP 31 N 0.61 6.76 0.29 3.32 1.01 -1.26 -4.96 116.67 122.44 2nsg s ASP 31 Ca 0.53 1.44 0.03 0.00 0.71 0.00 0.00 52.55 55.26 2nsg s ASP 31 Cb -0.27 -2.44 0.62 0.00 1.01 0.00 0.00 42.92 41.84 2nsg s ASP 31 CO 0.31 -0.35 1.80 0.78 0.21 0.00 0.00 175.17 177.92 2nsg h ASN 32 N 1.78 0.82 0.35 0.27 4.21 -1.95 0.18 115.58 121.23 2nsg h ASN 32 Ca -0.48 0.07 0.00 0.00 1.21 0.00 0.00 56.30 57.10 2nsg h ASN 32 Cb 1.18 -0.08 0.00 0.00 -1.12 0.00 0.00 38.32 38.30 2nsg h ASN 32 CO 0.63 0.37 0.00 0.00 -1.29 0.00 0.00 177.43 177.14 2nsg h ALA 33 N 1.58 1.00 -0.01 -0.83 0.00 -2.03 -2.33 119.26 116.64 2nsg h ALA 33 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.44 2nsg h ALA 33 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2nsg h ALA 33 CO -0.32 0.00 -0.20 0.39 0.00 0.00 0.00 179.25 179.11 2nsg n GLU 34 N -2.64 1.36 -0.04 0.00 1.02 0.61 -4.33 120.64 116.63 2nsg n GLU 34 Ca -0.01 -0.95 0.01 0.00 -0.02 0.00 0.00 57.16 56.20 2nsg n GLU 34 Cb 0.14 -1.48 0.33 0.00 -0.02 0.00 0.00 31.44 30.41 2nsg n GLU 34 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 2nsg h PHE 35 N 2.32 0.62 0.00 -0.32 -1.00 -1.41 -2.16 116.94 114.99 2nsg h PHE 35 Ca 0.00 -0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.76 2nsg h PHE 35 Cb 0.64 -0.20 0.00 0.00 3.61 0.00 0.00 35.95 40.00 2nsg h PHE 35 CO 0.00 0.47 0.00 0.41 -1.61 0.00 0.00 178.31 177.58 2nsg n GLY 36 N -1.20 -1.24 3.84 -1.45 0.00 -1.26 -1.51 105.19 102.37 2nsg n GLY 36 Ca 0.03 -0.10 -0.30 0.00 0.00 0.00 0.00 46.02 45.65 2nsg n GLY 36 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nsg s GLU 37 N -2.78 2.56 0.36 1.61 0.41 -0.81 -4.73 118.70 115.32 2nsg s GLU 37 Ca 0.18 0.61 -0.28 0.00 -0.41 0.00 0.00 54.97 55.08 2nsg s GLU 37 Cb 0.17 -1.97 -0.10 0.00 -1.78 0.00 0.00 34.13 30.45 2nsg s GLU 37 CO 0.42 -1.28 1.30 -1.01 -0.49 0.00 0.00 175.26 174.20 2nsg s HIS 38 N -3.22 2.97 0.22 1.61 3.76 -1.26 -0.52 115.29 118.84 2nsg s HIS 38 Ca 0.59 1.42 -0.03 0.00 -0.15 0.00 0.00 55.06 56.89 2nsg s HIS 38 Cb -0.13 -3.66 0.05 0.00 1.11 0.00 0.00 32.58 29.95 2nsg s HIS 38 CO 0.53 -1.91 0.30 -1.13 -0.85 0.00 0.00 174.74 171.68 2nsg n SER 39 N 0.51 0.05 -0.17 1.40 3.41 0.14 -4.61 113.62 114.34 2nsg n SER 39 Ca 0.02 -1.12 0.13 0.00 -0.26 0.00 0.00 58.87 57.64 2nsg n SER 39 Cb 0.43 -0.22 0.49 0.00 -0.26 0.00 0.00 64.21 64.64 2nsg n SER 39 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2nsg n LEU 40 N 0.00 0.73 -4.62 1.04 4.77 0.07 -4.74 117.00 114.25 2nsg n LEU 40 Ca 0.04 -0.11 -0.40 0.00 -0.03 0.00 0.00 56.01 55.50 2nsg n LEU 40 Cb 0.13 -0.16 -0.07 0.00 -2.33 0.00 0.00 43.42 41.00 2nsg n LEU 40 CO 0.10 0.14 0.37 -0.22 -1.33 0.00 0.00 177.39 176.45 2nsg s LEU 41 N -2.51 4.06 0.05 2.23 0.20 -1.26 -5.01 118.68 116.43 2nsg s LEU 41 Ca 0.26 0.68 -0.34 0.00 0.69 0.00 0.00 54.13 55.42 2nsg s LEU 41 Cb 0.20 -2.83 -0.13 0.00 -0.43 0.00 0.00 46.19 43.00 2nsg s LEU 41 CO 0.50 -0.36 1.73 -0.62 -0.29 0.00 0.00 176.35 177.32 2nsg n GLU 42 N 5.68 2.21 -0.35 1.98 1.02 -1.26 -2.08 120.64 127.85 2nsg n GLU 42 Ca -0.01 0.81 0.00 0.00 -0.02 0.00 0.00 57.16 57.93 2nsg n GLU 42 Cb 0.49 -2.62 0.00 0.00 -0.02 0.00 0.00 31.44 29.29 2nsg n GLU 42 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2nsg n GLY 43 N 3.92 0.71 3.05 0.62 0.00 -1.26 -5.05 105.19 107.18 2nsg n GLY 43 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 2nsg n GLY 43 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2nsg s TRP 44 N -2.50 2.00 0.81 1.61 0.52 -0.88 -5.09 118.94 115.40 2nsg s TRP 44 Ca 0.00 -0.97 -0.11 0.00 0.02 0.00 0.00 56.10 55.03 2nsg s TRP 44 Cb 0.00 -1.45 0.08 0.00 -1.15 0.00 0.00 33.47 30.94 2nsg s TRP 44 CO 0.00 -0.51 1.10 0.95 0.02 0.00 0.00 176.95 178.51 2nsg s THR 45 N 1.08 3.04 0.27 2.01 -4.23 -1.26 0.25 115.64 116.79 2nsg s THR 45 Ca -0.05 0.34 -0.04 0.00 -1.18 0.00 0.00 61.69 60.77 2nsg s THR 45 Cb -0.15 -3.05 0.20 0.00 1.34 0.00 0.00 72.50 70.85 2nsg s THR 45 CO -0.03 -0.44 1.88 0.03 -0.54 0.00 0.00 174.62 175.51 2nsg h ARG 46 N -1.14 1.06 -0.59 3.99 3.08 -0.57 -2.59 114.38 117.62 2nsg h ARG 46 Ca -0.47 -0.14 0.05 0.00 0.07 0.00 0.00 59.98 59.49 2nsg h ARG 46 Cb 1.27 -0.20 -0.05 0.00 0.08 0.00 0.00 29.97 31.07 2nsg h ARG 46 CO 0.58 0.80 0.32 0.77 -1.07 0.00 0.00 179.97 181.38 2nsg h SER 47 N 1.06 0.47 -0.22 7.04 0.02 -1.54 0.18 113.55 120.56 2nsg h SER 47 Ca 0.26 0.03 0.01 0.00 -0.84 0.00 0.00 61.79 61.25 2nsg h SER 47 Cb 0.08 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.54 2nsg h SER 47 CO -0.04 0.31 0.12 0.45 -1.14 0.00 0.00 176.83 176.53 2nsg h HIS 48 N 0.60 0.22 0.14 3.45 3.86 -1.76 -0.76 115.15 120.91 2nsg h HIS 48 Ca 0.26 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.47 2nsg h HIS 48 Cb 0.15 -0.07 -0.00 0.00 1.06 0.00 0.00 27.41 28.55 2nsg h HIS 48 CO -0.09 0.13 -0.08 1.25 0.86 0.00 0.00 177.93 180.00 2nsg h LEU 49 N 0.25 -0.20 -0.67 2.43 5.85 -1.03 0.40 115.31 122.34 2nsg h LEU 49 Ca 0.09 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.87 2nsg h LEU 49 Cb 0.01 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.05 2nsg h LEU 49 CO -0.05 -0.14 0.38 0.40 -0.34 0.00 0.00 178.44 178.70 2nsg h ILE 50 N -0.22 1.00 -0.19 4.05 2.04 -0.54 -0.85 117.51 122.80 2nsg h ILE 50 Ca -0.01 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.58 2nsg h ILE 50 Cb 0.18 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 2nsg h ILE 50 CO 0.02 0.13 0.04 0.00 0.00 0.00 0.00 178.15 178.34 2nsg h ALA 51 N 1.33 0.25 -0.88 1.87 0.00 -0.93 -2.67 119.26 118.23 2nsg h ALA 51 Ca 0.29 -0.16 0.09 0.00 0.00 0.00 0.00 54.91 55.14 2nsg h ALA 51 Cb 0.15 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.79 2nsg h ALA 51 CO -0.16 -0.10 0.53 0.00 0.00 0.00 0.00 179.25 179.52 2nsg h ALA 52 N 0.84 1.27 -0.66 0.00 0.00 -0.35 -0.42 119.26 119.95 2nsg h ALA 52 Ca 0.06 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2nsg h ALA 52 Cb 0.28 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2nsg h ALA 52 CO 0.00 0.18 0.28 0.28 0.00 0.00 0.00 179.25 180.00 2nsg h VAL 53 N 0.90 1.23 -0.48 0.00 2.07 -1.04 -0.55 116.25 118.38 2nsg h VAL 53 Ca 0.42 -0.70 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 2nsg h VAL 53 Cb 0.35 0.47 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 2nsg h VAL 53 CO -0.23 0.28 0.01 0.00 0.02 0.00 0.00 177.57 177.65 2nsg h ALA 54 N 1.12 0.64 0.00 1.67 0.00 -0.98 -2.12 119.26 119.60 2nsg h ALA 54 Ca 0.22 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 2nsg h ALA 54 Cb 0.17 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2nsg h ALA 54 CO -0.02 0.43 -0.19 1.88 0.00 0.00 0.00 179.25 181.35 2nsg h TYR 55 N 0.69 0.00 -0.24 0.00 0.05 -0.84 -1.51 116.97 115.12 2nsg h TYR 55 Ca 0.14 0.00 -0.17 0.00 0.05 0.00 0.00 58.73 58.75 2nsg h TYR 55 Cb 0.49 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.22 2nsg h TYR 55 CO 0.04 0.19 -0.53 -0.97 -1.05 0.00 0.00 178.16 175.84 2nsg h ASN 56 N 0.00 0.78 -0.54 3.88 -0.73 -0.66 -0.61 115.58 117.70 2nsg h ASN 56 Ca -0.00 -0.41 -0.03 0.00 1.87 0.00 0.00 56.30 57.73 2nsg h ASN 56 Cb 0.49 -0.22 -0.02 0.00 0.27 0.00 0.00 38.32 38.83 2nsg h ASN 56 CO 0.02 1.16 0.20 0.00 -0.37 0.00 0.00 177.43 178.44 2nsg h ALA 57 N 0.86 0.70 -0.52 1.57 0.00 -0.65 -0.50 119.26 120.73 2nsg h ALA 57 Ca 0.02 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 2nsg h ALA 57 Cb 1.09 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 2nsg h ALA 57 CO 0.11 0.32 0.15 0.82 0.00 0.00 0.00 179.25 180.65 2nsg h ILE 58 N 0.73 1.24 -0.94 0.00 2.04 -1.25 -1.29 117.51 118.03 2nsg h ILE 58 Ca 0.18 -0.81 0.00 0.00 1.00 0.00 0.00 64.86 65.22 2nsg h ILE 58 Cb 0.22 0.78 -0.05 0.00 -0.74 0.00 0.00 36.82 37.04 2nsg h ILE 58 CO -0.01 0.30 0.59 0.00 0.00 0.00 0.00 178.15 179.03 2nsg h ALA 59 N 1.01 1.28 0.00 1.87 0.00 -0.72 -0.96 119.26 121.73 2nsg h ALA 59 Ca 0.16 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2nsg h ALA 59 Cb 0.30 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2nsg h ALA 59 CO -0.00 0.64 -0.47 -0.07 0.00 0.00 0.00 179.25 179.35 2nsg h LEU 60 N 1.28 0.00 -0.89 0.00 3.38 -0.83 -2.35 115.31 115.89 2nsg h LEU 60 Ca 0.34 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.24 2nsg h LEU 60 Cb -0.10 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2nsg h LEU 60 CO -0.07 0.47 0.05 0.00 0.09 0.00 0.00 178.44 178.99 2nsg h ASN 62 N 0.82 0.39 -0.53 0.00 2.35 -0.76 -1.13 115.58 116.72 2nsg h ASN 62 Ca 0.16 -0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.85 2nsg h ASN 62 Cb 0.42 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 38.66 2nsg h ASN 62 CO 0.01 0.31 0.24 -0.07 -1.65 0.00 0.00 177.43 176.28 2nsg h LEU 63 N 0.44 0.73 -0.89 1.61 3.38 -1.24 -0.83 115.31 118.51 2nsg h LEU 63 Ca 0.12 -0.08 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 2nsg h LEU 63 Cb -0.02 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 2nsg h LEU 63 CO -0.02 0.65 -0.50 0.24 0.09 0.00 0.00 178.44 178.89 2nsg h MET 64 N 0.81 0.13 -0.30 1.13 2.86 -0.91 -0.65 114.93 117.99 2nsg h MET 64 Ca 0.20 -0.07 -0.16 0.00 -2.06 0.00 0.00 59.70 57.60 2nsg h MET 64 Cb 0.13 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.79 2nsg h MET 64 CO -0.02 0.60 -0.46 1.25 1.06 0.00 0.00 176.91 179.34 2nsg h HIS 65 N 0.10 0.98 -0.44 -0.22 -0.00 -0.48 -0.52 115.15 114.57 2nsg h HIS 65 Ca 0.00 -0.32 -0.02 0.00 -0.00 0.00 0.00 60.37 60.04 2nsg h HIS 65 Cb 0.92 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 28.12 2nsg h HIS 65 CO 0.01 1.11 0.20 2.35 -0.00 0.00 0.00 177.93 181.60 2nsg h TRP 66 N 0.64 0.65 -0.49 5.26 2.91 -0.95 -0.34 115.95 123.64 2nsg h TRP 66 Ca 0.04 -0.04 -0.03 0.00 1.13 0.00 0.00 58.89 59.99 2nsg h TRP 66 Cb 1.04 -0.20 -0.02 0.00 -0.51 0.00 0.00 29.16 29.47 2nsg h TRP 66 CO 0.06 0.54 0.17 0.00 -1.03 0.00 0.00 178.44 178.18 2nsg h ALA 67 N 1.05 0.64 0.00 2.65 0.00 -0.92 0.32 119.26 123.00 2nsg h ALA 67 Ca 0.15 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2nsg h ALA 67 Cb 0.14 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 2nsg h ALA 67 CO -0.02 0.28 -0.03 -0.91 0.00 0.00 0.00 179.25 178.57 2nsg h ASN 68 N 0.66 0.00 0.00 0.00 4.21 -0.95 -3.34 115.58 116.16 2nsg h ASN 68 Ca 0.16 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.67 2nsg h ASN 68 Cb 0.24 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.44 2nsg h ASN 68 CO -0.01 0.03 -1.37 0.35 -1.29 0.00 0.00 177.43 175.15 2nsg n THR 69 N -3.11 0.00 -0.91 2.81 -2.24 -0.15 -4.98 114.28 105.70 2nsg n THR 69 Ca 0.04 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 2nsg n THR 69 Cb 0.54 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.12 2nsg n THR 69 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2nsg n GLY 70 N 1.76 0.94 3.56 3.38 0.00 0.11 -5.00 105.19 109.95 2nsg n GLY 70 Ca -0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 2nsg n GLY 70 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nsg s GLU 71 N -0.09 3.84 0.04 1.61 2.02 -1.20 -5.01 118.70 119.92 2nsg s GLU 71 Ca 0.00 -0.39 -0.35 0.00 0.02 0.00 0.00 54.97 54.25 2nsg s GLU 71 Cb 0.00 -3.64 -0.14 0.00 0.10 0.00 0.00 34.13 30.45 2nsg s GLU 71 CO 0.00 -0.22 1.61 -1.91 0.02 0.00 0.00 175.26 174.76 2nsg n GLU 72 N 5.05 1.82 -3.42 1.61 2.13 -1.26 -4.11 120.64 122.45 2nsg n GLU 72 Ca -0.14 0.66 -0.20 0.00 0.66 0.00 0.00 57.16 58.14 2nsg n GLU 72 Cb 0.52 -2.41 -0.10 0.00 0.27 0.00 0.00 31.44 29.71 2nsg n GLU 72 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 2nsg s THR 73 N 1.77 -0.29 0.81 6.31 2.01 -1.26 -5.00 115.64 120.00 2nsg s THR 73 Ca 0.85 -0.73 -0.13 0.00 0.31 0.00 0.00 61.69 61.99 2nsg s THR 73 Cb -0.79 -0.94 0.08 0.00 0.01 0.00 0.00 72.50 70.86 2nsg s THR 73 CO 0.46 -0.58 1.14 -0.81 -0.69 0.00 0.00 174.62 174.14 2nsg n PRO 74 N 5.01 0.14 -0.13 4.92 -0.04 -1.26 -4.05 135.00 139.59 2nsg n PRO 74 Ca 0.01 0.12 -0.04 0.00 -0.04 0.00 0.00 63.50 63.55 2nsg n PRO 74 Cb 0.45 -2.39 0.04 0.00 -0.04 0.00 0.00 33.50 31.56 2nsg n PRO 74 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 2nsg h MET 75 N -0.95 0.22 -5.58 0.54 2.86 -1.79 -3.44 114.93 106.79 2nsg h MET 75 Ca -0.46 -0.01 -0.45 0.00 -2.06 0.00 0.00 59.70 56.71 2nsg h MET 75 Cb 1.30 -0.05 -0.21 0.00 0.06 0.00 0.00 31.60 32.70 2nsg h MET 75 CO 0.45 0.15 -0.79 0.71 1.06 0.00 0.00 176.91 178.49 2nsg s TYR 76 N -6.15 1.39 0.15 -0.22 2.02 -1.26 -4.39 117.35 108.89 2nsg s TYR 76 Ca -0.13 -0.45 -0.16 0.00 -0.37 0.00 0.00 57.07 55.95 2nsg s TYR 76 Cb 0.14 -0.77 0.04 0.00 -0.40 0.00 0.00 41.96 40.97 2nsg s TYR 76 CO 0.72 0.10 1.78 0.28 -1.57 0.00 0.00 175.55 176.86 2nsg h VAL 77 N 4.19 1.00 -2.14 0.71 2.07 -1.95 -3.46 116.25 116.66 2nsg h VAL 77 Ca -0.42 -0.14 0.19 0.00 0.82 0.00 0.00 66.70 67.14 2nsg h VAL 77 Cb 1.19 0.56 -0.11 0.00 -1.52 0.00 0.00 31.29 31.41 2nsg h VAL 77 CO 0.40 0.07 0.56 -0.94 0.02 0.00 0.00 177.57 177.69 2nsg s SER 78 N -5.45 -0.20 0.22 0.57 1.04 -1.26 -4.99 113.70 103.63 2nsg s SER 78 Ca -0.13 -0.24 -0.08 0.00 0.48 0.00 0.00 55.95 55.98 2nsg s SER 78 Cb 0.11 0.39 0.23 0.00 0.10 0.00 0.00 66.02 66.86 2nsg s SER 78 CO 0.72 -0.70 1.87 -0.65 0.98 0.00 0.00 173.24 175.45 2nsg h PRO 79 N 2.00 0.97 0.74 4.02 0.11 -2.00 -1.40 132.00 136.44 2nsg h PRO 79 Ca -0.24 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 65.78 2nsg h PRO 79 Cb 1.23 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2nsg h PRO 79 CO 0.27 0.64 -0.39 0.93 -0.21 0.00 0.00 178.00 179.24 2nsg h GLU 80 N 1.00 -1.00 -0.95 1.05 3.07 -2.00 -2.39 114.58 113.35 2nsg h GLU 80 Ca 0.32 0.07 0.17 0.00 -0.50 0.00 0.00 59.36 59.41 2nsg h GLU 80 Cb 0.01 0.23 -0.08 0.00 -0.84 0.00 0.00 28.75 28.06 2nsg h GLU 80 CO -0.11 -0.67 0.60 0.00 -1.40 0.00 0.00 179.01 177.44 2nsg h ALA 81 N -0.80 1.79 0.24 3.43 0.00 -1.90 0.22 119.26 122.25 2nsg h ALA 81 Ca -0.10 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2nsg h ALA 81 Cb 0.81 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2nsg h ALA 81 CO 0.14 -0.09 -0.28 -0.09 0.00 0.00 0.00 179.25 178.93 2nsg h ARG 82 N 0.72 -0.51 -0.80 0.00 2.43 -1.01 -0.61 114.38 114.60 2nsg h ARG 82 Ca 0.51 0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.76 2nsg h ARG 82 Cb 0.83 0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 30.44 2nsg h ARG 82 CO -0.27 -0.34 0.50 -0.91 -1.51 0.00 0.00 179.97 177.44 2nsg h ASN 83 N -0.53 0.80 -0.33 -3.80 2.35 -0.90 -1.95 115.58 111.22 2nsg h ASN 83 Ca -0.03 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.71 2nsg h ASN 83 Cb 0.47 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.66 2nsg h ASN 83 CO -0.05 0.53 0.16 -0.33 -1.65 0.00 0.00 177.43 176.09 2nsg h GLU 84 N 0.94 0.54 -0.01 0.81 5.08 -0.87 0.13 114.58 121.18 2nsg h GLU 84 Ca 0.33 -0.06 -0.23 0.00 -1.00 0.00 0.00 59.36 58.40 2nsg h GLU 84 Cb 0.09 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 29.24 2nsg h GLU 84 CO -0.14 0.44 -0.94 1.49 -1.00 0.00 0.00 179.01 178.86 2nsg h GLU 85 N 0.54 0.50 -0.55 2.33 4.81 -0.38 -2.08 114.58 119.74 2nsg h GLU 85 Ca 0.13 -0.52 -0.09 0.00 -0.13 0.00 0.00 59.36 58.76 2nsg h GLU 85 Cb 0.10 0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 2nsg h GLU 85 CO -0.01 1.15 0.01 0.82 -0.73 0.00 0.00 179.01 180.25 2nsg h ILE 86 N 0.29 1.26 -0.45 2.32 2.04 -0.92 0.93 117.51 122.97 2nsg h ILE 86 Ca -0.09 -1.08 0.00 0.00 1.00 0.00 0.00 64.86 64.69 2nsg h ILE 86 Cb 1.57 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 38.45 2nsg h ILE 86 CO 0.17 0.39 0.29 0.00 0.00 0.00 0.00 178.15 179.00 2nsg h ALA 87 N 1.13 0.57 0.40 1.87 0.00 -0.91 -0.50 119.26 121.81 2nsg h ALA 87 Ca 0.16 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2nsg h ALA 87 Cb 0.50 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2nsg h ALA 87 CO 0.02 0.03 -0.19 -0.92 0.00 0.00 0.00 179.25 178.19 2nsg h TYR 88 N 0.61 -0.50 -0.79 0.00 3.20 -0.91 -3.09 116.97 115.48 2nsg h TYR 88 Ca 0.16 -0.01 0.13 0.00 3.14 0.00 0.00 58.73 62.15 2nsg h TYR 88 Cb -0.05 0.17 -0.06 0.00 1.54 0.00 0.00 36.73 38.33 2nsg h TYR 88 CO -0.04 -0.24 0.52 0.78 -1.64 0.00 0.00 178.16 177.54 2nsg h GLY 89 N -0.67 0.93 2.00 1.82 0.00 -0.66 -1.09 103.07 105.39 2nsg h GLY 89 Ca -0.06 -0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.03 2nsg h GLY 89 CO 0.09 0.10 0.00 1.48 0.00 0.00 0.00 176.54 178.21 2nsg h SER 90 N 0.58 0.00 1.03 0.19 4.64 -1.00 -2.28 113.55 116.70 2nsg h SER 90 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 2nsg h SER 90 Cb 0.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.78 2nsg h SER 90 CO -0.15 0.00 -0.74 0.71 -0.87 0.00 0.00 176.83 175.79 2nsg h THR 91 N 0.00 0.00 -4.17 2.95 1.35 -1.24 -3.43 112.91 108.37 2nsg h THR 91 Ca 0.00 -0.77 -0.53 0.00 -0.55 0.00 0.00 66.41 64.56 2nsg h THR 91 Cb 0.20 1.35 0.15 0.00 -1.73 0.00 0.00 68.15 68.12 2nsg h THR 91 CO 0.00 0.00 0.40 -0.76 -0.25 0.00 0.00 175.52 174.91 2nsg s LEU 92 N -4.92 3.33 0.69 3.87 1.43 -0.86 -4.97 118.68 117.25 2nsg s LEU 92 Ca 0.03 2.36 -0.15 0.00 -1.03 0.00 0.00 54.13 55.34 2nsg s LEU 92 Cb 0.11 -4.59 0.02 0.00 0.03 0.00 0.00 46.19 41.75 2nsg s LEU 92 CO 0.75 -2.23 1.14 0.54 0.23 0.00 0.00 176.35 176.78 2nsg s ASN 93 N -2.01 4.76 0.22 2.29 4.22 -1.26 -4.80 114.94 118.36 2nsg s ASN 93 Ca 0.75 2.13 -0.12 0.00 -2.14 0.00 0.00 52.86 53.47 2nsg s ASN 93 Cb -0.29 -2.57 0.28 0.00 1.28 0.00 0.00 41.25 39.95 2nsg s ASN 93 CO 0.45 -1.87 1.62 -0.65 -2.04 0.00 0.00 177.10 174.61 2nsg h PRO 94 N -0.09 0.01 -0.28 3.55 0.11 -1.93 -1.64 132.00 131.72 2nsg h PRO 94 Ca -0.47 -0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.57 2nsg h PRO 94 Cb 1.26 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.36 2nsg h PRO 94 CO 0.52 0.01 -0.14 -0.44 -0.21 0.00 0.00 178.00 177.74 2nsg h ASP 95 N 0.01 0.46 -0.71 -2.05 3.32 -1.97 -0.98 116.42 114.51 2nsg h ASP 95 Ca 0.34 -0.12 -0.06 0.00 0.02 0.00 0.00 57.03 57.21 2nsg h ASP 95 Cb 0.52 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.92 2nsg h ASP 95 CO -0.69 0.63 0.22 0.00 -1.72 0.00 0.00 179.24 177.68 2nsg h ALA 96 N 1.42 1.03 -0.46 3.45 0.00 -1.68 -1.13 119.26 121.89 2nsg h ALA 96 Ca 0.08 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.66 2nsg h ALA 96 Cb 0.50 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2nsg h ALA 96 CO 0.03 0.65 -0.13 -0.07 0.00 0.00 0.00 179.25 179.73 2nsg h LEU 97 N 1.07 0.91 -0.92 0.00 3.38 -0.87 -1.10 115.31 117.79 2nsg h LEU 97 Ca 0.23 -0.37 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 2nsg h LEU 97 Cb 0.30 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.76 2nsg h LEU 97 CO -0.01 1.07 0.53 0.03 0.09 0.00 0.00 178.44 180.15 2nsg h ARG 98 N 0.74 1.27 -0.63 1.13 3.08 -0.89 0.04 114.38 119.12 2nsg h ARG 98 Ca 0.11 -0.13 -0.09 0.00 0.07 0.00 0.00 59.98 59.94 2nsg h ARG 98 Cb 0.68 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 2nsg h ARG 98 CO 0.05 0.91 0.02 -0.91 -1.07 0.00 0.00 179.97 178.97 2nsg h ASN 99 N 1.28 1.07 -0.47 7.04 2.35 -0.98 -1.20 115.58 124.66 2nsg h ASN 99 Ca 0.33 -0.29 -0.04 0.00 -0.55 0.00 0.00 56.30 55.74 2nsg h ASN 99 Cb -0.01 -0.29 -0.02 0.00 0.05 0.00 0.00 38.32 38.05 2nsg h ASN 99 CO -0.06 1.10 0.13 0.25 -1.65 0.00 0.00 177.43 177.20 2nsg h LEU 100 N 1.00 0.70 0.32 1.61 5.85 -0.67 0.39 115.31 124.51 2nsg h LEU 100 Ca 0.18 -0.22 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 2nsg h LEU 100 Cb 0.54 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.39 2nsg h LEU 100 CO 0.03 0.73 -0.16 -0.74 -0.34 0.00 0.00 178.44 177.96 2nsg h HIS 101 N 0.63 -0.40 -0.23 1.25 2.76 -0.84 -0.21 115.15 118.10 2nsg h HIS 101 Ca 0.15 -0.01 0.04 0.00 -2.20 0.00 0.00 60.37 58.35 2nsg h HIS 101 Cb 0.29 0.13 -0.04 0.00 1.55 0.00 0.00 27.41 29.35 2nsg h HIS 101 CO 0.02 -0.22 0.01 1.49 -1.30 0.00 0.00 177.93 177.92 2nsg h GLU 102 N -0.48 0.08 -0.46 5.26 4.81 -1.10 -0.65 114.58 122.05 2nsg h GLU 102 Ca -0.04 -0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.10 2nsg h GLU 102 Cb 0.36 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 2nsg h GLU 102 CO 0.07 0.05 -0.05 1.25 -0.73 0.00 0.00 179.01 179.61 2nsg h HIS 103 N 0.08 0.93 -0.47 0.92 2.76 -0.89 -1.59 115.15 116.90 2nsg h HIS 103 Ca 0.11 -0.18 -0.04 0.00 -2.20 0.00 0.00 60.37 58.06 2nsg h HIS 103 Cb 0.13 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 28.84 2nsg h HIS 103 CO -0.18 0.91 0.13 0.66 -1.30 0.00 0.00 177.93 178.14 2nsg h SER 104 N 0.68 0.64 -0.00 3.26 4.64 -0.82 -0.65 113.55 121.30 2nsg h SER 104 Ca 0.12 -0.10 -0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2nsg h SER 104 Cb 0.57 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2nsg h SER 104 CO 0.03 0.63 0.00 0.58 -0.87 0.00 0.00 176.83 177.20 2nsg h VAL 105 N 0.68 1.19 -1.01 0.95 2.07 -0.90 -2.33 116.25 116.90 2nsg h VAL 105 Ca 0.16 -0.56 0.05 0.00 0.82 0.00 0.00 66.70 67.16 2nsg h VAL 105 Cb 0.23 1.56 -0.06 0.00 -1.52 0.00 0.00 31.29 31.50 2nsg h VAL 105 CO -0.01 0.15 0.66 0.00 0.02 0.00 0.00 177.57 178.39 2nsg h ALA 106 N 0.77 1.36 -0.15 1.67 0.00 -0.90 -1.77 119.26 120.23 2nsg h ALA 106 Ca 0.00 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.72 2nsg h ALA 106 Cb 0.24 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 2nsg h ALA 106 CO 0.00 0.53 -0.55 0.00 0.00 0.00 0.00 179.25 179.23 2nsg h ARG 107 N 1.25 0.46 -0.36 0.00 2.47 -1.08 -2.24 114.38 114.88 2nsg h ARG 107 Ca 0.41 -0.29 -0.15 0.00 -1.26 0.00 0.00 59.98 58.69 2nsg h ARG 107 Cb 0.05 0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.39 2nsg h ARG 107 CO -0.14 0.89 -0.37 1.25 0.56 0.00 0.00 179.97 182.16 2nsg h LEU 108 N 0.35 0.91 -0.73 3.04 5.85 -1.01 -1.56 115.31 122.16 2nsg h LEU 108 Ca 0.01 -0.40 -0.06 0.00 0.84 0.00 0.00 57.88 58.26 2nsg h LEU 108 Cb 1.07 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.82 2nsg h LEU 108 CO 0.10 1.17 0.23 -0.78 -0.34 0.00 0.00 178.44 178.82 2nsg h ASP 109 N 0.70 1.07 -0.49 1.25 3.58 -1.24 -1.18 116.42 120.10 2nsg h ASP 109 Ca 0.06 -0.21 -0.02 0.00 0.42 0.00 0.00 57.03 57.28 2nsg h ASP 109 Cb 0.94 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 41.69 2nsg h ASP 109 CO 0.09 0.99 0.22 0.58 -2.88 0.00 0.00 179.24 178.24 2nsg h VAL 110 N 1.09 1.20 -0.61 2.25 2.07 -1.27 -0.69 116.25 120.29 2nsg h VAL 110 Ca 0.24 -0.59 0.06 0.00 0.82 0.00 0.00 66.70 67.22 2nsg h VAL 110 Cb 0.31 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 30.70 2nsg h VAL 110 CO -0.01 0.23 0.32 0.00 0.02 0.00 0.00 177.57 178.13 2nsg h ALA 111 N 1.06 0.80 -0.31 1.67 0.00 -0.79 -1.13 119.26 120.57 2nsg h ALA 111 Ca 0.17 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 2nsg h ALA 111 Cb 0.15 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2nsg h ALA 111 CO -0.02 -0.02 0.00 -1.49 0.00 0.00 0.00 179.25 177.73 2nsg h TRP 112 N 0.60 0.59 -0.11 0.00 6.55 -0.87 -2.77 115.95 119.94 2nsg h TRP 112 Ca 0.27 -0.10 -0.03 0.00 0.95 0.00 0.00 58.89 59.99 2nsg h TRP 112 Cb 0.18 -0.15 -0.01 0.00 -0.86 0.00 0.00 29.16 28.32 2nsg h TRP 112 CO -0.09 0.67 -0.05 0.00 -1.05 0.00 0.00 178.44 177.92 2nsg h ARG 113 N 0.34 0.15 -0.43 0.49 3.08 -0.72 -2.32 114.38 114.98 2nsg h ARG 113 Ca 0.09 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.12 2nsg h ARG 113 Cb 0.43 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.46 2nsg h ARG 113 CO 0.02 0.22 0.00 0.39 -1.07 0.00 0.00 179.97 179.52 2nsg n GLU 114 N -4.39 2.25 -2.55 0.04 1.02 -0.46 -4.93 120.64 111.61 2nsg n GLU 114 Ca -0.01 -1.91 -0.41 0.00 -0.02 0.00 0.00 57.16 54.81 2nsg n GLU 114 Cb 0.18 -1.45 -0.04 0.00 -0.02 0.00 0.00 31.44 30.11 2nsg n GLU 114 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2nsg s THR 115 N -1.44 3.85 0.64 2.62 2.01 -0.88 -5.03 115.64 117.41 2nsg s THR 115 Ca 0.37 1.68 -0.11 0.00 0.31 0.00 0.00 61.69 63.94 2nsg s THR 115 Cb 0.20 -4.07 -0.02 0.00 0.01 0.00 0.00 72.50 68.62 2nsg s THR 115 CO 0.28 0.33 1.05 -0.94 -0.69 0.00 0.00 174.62 174.64 2nsg s SER 116 N -0.41 6.00 0.20 3.53 1.04 -1.26 -4.95 113.70 117.85 2nsg s SER 116 Ca 0.47 1.33 -0.10 0.00 0.48 0.00 0.00 55.95 58.13 2nsg s SER 116 Cb -0.29 -2.31 0.21 0.00 0.10 0.00 0.00 66.02 63.72 2nsg s SER 116 CO 0.36 -1.01 1.80 -0.08 0.98 0.00 0.00 173.24 175.29 2nsg h GLU 117 N -0.42 0.60 -0.49 4.02 4.81 -2.00 -2.41 114.58 118.70 2nsg h GLU 117 Ca -0.44 -0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 58.62 2nsg h GLU 117 Cb 1.21 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.44 2nsg h GLU 117 CO 0.63 0.40 -0.20 -0.44 -0.73 0.00 0.00 179.01 178.67 2nsg h ASP 118 N 0.62 1.00 -0.92 1.04 3.32 -1.99 -3.12 116.42 116.37 2nsg h ASP 118 Ca 0.27 -0.37 0.14 0.00 0.02 0.00 0.00 57.03 57.09 2nsg h ASP 118 Cb 0.17 -0.27 -0.07 0.00 0.22 0.00 0.00 39.33 39.37 2nsg h ASP 118 CO -0.18 1.16 0.59 0.00 -1.72 0.00 0.00 179.24 179.09 2nsg h ALA 119 N 0.91 1.75 -0.63 3.45 0.00 -1.70 -1.37 119.26 121.68 2nsg h ALA 119 Ca 0.11 0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.19 2nsg h ALA 119 Cb 0.77 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 2nsg h ALA 119 CO 0.06 0.00 0.43 -1.49 0.00 0.00 0.00 179.25 178.26 2nsg h TRP 120 N 0.77 0.25 -0.24 0.00 4.06 -1.43 0.75 115.95 120.11 2nsg h TRP 120 Ca 0.46 0.01 0.00 0.00 2.06 0.00 0.00 58.89 61.42 2nsg h TRP 120 Cb 0.66 -0.08 0.00 0.00 -1.00 0.00 0.00 29.16 28.74 2nsg h TRP 120 CO -0.00 0.10 0.00 -1.13 -3.56 0.00 0.00 178.44 173.85 2nsg n SER 121 N -4.43 2.85 -4.76 -3.49 3.41 -0.53 -1.46 113.62 105.21 2nsg n SER 121 Ca 0.12 -1.90 -0.41 0.00 -0.26 0.00 0.00 58.87 56.41 2nsg n SER 121 Cb 0.54 -0.15 -0.02 0.00 -0.26 0.00 0.00 64.21 64.32 2nsg n SER 121 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2nsg s HIS 122 N -1.70 2.91 -0.06 7.33 5.04 0.26 -4.60 115.29 124.47 2nsg s HIS 122 Ca 0.35 1.22 -0.30 0.00 -1.54 0.00 0.00 55.06 54.79 2nsg s HIS 122 Cb 0.21 -3.82 -0.02 0.00 0.04 0.00 0.00 32.58 28.98 2nsg s HIS 122 CO 0.30 -2.44 1.06 -2.00 -2.34 0.00 0.00 174.74 169.33 2nsg s GLU 123 N -1.43 4.43 0.30 2.88 2.12 -1.26 0.14 118.70 125.89 2nsg s GLU 123 Ca 0.53 1.50 0.03 0.00 0.36 0.00 0.00 54.97 57.39 2nsg s GLU 123 Cb -0.42 -3.51 -0.04 0.00 0.26 0.00 0.00 34.13 30.41 2nsg s GLU 123 CO 0.53 -0.29 0.14 0.14 -0.54 0.00 0.00 175.26 175.24 2nsg s VAL 124 N 1.77 0.45 -0.08 3.70 -7.23 0.78 -4.92 120.40 114.87 2nsg s VAL 124 Ca 0.52 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.73 2nsg s VAL 124 Cb -0.21 -2.54 -0.01 0.00 0.56 0.00 0.00 36.38 34.18 2nsg s VAL 124 CO 0.22 0.00 -0.22 -0.22 -0.31 0.00 0.00 175.10 174.57 2nsg s LEU 125 N -3.39 2.23 0.74 1.32 2.96 -1.26 -1.17 118.68 120.12 2nsg s LEU 125 Ca 0.35 -0.48 -0.09 0.00 -0.22 0.00 0.00 54.13 53.70 2nsg s LEU 125 Cb 0.06 -1.44 0.07 0.00 0.50 0.00 0.00 46.19 45.37 2nsg s LEU 125 CO 0.16 0.21 1.07 0.42 -1.32 0.00 0.00 176.35 176.90 2nsg s THR 126 N 0.05 2.24 0.42 3.68 -4.23 -0.44 -4.52 115.64 112.84 2nsg s THR 126 Ca -0.09 -0.15 0.32 0.00 -1.18 0.00 0.00 61.69 60.60 2nsg s THR 126 Cb -0.15 -3.02 0.35 0.00 1.34 0.00 0.00 72.50 71.01 2nsg s THR 126 CO 0.06 -0.03 2.13 0.00 -0.54 0.00 0.00 174.62 176.24 2nsg h ALA 127 N -0.75 1.18 -0.39 3.99 0.00 -1.99 -1.60 119.26 119.69 2nsg h ALA 127 Ca -0.45 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2nsg h ALA 127 Cb 1.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2nsg h ALA 127 CO 0.62 0.08 0.00 1.04 0.00 0.00 0.00 179.25 181.00 2nsg n GLN 128 N -3.43 2.37 -1.06 0.00 1.13 -1.26 -4.92 117.38 110.22 2nsg n GLN 128 Ca -0.02 -1.59 -0.02 0.00 -1.94 0.00 0.00 57.00 53.44 2nsg n GLN 128 Cb 0.21 -1.53 -0.01 0.00 0.11 0.00 0.00 30.24 29.02 2nsg n GLN 128 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2nsg n GLY 129 N 0.89 0.55 3.82 1.08 0.00 -0.60 -5.03 105.19 105.89 2nsg n GLY 129 Ca 0.14 -0.71 -0.38 0.00 0.00 0.00 0.00 46.02 45.07 2nsg n GLY 129 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2nsg s ARG 130 N -1.71 4.07 -0.35 1.61 0.52 -1.26 -4.84 118.95 116.99 2nsg s ARG 130 Ca 0.00 0.56 -0.17 0.00 -0.52 0.00 0.00 55.73 55.60 2nsg s ARG 130 Cb 0.00 -3.24 -0.00 0.00 0.52 0.00 0.00 34.95 32.22 2nsg s ARG 130 CO 0.00 0.63 0.45 0.99 0.02 0.00 0.00 175.30 177.40 2nsg s THR 131 N -0.97 5.07 0.10 0.02 2.01 -1.26 -1.33 115.64 119.29 2nsg s THR 131 Ca 0.26 0.18 -0.01 0.00 0.31 0.00 0.00 61.69 62.42 2nsg s THR 131 Cb -0.18 -3.92 -0.04 0.00 0.01 0.00 0.00 72.50 68.37 2nsg s THR 131 CO 0.16 -0.19 0.04 0.68 -0.69 0.00 0.00 174.62 174.61 2nsg s VAL 132 N 2.24 0.14 0.56 3.82 -7.23 -0.31 -4.96 120.40 114.67 2nsg s VAL 132 Ca 0.16 -1.84 -0.17 0.00 -1.81 0.00 0.00 61.98 58.32 2nsg s VAL 132 Cb -0.16 -1.84 -0.05 0.00 0.56 0.00 0.00 36.38 34.89 2nsg s VAL 132 CO 0.13 -0.65 1.05 -2.16 -0.31 0.00 0.00 175.10 173.15 2nsg s PRO 133 N -4.00 3.46 0.54 4.82 0.04 -1.26 -0.16 135.00 138.45 2nsg s PRO 133 Ca 0.17 1.22 0.28 0.00 0.04 0.00 0.00 61.00 62.71 2nsg s PRO 133 Cb 0.07 -2.05 1.43 0.00 0.04 0.00 0.00 34.50 34.00 2nsg s PRO 133 CO -0.03 -0.69 1.96 0.00 0.04 0.00 0.00 177.00 178.28 2nsg h ALA 134 N 0.72 2.57 -0.02 8.56 0.00 -0.06 0.10 119.26 131.13 2nsg h ALA 134 Ca -0.47 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.42 2nsg h ALA 134 Cb 1.22 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 2nsg h ALA 134 CO 0.58 -0.79 0.08 0.66 0.00 0.00 0.00 179.25 179.78 2nsg h SER 135 N 0.00 0.00 -0.26 0.00 4.64 -1.54 -1.15 113.55 115.23 2nsg h SER 135 Ca 0.30 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.69 2nsg h SER 135 Cb 1.22 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.30 2nsg h SER 135 CO -0.00 0.00 0.27 -0.08 -0.87 0.00 0.00 176.83 176.15 2nsg h GLU 136 N 0.00 0.00 0.00 4.77 4.57 -1.08 -0.60 114.58 122.24 2nsg h GLU 136 Ca 0.01 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.18 2nsg h GLU 136 Cb 0.16 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.75 2nsg h GLU 136 CO -0.00 0.00 -0.03 1.79 -1.18 0.00 0.00 179.01 179.59 2nsg h THR 137 N 0.00 0.91 -0.67 0.32 1.35 -1.41 0.63 112.91 114.04 2nsg h THR 137 Ca 0.12 -0.12 -0.06 0.00 -0.55 0.00 0.00 66.41 65.81 2nsg h THR 137 Cb 0.67 1.07 -0.03 0.00 -1.73 0.00 0.00 68.15 68.13 2nsg h THR 137 CO -0.00 0.03 0.19 -0.07 -0.25 0.00 0.00 175.52 175.42 2nsg h LEU 138 N 0.00 0.99 -0.06 3.87 3.38 -1.32 0.15 115.31 122.32 2nsg h LEU 138 Ca -0.00 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 2nsg h LEU 138 Cb 0.06 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.55 2nsg h LEU 138 CO 0.00 0.95 -0.12 -0.25 0.09 0.00 0.00 178.44 179.11 2nsg h TRP 139 N 0.98 0.24 -0.60 1.13 2.91 -1.27 -2.32 115.95 117.02 2nsg h TRP 139 Ca 0.21 -0.09 0.07 0.00 1.13 0.00 0.00 58.89 60.21 2nsg h TRP 139 Cb 0.32 -0.04 -0.06 0.00 -0.51 0.00 0.00 29.16 28.87 2nsg h TRP 139 CO 0.02 0.72 0.29 0.52 -1.03 0.00 0.00 178.44 178.97 2nsg h MET 140 N -0.31 0.53 -0.49 2.65 2.86 -0.83 -0.06 114.93 119.29 2nsg h MET 140 Ca 0.00 -0.03 -0.12 0.00 -2.06 0.00 0.00 59.70 57.49 2nsg h MET 140 Cb 0.71 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.24 2nsg h MET 140 CO 0.03 0.35 -0.16 -0.09 1.06 0.00 0.00 176.91 178.10 2nsg h ARG 141 N 0.54 0.97 -0.75 1.72 9.65 -1.01 -2.31 114.38 123.20 2nsg h ARG 141 Ca 0.28 -0.39 0.00 0.00 -1.10 0.00 0.00 59.98 58.77 2nsg h ARG 141 Cb 0.24 -0.05 -0.04 0.00 -1.39 0.00 0.00 29.97 28.73 2nsg h ARG 141 CO -0.21 1.06 0.47 0.77 2.80 0.00 0.00 179.97 184.86 2nsg h SER 142 N 0.82 0.87 -0.54 -3.80 0.02 -0.82 -1.20 113.55 108.91 2nsg h SER 142 Ca 0.12 -0.04 0.04 0.00 -0.84 0.00 0.00 61.79 61.07 2nsg h SER 142 Cb 0.72 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 63.00 2nsg h SER 142 CO 0.06 0.66 0.30 -0.09 -1.14 0.00 0.00 176.83 176.61 2nsg h ARG 143 N 1.01 0.56 0.91 3.45 2.43 -0.89 -1.73 114.38 120.13 2nsg h ARG 143 Ca 0.27 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.36 2nsg h ARG 143 Cb -0.08 -0.13 0.01 0.00 -0.42 0.00 0.00 29.97 29.35 2nsg h ARG 143 CO -0.05 0.37 -0.44 0.93 -1.51 0.00 0.00 179.97 179.27 2nsg h GLU 144 N 0.58 -1.18 -0.28 0.20 4.39 -0.79 -3.03 114.58 114.47 2nsg h GLU 144 Ca 0.23 0.08 -0.03 0.00 0.34 0.00 0.00 59.36 59.98 2nsg h GLU 144 Cb 0.10 0.27 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 2nsg h GLU 144 CO -0.14 -0.78 0.04 -0.39 -1.16 0.00 0.00 179.01 176.58 2nsg h VAL 145 N -1.29 1.24 -0.77 3.13 -1.51 -1.24 -0.69 116.25 115.12 2nsg h VAL 145 Ca -0.12 -0.81 -0.03 0.00 -1.23 0.00 0.00 66.70 64.51 2nsg h VAL 145 Cb 0.94 1.23 -0.04 0.00 -2.13 0.00 0.00 31.29 31.29 2nsg h VAL 145 CO 0.21 0.26 0.37 -0.50 -1.23 0.00 0.00 177.57 176.68 2nsg h TRP 146 N 0.28 1.09 0.05 5.19 4.06 -1.44 -1.56 115.95 123.61 2nsg h TRP 146 Ca 0.08 -0.05 -0.09 0.00 2.06 0.00 0.00 58.89 60.90 2nsg h TRP 146 Cb 0.35 -0.34 0.00 0.00 -1.00 0.00 0.00 29.16 28.17 2nsg h TRP 146 CO 0.02 0.79 -0.42 0.82 -3.56 0.00 0.00 178.44 176.09 2nsg h ILE 147 N 1.09 1.60 0.00 1.49 2.04 -1.55 -3.31 117.51 118.87 2nsg h ILE 147 Ca 0.26 -2.40 0.00 0.00 1.00 0.00 0.00 64.86 63.73 2nsg h ILE 147 Cb 0.11 3.21 0.00 0.00 -0.74 0.00 0.00 36.82 39.40 2nsg h ILE 147 CO -0.03 0.63 0.00 1.41 0.00 0.00 0.00 178.15 180.15 2nsg n HIS 148 N -4.41 0.67 -0.08 1.37 8.25 -0.27 -1.27 115.22 119.49 2nsg n HIS 148 Ca -0.14 0.29 -0.03 0.00 -0.26 0.00 0.00 57.72 57.58 2nsg n HIS 148 Cb 0.62 -0.97 0.19 0.00 1.12 0.00 0.00 29.99 30.96 2nsg n HIS 148 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2nsg h ALA 149 N 2.20 1.17 -0.22 -1.41 0.00 -1.37 -2.30 119.26 117.32 2nsg h ALA 149 Ca 0.00 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 2nsg h ALA 149 Cb 0.23 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 2nsg h ALA 149 CO 0.00 0.54 -0.36 0.28 0.00 0.00 0.00 179.25 179.71 2nsg h VAL 150 N 0.67 1.32 -0.02 0.00 2.07 -1.34 -3.17 116.25 115.78 2nsg h VAL 150 Ca 0.13 -1.57 0.01 0.00 0.82 0.00 0.00 66.70 66.08 2nsg h VAL 150 Cb 0.43 1.80 -0.00 0.00 -1.52 0.00 0.00 31.29 32.00 2nsg h VAL 150 CO 0.02 0.49 0.02 0.44 0.02 0.00 0.00 177.57 178.56 2nsg h ASP 151 N 0.32 0.00 -0.01 0.57 3.32 -1.35 -2.30 116.42 116.98 2nsg h ASP 151 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2nsg h ASP 151 Cb 0.95 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.50 2nsg h ASP 151 CO 0.08 0.00 0.03 -0.07 -1.72 0.00 0.00 179.24 177.56 2nsg h LEU 152 N 0.00 0.00 0.35 1.55 3.38 -1.40 0.24 115.31 119.44 2nsg h LEU 152 Ca 0.01 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.90 2nsg h LEU 152 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2nsg h LEU 152 CO -0.00 0.00 -0.10 0.61 0.09 0.00 0.00 178.44 179.04 2nsg n GLY 153 N -1.17 0.27 0.00 0.83 0.00 -0.87 -4.77 105.19 99.48 2nsg n GLY 153 Ca -0.03 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.30 2nsg n GLY 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nsg n ALA 154 N -1.43 0.00 -0.32 4.61 0.00 -1.26 -5.02 120.51 117.09 2nsg n ALA 154 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2nsg n ALA 154 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2nsg n ALA 154 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2nsg n VAL 155 N 0.00 0.16 -2.33 0.00 0.24 -1.26 -5.07 118.33 110.06 2nsg n VAL 155 Ca 0.00 -0.42 -0.35 0.00 -2.04 0.00 0.00 64.34 61.53 2nsg n VAL 155 Cb 0.00 1.16 -0.01 0.00 -1.47 0.00 0.00 33.84 33.52 2nsg n VAL 155 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2nsg s ALA 156 N -0.16 2.78 0.27 2.33 0.00 -1.26 -5.06 121.76 120.67 2nsg s ALA 156 Ca 0.00 0.79 0.02 0.00 0.00 0.00 0.00 51.96 52.76 2nsg s ALA 156 Cb 0.00 -3.34 -0.04 0.00 0.00 0.00 0.00 23.12 19.74 2nsg s ALA 156 CO 0.00 -0.63 0.13 0.95 0.00 0.00 0.00 175.76 176.21 2nsg s THR 157 N -1.78 0.35 0.08 0.00 -4.23 -1.26 -4.58 115.64 104.23 2nsg s THR 157 Ca 0.70 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 59.42 2nsg s THR 157 Cb -0.23 -2.56 0.18 0.00 1.34 0.00 0.00 72.50 71.24 2nsg s THR 157 CO 0.26 0.00 1.73 -0.26 -0.54 0.00 0.00 174.62 175.82 2nsg h PHE 158 N 2.34 0.00 0.00 3.99 0.04 -1.93 -2.63 116.94 118.75 2nsg h PHE 158 Ca -0.35 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.38 2nsg h PHE 158 Cb 1.25 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.39 2nsg h PHE 158 CO 0.72 0.31 -0.15 0.78 -0.60 0.00 0.00 178.31 179.37 2nsg h GLY 159 N 2.34 0.00 2.00 -1.45 0.00 -1.95 -2.12 103.07 101.88 2nsg h GLY 159 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.25 2nsg h GLY 159 CO 0.04 0.00 -0.35 -0.55 0.00 0.00 0.00 176.54 175.68 2nsg h ASP 160 N 0.00 0.00 -2.90 0.19 3.32 -1.87 -3.45 116.42 111.71 2nsg h ASP 160 Ca -0.00 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.50 2nsg h ASP 160 Cb 0.44 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.99 2nsg h ASP 160 CO 0.02 0.35 0.85 -0.63 -1.72 0.00 0.00 179.24 178.11 2nsg s ILE 161 N -3.68 3.72 0.16 0.35 1.01 -0.80 -4.96 121.20 117.01 2nsg s ILE 161 Ca -0.00 1.09 -0.33 0.00 0.00 0.00 0.00 60.65 61.41 2nsg s ILE 161 Cb 0.11 -3.70 -0.16 0.00 0.01 0.00 0.00 42.46 38.72 2nsg s ILE 161 CO 0.68 -0.01 1.21 -2.65 0.00 0.00 0.00 174.94 174.17 2nsg n PRO 162 N 5.49 1.21 -0.32 2.79 -0.02 -1.26 -4.70 135.00 138.19 2nsg n PRO 162 Ca 0.13 0.43 0.14 0.00 -2.02 0.00 0.00 63.50 62.19 2nsg n PRO 162 Cb 0.44 -1.97 0.33 0.00 -0.02 0.00 0.00 33.50 32.28 2nsg n PRO 162 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2nsg h GLU 163 N 3.67 0.47 -0.44 -0.52 4.81 -1.94 0.51 114.58 121.14 2nsg h GLU 163 Ca -0.44 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 58.80 2nsg h GLU 163 Cb 1.34 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.59 2nsg h GLU 163 CO 0.72 0.31 0.29 -0.24 -0.73 0.00 0.00 179.01 179.37 2nsg h VAL 164 N 0.49 1.02 -0.04 0.32 3.04 -1.89 0.11 116.25 119.29 2nsg h VAL 164 Ca 0.58 -0.15 -0.23 0.00 -1.01 0.00 0.00 66.70 65.89 2nsg h VAL 164 Cb 1.08 0.53 0.02 0.00 -2.01 0.00 0.00 31.29 30.91 2nsg h VAL 164 CO -0.49 0.08 -0.88 0.40 -1.01 0.00 0.00 177.57 175.67 2nsg h ILE 165 N 0.45 1.31 -0.66 3.17 2.04 -1.25 -2.45 117.51 120.12 2nsg h ILE 165 Ca 0.18 -2.13 -0.05 0.00 1.00 0.00 0.00 64.86 63.86 2nsg h ILE 165 Cb 0.16 2.33 -0.03 0.00 -0.74 0.00 0.00 36.82 38.54 2nsg h ILE 165 CO -0.04 0.66 0.23 -0.07 0.00 0.00 0.00 178.15 178.92 2nsg h LEU 166 N 0.32 0.94 -0.56 1.44 3.38 -0.85 -0.11 115.31 119.88 2nsg h LEU 166 Ca -0.10 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.64 2nsg h LEU 166 Cb 1.54 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 42.02 2nsg h LEU 166 CO 0.18 0.89 0.22 0.03 0.09 0.00 0.00 178.44 179.84 2nsg h ARG 167 N 0.95 0.83 -0.44 1.13 3.08 -0.85 0.66 114.38 119.75 2nsg h ARG 167 Ca 0.22 -0.15 -0.07 0.00 0.07 0.00 0.00 59.98 60.04 2nsg h ARG 167 Cb 0.26 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 2nsg h ARG 167 CO -0.01 0.72 -0.02 1.15 -1.07 0.00 0.00 179.97 180.74 2nsg h THR 168 N 0.76 1.24 -0.36 2.04 2.02 -1.16 -1.93 112.91 115.52 2nsg h THR 168 Ca 0.19 -1.00 -0.12 0.00 0.77 0.00 0.00 66.41 66.25 2nsg h THR 168 Cb 0.20 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 2nsg h THR 168 CO -0.01 0.35 -0.25 -0.07 0.37 0.00 0.00 175.52 175.90 2nsg h LEU 169 N 0.68 0.85 -0.66 2.58 3.38 -0.61 -0.10 115.31 121.42 2nsg h LEU 169 Ca 0.13 -0.43 0.02 0.00 0.09 0.00 0.00 57.88 57.69 2nsg h LEU 169 Cb 0.45 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 2nsg h LEU 169 CO 0.02 1.10 0.42 0.00 0.09 0.00 0.00 178.44 180.07 2nsg h ALA 170 N 0.77 0.85 -0.10 1.53 0.00 -0.59 -0.92 119.26 120.81 2nsg h ALA 170 Ca 0.07 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2nsg h ALA 170 Cb 0.82 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2nsg h ALA 170 CO 0.07 0.20 -0.11 0.00 0.00 0.00 0.00 179.25 179.41 2nsg h ALA 171 N 1.27 0.14 0.05 0.00 0.00 -1.27 -3.04 119.26 116.41 2nsg h ALA 171 Ca 0.26 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2nsg h ALA 171 Cb -0.02 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2nsg h ALA 171 CO -0.09 -0.01 -0.05 1.49 0.00 0.00 0.00 179.25 180.59 2nsg h GLU 172 N -0.17 -0.11 -0.26 0.00 4.81 -0.81 0.40 114.58 118.43 2nsg h GLU 172 Ca 0.01 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.28 2nsg h GLU 172 Cb 0.63 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.01 2nsg h GLU 172 CO 0.03 -0.08 0.09 0.82 -0.73 0.00 0.00 179.01 179.15 2nsg h ILE 173 N -0.12 0.94 -0.04 2.32 2.04 -1.27 0.54 117.51 121.92 2nsg h ILE 173 Ca 0.01 -0.07 -0.11 0.00 1.00 0.00 0.00 64.86 65.68 2nsg h ILE 173 Cb 0.12 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 2nsg h ILE 173 CO -0.02 0.04 -0.50 0.71 0.00 0.00 0.00 178.15 178.38 2nsg h THR 174 N 0.22 1.36 -0.36 -0.27 1.35 -1.46 -1.59 112.91 112.15 2nsg h THR 174 Ca 0.11 -1.74 -0.12 0.00 -0.55 0.00 0.00 66.41 64.11 2nsg h THR 174 Cb 0.08 1.89 -0.01 0.00 -1.73 0.00 0.00 68.15 68.38 2nsg h THR 174 CO -0.11 0.51 -0.27 1.56 -0.25 0.00 0.00 175.52 176.95 2nsg h GLN 175 N 0.08 0.75 -0.24 4.72 4.20 -0.49 -0.52 115.11 123.62 2nsg h GLN 175 Ca 0.00 -0.32 -0.04 0.00 0.06 0.00 0.00 58.65 58.35 2nsg h GLN 175 Cb 0.92 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.67 2nsg h GLN 175 CO 0.07 0.94 -0.01 -0.22 -0.67 0.00 0.00 178.83 178.94 2nsg h LYS 176 N 0.65 0.42 -0.18 1.46 3.64 -0.56 -0.54 116.57 121.45 2nsg h LYS 176 Ca 0.08 -0.14 0.02 0.00 -1.27 0.00 0.00 60.65 59.35 2nsg h LYS 176 Cb 0.78 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.55 2nsg h LYS 176 CO 0.06 0.61 0.04 -1.49 -2.27 0.00 0.00 179.45 176.40 2nsg h TRP 177 N 0.19 0.06 -0.31 1.91 6.55 -1.18 -2.52 115.95 120.65 2nsg h TRP 177 Ca 0.07 0.01 0.06 0.00 0.95 0.00 0.00 58.89 59.98 2nsg h TRP 177 Cb 0.42 -0.00 -0.06 0.00 -0.86 0.00 0.00 29.16 28.66 2nsg h TRP 177 CO 0.04 0.02 -0.11 1.15 -1.05 0.00 0.00 178.44 178.49 2nsg h THR 178 N 0.11 0.63 -0.09 1.49 2.02 -0.92 0.13 112.91 116.28 2nsg h THR 178 Ca 0.08 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.29 2nsg h THR 178 Cb 0.08 0.63 -0.00 0.00 -1.74 0.00 0.00 68.15 67.11 2nsg h THR 178 CO -0.11 0.00 0.10 0.77 0.37 0.00 0.00 175.52 176.65 2nsg h SER 179 N -0.04 0.00 -0.49 4.18 4.64 -0.73 -0.55 113.55 120.56 2nsg h SER 179 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2nsg h SER 179 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2nsg h SER 179 CO -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.62 2nsg n GLN 180 N -3.79 2.56 -1.23 4.77 6.02 -0.45 -4.95 117.38 120.32 2nsg n GLN 180 Ca -0.01 -2.31 -0.08 0.00 -0.01 0.00 0.00 57.00 54.60 2nsg n GLN 180 Cb 0.20 -1.45 -0.03 0.00 1.02 0.00 0.00 30.24 29.97 2nsg n GLN 180 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2nsg n GLY 181 N 1.25 0.96 3.90 1.08 0.00 -0.21 -5.01 105.19 107.15 2nsg n GLY 181 Ca 0.19 -0.46 -0.28 0.00 0.00 0.00 0.00 46.02 45.46 2nsg n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nsg s ALA 182 N -2.19 3.44 -0.99 4.61 0.00 0.34 -4.47 121.76 122.49 2nsg s ALA 182 Ca 0.00 -0.47 -0.04 0.00 0.00 0.00 0.00 51.96 51.45 2nsg s ALA 182 Cb 0.00 -2.54 0.00 0.00 0.00 0.00 0.00 23.12 20.58 2nsg s ALA 182 CO 0.00 -0.17 0.85 0.41 0.00 0.00 0.00 175.76 176.85 2nsg n GLY 183 N -1.83 -0.18 3.68 0.00 0.00 -1.26 -2.12 105.19 103.47 2nsg n GLY 183 Ca 0.00 0.01 -0.48 0.00 0.00 0.00 0.00 46.02 45.55 2nsg n GLY 183 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2nsg n GLU 184 N -3.71 2.10 0.00 1.61 1.02 -1.25 -1.07 120.64 119.34 2nsg n GLU 184 Ca -0.09 0.77 0.00 0.00 -0.02 0.00 0.00 57.16 57.82 2nsg n GLU 184 Cb 0.58 -2.57 0.00 0.00 -0.02 0.00 0.00 31.44 29.43 2nsg n GLU 184 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2nsg n GLY 185 N 4.01 2.96 3.72 0.62 0.00 -0.41 -4.72 105.19 111.37 2nsg n GLY 185 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 2nsg n GLY 185 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2nsg s LEU 186 N 0.00 4.42 -0.04 0.99 2.96 -0.23 -0.98 118.68 125.79 2nsg s LEU 186 Ca 0.00 1.71 0.01 0.00 -0.22 0.00 0.00 54.13 55.63 2nsg s LEU 186 Cb 0.00 -3.58 0.02 0.00 0.50 0.00 0.00 46.19 43.14 2nsg s LEU 186 CO 0.00 -0.19 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.12 2nsg s VAL 187 N 0.65 0.44 -0.01 1.68 1.01 -0.48 -1.91 120.40 121.79 2nsg s VAL 187 Ca 0.50 -0.06 -0.17 0.00 0.00 0.00 0.00 61.98 62.26 2nsg s VAL 187 Cb -0.22 -0.49 -0.06 0.00 0.00 0.00 0.00 36.38 35.61 2nsg s VAL 187 CO 0.29 0.21 0.46 -0.76 0.00 0.00 0.00 175.10 175.29 2nsg s LEU 188 N 1.00 4.44 -0.17 3.92 1.43 -0.70 -0.89 118.68 127.71 2nsg s LEU 188 Ca -0.10 0.99 0.01 0.00 -1.03 0.00 0.00 54.13 54.00 2nsg s LEU 188 Cb -0.14 -2.68 0.03 0.00 0.03 0.00 0.00 46.19 43.43 2nsg s LEU 188 CO -0.01 0.24 -0.15 -0.22 0.23 0.00 0.00 176.35 176.44 2nsg s LEU 189 N -0.67 1.94 -1.02 1.79 2.96 0.10 -0.08 118.68 123.70 2nsg s LEU 189 Ca 0.25 -0.62 -0.22 0.00 -0.22 0.00 0.00 54.13 53.33 2nsg s LEU 189 Cb -0.17 -1.27 0.07 0.00 0.50 0.00 0.00 46.19 45.32 2nsg s LEU 189 CO 0.14 -0.06 1.40 -0.62 -1.32 0.00 0.00 176.35 175.89 2nsg s ASP 190 N 1.41 6.56 0.13 3.68 -1.08 0.37 -2.20 116.67 125.54 2nsg s ASP 190 Ca 0.04 -1.66 -0.21 0.00 -0.52 0.00 0.00 52.55 50.20 2nsg s ASP 190 Cb -0.14 -2.53 -0.04 0.00 -1.46 0.00 0.00 42.92 38.76 2nsg s ASP 190 CO -0.11 -1.38 1.70 -0.08 0.52 0.00 0.00 175.17 175.82 2nsg h GLU 191 N 9.41 -0.03 -0.91 4.34 4.81 -1.62 0.22 114.58 130.80 2nsg h GLU 191 Ca 0.21 0.00 0.14 0.00 -0.13 0.00 0.00 59.36 59.58 2nsg h GLU 191 Cb 1.00 0.01 -0.09 0.00 0.63 0.00 0.00 28.75 30.30 2nsg h GLU 191 CO 1.36 -0.02 0.52 -1.35 -0.73 0.00 0.00 179.01 178.80 2nsg h PRO 192 N -0.03 0.75 -0.11 0.92 0.11 -1.90 -1.67 132.00 130.07 2nsg h PRO 192 Ca 0.09 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.15 2nsg h PRO 192 Cb 0.16 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 31.10 2nsg h PRO 192 CO -0.19 0.49 0.00 0.43 -0.21 0.00 0.00 178.00 178.52 2nsg n SER 193 N -4.77 2.73 -3.78 -2.05 7.64 -1.01 -4.97 113.62 107.41 2nsg n SER 193 Ca 0.18 -1.89 -0.24 0.00 1.01 0.00 0.00 58.87 57.93 2nsg n SER 193 Cb 0.41 -0.06 0.03 0.00 -1.01 0.00 0.00 64.21 63.58 2nsg n SER 193 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2nsg n SER 194 N 1.09 -2.18 -4.21 6.43 2.88 0.73 -4.97 113.62 113.39 2nsg n SER 194 Ca 0.16 -0.82 -0.34 0.00 -1.33 0.00 0.00 58.87 56.54 2nsg n SER 194 Cb 0.54 -3.94 -0.15 0.00 -0.75 0.00 0.00 64.21 59.90 2nsg n SER 194 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2nsg s THR 195 N -3.58 2.68 0.03 2.46 2.01 -0.89 -4.96 115.64 113.39 2nsg s THR 195 Ca 0.20 -0.73 -0.14 0.00 0.31 0.00 0.00 61.69 61.32 2nsg s THR 195 Cb -0.10 -2.18 -0.06 0.00 0.01 0.00 0.00 72.50 70.18 2nsg s THR 195 CO 0.82 0.49 0.43 -0.13 -0.69 0.00 0.00 174.62 175.54 2nsg s ARG 196 N 1.34 3.92 -0.52 4.92 0.52 -1.26 -0.47 118.95 127.39 2nsg s ARG 196 Ca 0.05 0.41 0.04 0.00 -0.52 0.00 0.00 55.73 55.70 2nsg s ARG 196 Cb -0.14 -3.17 0.15 0.00 0.52 0.00 0.00 34.95 32.31 2nsg s ARG 196 CO -0.08 0.66 0.34 0.71 0.02 0.00 0.00 175.30 176.95 2nsg s TYR 197 N -1.15 2.44 0.59 -0.53 2.02 0.89 -4.97 117.35 116.63 2nsg s TYR 197 Ca 0.26 -2.77 -0.15 0.00 -0.37 0.00 0.00 57.07 54.04 2nsg s TYR 197 Cb -0.16 -2.06 -0.04 0.00 -0.40 0.00 0.00 41.96 39.29 2nsg s TYR 197 CO 0.15 -0.71 1.04 -1.25 -1.57 0.00 0.00 175.55 173.20 2nsg s PRO 198 N -0.33 3.45 0.00 -1.71 0.04 -1.26 -1.72 135.00 133.47 2nsg s PRO 198 Ca 0.23 1.08 0.00 0.00 0.04 0.00 0.00 61.00 62.34 2nsg s PRO 198 Cb -0.13 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.35 2nsg s PRO 198 CO -0.09 -0.69 0.00 0.00 0.04 0.00 0.00 177.00 176.26 2nsg n ALA 199 N -2.11 0.00 -1.77 8.56 0.00 -0.80 -4.65 120.51 119.75 2nsg n ALA 199 Ca 0.08 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.14 2nsg n ALA 199 Cb 0.53 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.98 2nsg n ALA 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2nsg s ALA 200 N -2.77 3.06 0.62 0.00 0.00 -0.90 -4.77 121.76 117.00 2nsg s ALA 200 Ca 0.00 1.11 -0.18 0.00 0.00 0.00 0.00 51.96 52.89 2nsg s ALA 200 Cb 0.00 -3.45 -0.02 0.00 0.00 0.00 0.00 23.12 19.65 2nsg s ALA 200 CO 0.00 -0.82 1.20 -1.25 0.00 0.00 0.00 175.76 174.88 2nsg s PRO 201 N -2.53 2.85 0.19 0.00 0.04 -1.26 -1.28 135.00 133.00 2nsg s PRO 201 Ca 0.62 1.77 -0.21 0.00 0.04 0.00 0.00 61.00 63.22 2nsg s PRO 201 Cb -0.34 -1.92 0.05 0.00 0.04 0.00 0.00 34.50 32.33 2nsg s PRO 201 CO 0.42 -1.29 0.60 0.20 0.04 0.00 0.00 177.00 176.97 2nsg s GLY 202 N -1.76 -0.36 0.13 0.56 0.00 -1.26 -4.08 107.32 100.55 2nsg s GLY 202 Ca 0.76 0.12 -0.07 0.00 0.00 0.00 0.00 44.72 45.53 2nsg s GLY 202 CO 0.35 -0.02 1.34 0.06 0.00 0.00 0.00 173.10 174.84 2nsg h GLN 203 N 2.07 0.58 -4.33 2.90 -0.00 -1.96 -3.41 115.11 110.96 2nsg h GLN 203 Ca -0.30 -0.51 -0.73 0.00 -0.00 0.00 0.00 58.65 57.11 2nsg h GLN 203 Cb 1.28 0.12 -0.25 0.00 -0.00 0.00 0.00 27.48 28.63 2nsg h GLN 203 CO 0.35 1.13 -0.36 -0.51 -0.00 0.00 0.00 178.83 179.44 2nsg s ASP 204 N -7.07 5.98 0.24 0.06 1.01 -1.26 -5.06 116.67 110.56 2nsg s ASP 204 Ca -0.08 -1.45 -0.30 0.00 0.71 0.00 0.00 52.55 51.44 2nsg s ASP 204 Cb 0.09 -2.12 -0.09 0.00 1.01 0.00 0.00 42.92 41.81 2nsg s ASP 204 CO 0.88 -0.64 1.06 -0.70 0.21 0.00 0.00 175.17 175.98 2nsg s GLU 205 N 1.56 4.68 -0.16 8.23 2.12 -1.26 -4.47 118.70 129.39 2nsg s GLU 205 Ca 0.04 1.70 -0.02 0.00 0.36 0.00 0.00 54.97 57.04 2nsg s GLU 205 Cb -0.25 -3.24 0.05 0.00 0.26 0.00 0.00 34.13 30.96 2nsg s GLU 205 CO 0.05 0.24 0.03 0.08 -0.54 0.00 0.00 175.26 175.11 2nsg s VAL 206 N -0.86 0.46 -0.27 3.70 1.01 -0.16 -4.96 120.40 119.32 2nsg s VAL 206 Ca 0.45 -0.34 -0.12 0.00 0.00 0.00 0.00 61.98 61.97 2nsg s VAL 206 Cb -0.30 -0.87 -0.05 0.00 0.00 0.00 0.00 36.38 35.17 2nsg s VAL 206 CO 0.37 -0.07 0.25 -0.69 0.00 0.00 0.00 175.10 174.96 2nsg s VAL 207 N 1.90 5.27 -0.34 2.92 1.01 -1.26 -1.38 120.40 128.52 2nsg s VAL 207 Ca 0.01 0.30 -0.10 0.00 0.00 0.00 0.00 61.98 62.19 2nsg s VAL 207 Cb -0.16 -3.58 0.01 0.00 0.00 0.00 0.00 36.38 32.65 2nsg s VAL 207 CO -0.07 0.23 0.18 -0.69 0.00 0.00 0.00 175.10 174.74 2nsg s VAL 208 N 1.81 4.60 0.29 2.92 1.01 -0.07 -1.26 120.40 129.70 2nsg s VAL 208 Ca 0.10 -0.61 0.11 0.00 0.00 0.00 0.00 61.98 61.58 2nsg s VAL 208 Cb -0.16 -3.44 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 2nsg s VAL 208 CO 0.10 -0.06 -0.17 -0.94 0.00 0.00 0.00 175.10 174.03 2nsg s SER 209 N 1.59 3.54 0.00 3.32 1.04 -0.41 -0.73 113.70 122.05 2nsg s SER 209 Ca 0.04 -1.07 0.00 0.00 0.48 0.00 0.00 55.95 55.40 2nsg s SER 209 Cb -0.18 -0.30 0.00 0.00 0.10 0.00 0.00 66.02 65.64 2nsg s SER 209 CO 0.06 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 174.86 2nsg n GLY 210 N -0.64 -0.76 3.83 7.32 0.00 -0.93 -1.60 105.19 112.41 2nsg n GLY 210 Ca -0.05 -0.95 -0.29 0.00 0.00 0.00 0.00 46.02 44.72 2nsg n GLY 210 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nsg s SER 211 N -4.00 4.30 0.20 1.61 1.04 -1.26 -1.72 113.70 113.87 2nsg s SER 211 Ca 0.00 1.07 -0.10 0.00 0.48 0.00 0.00 55.95 57.40 2nsg s SER 211 Cb 0.00 -1.72 0.22 0.00 0.10 0.00 0.00 66.02 64.62 2nsg s SER 211 CO 0.00 -2.07 1.80 0.25 0.98 0.00 0.00 173.24 174.20 2nsg h LEU 212 N -1.16 0.48 -1.24 2.42 5.85 -1.93 -0.24 115.31 119.49 2nsg h LEU 212 Ca -0.48 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.27 2nsg h LEU 212 Cb 1.30 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.24 2nsg h LEU 212 CO 0.62 0.31 0.36 0.00 -0.34 0.00 0.00 178.44 179.39 2nsg h ALA 213 N 1.34 1.42 -0.16 1.25 0.00 -1.92 -1.58 119.26 119.61 2nsg h ALA 213 Ca 0.28 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2nsg h ALA 213 Cb 0.19 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2nsg h ALA 213 CO -0.19 0.48 -0.00 0.78 0.00 0.00 0.00 179.25 180.32 2nsg h GLY 214 N 0.94 0.30 2.00 0.00 0.00 -1.37 -2.08 103.07 102.86 2nsg h GLY 214 Ca 0.23 -0.22 -0.10 0.00 0.00 0.00 0.00 47.33 47.24 2nsg h GLY 214 CO -0.04 0.21 -0.46 0.16 0.00 0.00 0.00 176.54 176.41 2nsg h ILE 215 N 0.02 1.05 -0.13 2.60 3.07 -0.96 -2.29 117.51 120.88 2nsg h ILE 215 Ca 0.04 -1.73 -0.23 0.00 1.55 0.00 0.00 64.86 64.49 2nsg h ILE 215 Cb 0.38 2.01 0.01 0.00 -0.27 0.00 0.00 36.82 38.96 2nsg h ILE 215 CO 0.01 0.45 -0.81 0.58 -1.05 0.00 0.00 178.15 177.32 2nsg h VAL 216 N 0.00 1.28 -0.74 0.16 2.07 -1.28 0.84 116.25 118.58 2nsg h VAL 216 Ca -0.00 -2.01 -0.02 0.00 0.82 0.00 0.00 66.70 65.49 2nsg h VAL 216 Cb 0.98 2.05 -0.03 0.00 -1.52 0.00 0.00 31.29 32.77 2nsg h VAL 216 CO 0.06 0.63 0.39 -0.09 0.02 0.00 0.00 177.57 178.59 2nsg h ARG 217 N 0.50 1.04 0.57 1.57 2.43 -1.30 0.05 114.38 119.23 2nsg h ARG 217 Ca -0.07 -0.13 -0.03 0.00 -0.81 0.00 0.00 59.98 58.95 2nsg h ARG 217 Cb 1.45 -0.20 0.01 0.00 -0.42 0.00 0.00 29.97 30.80 2nsg h ARG 217 CO 0.17 0.78 -0.27 -0.92 -1.51 0.00 0.00 179.97 178.22 2nsg h TYR 218 N 1.02 -0.71 -0.65 2.20 3.20 -1.27 -0.10 116.97 120.68 2nsg h TYR 218 Ca 0.26 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.15 2nsg h TYR 218 Cb 0.06 0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.52 2nsg h TYR 218 CO 0.00 -0.39 0.43 0.00 -1.64 0.00 0.00 178.16 176.56 2nsg h ALA 219 N -0.55 1.67 0.00 1.82 0.00 -0.70 -0.22 119.26 121.28 2nsg h ALA 219 Ca -0.08 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2nsg h ALA 219 Cb 0.63 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2nsg h ALA 219 CO 0.13 0.26 0.00 0.00 0.00 0.00 0.00 179.25 179.64 2nsg n ALA 220 N -2.45 2.36 -1.85 0.00 0.00 -0.01 -4.73 120.51 113.82 2nsg n ALA 220 Ca 0.08 -0.10 -0.08 0.00 0.00 0.00 0.00 53.44 53.34 2nsg n ALA 220 Cb 0.15 -1.25 -0.01 0.00 0.00 0.00 0.00 19.45 18.33 2nsg n ALA 220 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nsg n GLY 221 N 0.43 0.36 1.05 0.00 0.00 -0.09 -4.85 105.19 102.09 2nsg n GLY 221 Ca 0.12 -0.58 -0.00 0.00 0.00 0.00 0.00 46.02 45.56 2nsg n GLY 221 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nsg n ARG 222 N -2.13 2.13 0.00 1.61 1.74 -0.06 -5.04 116.66 114.92 2nsg n ARG 222 Ca -0.09 -3.06 0.00 0.00 -0.77 0.00 0.00 57.85 53.93 2nsg n ARG 222 Cb 0.48 -1.82 0.00 0.00 -1.02 0.00 0.00 32.46 30.10 2nsg n ARG 222 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2nsg n GLY 223 N -0.97 3.75 0.63 -0.13 0.00 -1.24 -4.85 105.19 102.39 2nsg n GLY 223 Ca 0.29 -1.58 0.07 0.00 0.00 0.00 0.00 46.02 44.80 2nsg n GLY 223 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2nsg n SER 224 N 0.00 2.57 -0.00 1.61 7.64 -1.26 -2.88 113.62 121.29 2nsg n SER 224 Ca 0.00 -1.76 0.19 0.00 1.01 0.00 0.00 58.87 58.31 2nsg n SER 224 Cb 0.00 -0.13 0.67 0.00 -1.01 0.00 0.00 64.21 63.74 2nsg n SER 224 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 2nsg h ASP 225 N 2.49 0.04 -0.41 6.43 3.32 -1.93 -1.76 116.42 124.60 2nsg h ASP 225 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2nsg h ASP 225 Cb 0.65 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.20 2nsg h ASP 225 CO 0.00 0.02 0.00 0.61 -1.72 0.00 0.00 179.24 178.15 2nsg n GLY 226 N -1.63 1.01 3.21 2.75 0.00 -1.26 -4.95 105.19 104.32 2nsg n GLY 226 Ca 0.10 -0.48 -0.12 0.00 0.00 0.00 0.00 46.02 45.51 2nsg n GLY 226 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2nsg s VAL 227 N -1.45 0.44 0.13 1.61 -7.23 -0.66 -4.27 120.40 108.97 2nsg s VAL 227 Ca 0.30 -1.95 0.03 0.00 -1.81 0.00 0.00 61.98 58.56 2nsg s VAL 227 Cb 0.16 -2.10 -0.04 0.00 0.56 0.00 0.00 36.38 34.96 2nsg s VAL 227 CO 0.21 -0.47 -0.08 0.42 -0.31 0.00 0.00 175.10 174.87 2nsg s THR 228 N -3.82 0.99 0.08 5.32 -4.23 -0.63 -4.96 115.64 108.39 2nsg s THR 228 Ca 0.24 -2.02 0.06 0.00 -1.18 0.00 0.00 61.69 58.79 2nsg s THR 228 Cb 0.07 -1.81 -0.04 0.00 1.34 0.00 0.00 72.50 72.06 2nsg s THR 228 CO 0.03 -0.77 -0.09 -0.55 -0.54 0.00 0.00 174.62 172.70 2nsg s SER 229 N -3.13 4.47 0.21 3.99 0.15 -1.26 -1.28 113.70 116.85 2nsg s SER 229 Ca 0.16 -0.31 0.23 0.00 0.70 0.00 0.00 55.95 56.72 2nsg s SER 229 Cb 0.04 -0.92 0.92 0.00 -1.71 0.00 0.00 66.02 64.35 2nsg s SER 229 CO -0.01 0.21 1.69 -1.54 1.20 0.00 0.00 173.24 174.78 2nsg n SER 230 N 0.94 0.58 -0.82 5.45 3.41 -0.39 -1.88 113.62 120.91 2nsg n SER 230 Ca -0.14 0.63 0.09 0.00 -0.26 0.00 0.00 58.87 59.19 2nsg n SER 230 Cb 0.52 -0.76 0.14 0.00 -0.26 0.00 0.00 64.21 63.85 2nsg n SER 230 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2nsg n THR 231 N -2.13 0.40 0.00 6.66 -2.24 -1.26 -4.96 114.28 110.75 2nsg n THR 231 Ca 0.03 -0.70 0.00 0.00 -2.27 0.00 0.00 64.05 61.11 2nsg n THR 231 Cb 0.24 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 2nsg n THR 231 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2nsg n GLY 232 N 1.02 2.26 2.83 3.38 0.00 -0.79 -4.99 105.19 108.90 2nsg n GLY 232 Ca 0.13 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 2nsg n GLY 232 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2nsg s GLU 233 N -0.28 0.91 -0.31 1.61 2.56 -1.26 -4.82 118.70 117.11 2nsg s GLU 233 Ca 0.00 -0.03 -0.28 0.00 0.00 0.00 0.00 54.97 54.66 2nsg s GLU 233 Cb 0.00 -1.12 0.01 0.00 2.00 0.00 0.00 34.13 35.02 2nsg s GLU 233 CO 0.00 -0.25 1.00 0.08 -0.56 0.00 0.00 175.26 175.53 2nsg s VAL 234 N 1.70 4.58 0.69 3.70 1.01 -1.26 -4.76 120.40 126.07 2nsg s VAL 234 Ca 0.02 1.61 -0.11 0.00 0.00 0.00 0.00 61.98 63.50 2nsg s VAL 234 Cb -0.13 -4.35 0.00 0.00 0.00 0.00 0.00 36.38 31.91 2nsg s VAL 234 CO -0.05 -0.42 1.06 -2.16 0.00 0.00 0.00 175.10 173.54 2nsg s PRO 235 N 3.47 3.01 0.09 2.72 0.04 -1.26 -4.99 135.00 138.09 2nsg s PRO 235 Ca 0.42 0.71 -0.30 0.00 0.04 0.00 0.00 61.00 61.87 2nsg s PRO 235 Cb -0.13 -2.02 -0.06 0.00 0.04 0.00 0.00 34.50 32.33 2nsg s PRO 235 CO 0.14 -0.98 1.20 -1.21 0.04 0.00 0.00 177.00 176.19 2nsg s GLU 236 N -5.19 4.45 0.80 4.56 0.41 -1.26 -5.00 118.70 117.47 2nsg s GLU 236 Ca 0.57 1.80 -0.11 0.00 -0.41 0.00 0.00 54.97 56.82 2nsg s GLU 236 Cb -0.12 -3.32 0.07 0.00 -1.78 0.00 0.00 34.13 28.98 2nsg s GLU 236 CO 0.54 -0.21 1.09 -1.25 -0.49 0.00 0.00 175.26 174.94 2nsg s PRO 237 N 0.73 2.03 0.87 0.39 0.04 -1.26 -5.00 135.00 132.81 2nsg s PRO 237 Ca 0.57 0.83 -0.11 0.00 0.04 0.00 0.00 61.00 62.33 2nsg s PRO 237 Cb -0.30 -1.90 0.12 0.00 0.04 0.00 0.00 34.50 32.46 2nsg s PRO 237 CO 0.31 -1.71 1.15 -2.14 0.04 0.00 0.00 177.00 174.65 2nsg s PRO 238 N -5.04 1.30 0.60 0.56 0.02 -1.26 -4.94 135.00 126.24 2nsg s PRO 238 Ca 0.61 1.54 -0.16 0.00 0.02 0.00 0.00 61.00 63.02 2nsg s PRO 238 Cb -0.16 -1.76 -0.03 0.00 0.02 0.00 0.00 34.50 32.57 2nsg s PRO 238 CO 0.55 -2.42 1.07 1.03 -0.33 0.00 0.00 177.00 176.90 2nsg s ARG 239 N -4.58 3.22 0.00 5.54 3.00 -1.26 -4.88 118.95 120.00 2nsg s ARG 239 Ca 0.67 1.27 0.00 0.00 0.00 0.00 0.00 55.73 57.67 2nsg s ARG 239 Cb -0.23 -2.02 0.00 0.00 0.00 0.00 0.00 34.95 32.70 2nsg s ARG 239 CO 0.56 -0.89 0.00 1.87 0.00 0.00 0.00 175.30 176.84