#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bns h LEU 12 N 0.00 0.55 -0.80 -2.67 7.12 -2.05 -1.65 115.31 115.81 2bns h LEU 12 Ca 0.00 -0.06 -0.08 0.00 0.13 0.00 0.00 57.88 57.86 2bns h LEU 12 Cb 0.00 -0.14 -0.02 0.00 -0.53 0.00 0.00 40.66 39.97 2bns h LEU 12 CO 0.00 0.52 0.02 0.00 -0.13 0.00 0.00 178.44 178.84 2bns h ALA 13 N 1.57 1.00 -0.43 1.25 0.00 -2.05 -0.22 119.26 120.37 2bns h ALA 13 Ca 0.14 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.64 2bns h ALA 13 Cb 0.16 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 2bns h ALA 13 CO -0.01 0.62 -0.26 0.77 0.00 0.00 0.00 179.25 180.36 2bns h SER 14 N 0.86 0.95 -0.46 0.00 0.02 -1.77 -1.27 113.55 111.87 2bns h SER 14 Ca 0.16 -0.38 -0.07 0.00 -0.84 0.00 0.00 61.79 60.67 2bns h SER 14 Cb 0.48 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 2bns h SER 14 CO 0.02 1.15 0.05 0.25 -1.14 0.00 0.00 176.83 177.16 2bns h LEU 15 N 0.78 0.81 -0.23 5.07 5.85 -1.19 -2.18 115.31 124.22 2bns h LEU 15 Ca 0.09 -0.18 -0.18 0.00 0.84 0.00 0.00 57.88 58.45 2bns h LEU 15 Cb 0.83 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.65 2bns h LEU 15 CO 0.07 0.84 -0.57 0.00 -0.34 0.00 0.00 178.44 178.44 2bns h ALA 16 N 1.25 0.38 -0.22 1.25 0.00 -0.76 -0.80 119.26 120.37 2bns h ALA 16 Ca 0.16 -0.52 -0.17 0.00 0.00 0.00 0.00 54.91 54.38 2bns h ALA 16 Cb 0.41 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2bns h ALA 16 CO 0.01 0.62 -0.53 0.97 0.00 0.00 0.00 179.25 180.31 2bns h ILE 17 N 0.55 1.30 -0.27 0.00 6.09 -1.21 -0.26 117.51 123.70 2bns h ILE 17 Ca -0.01 -1.75 -0.02 0.00 -1.37 0.00 0.00 64.86 61.72 2bns h ILE 17 Cb 1.19 1.82 -0.01 0.00 0.47 0.00 0.00 36.82 40.29 2bns h ILE 17 CO 0.13 0.55 0.10 0.22 -3.07 0.00 0.00 178.15 176.08 2bns h TYR 18 N 0.48 0.43 -0.41 2.19 3.20 -1.44 -1.96 116.97 119.46 2bns h TYR 18 Ca -0.00 -0.04 0.06 0.00 3.14 0.00 0.00 58.73 61.89 2bns h TYR 18 Cb 1.15 -0.13 -0.05 0.00 1.54 0.00 0.00 36.73 39.24 2bns h TYR 18 CO 0.09 0.44 0.12 0.77 -1.64 0.00 0.00 178.16 177.93 2bns h SER 19 N 0.29 0.09 -0.78 -2.11 0.02 -1.05 -2.44 113.55 107.58 2bns h SER 19 Ca 0.09 0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 2bns h SER 19 Cb 0.20 0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.76 2bns h SER 19 CO -0.01 0.09 0.41 0.15 -1.14 0.00 0.00 176.83 176.33 2bns h PHE 20 N 0.27 1.10 -0.43 3.45 3.57 -0.89 -1.07 116.94 122.95 2bns h PHE 20 Ca 0.19 -0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.60 2bns h PHE 20 Cb 0.20 -0.35 -0.02 0.00 2.79 0.00 0.00 35.95 38.58 2bns h PHE 20 CO -0.17 0.78 0.00 -1.49 -2.23 0.00 0.00 178.31 175.20 2bns h TRP 21 N 1.12 0.73 -0.00 0.41 4.06 -0.92 -0.39 115.95 120.95 2bns h TRP 21 Ca 0.28 -0.09 -0.00 0.00 2.06 0.00 0.00 58.89 61.14 2bns h TRP 21 Cb 0.07 -0.20 -0.00 0.00 -1.00 0.00 0.00 29.16 28.02 2bns h TRP 21 CO 0.01 0.69 0.00 0.82 -3.56 0.00 0.00 178.44 176.40 2bns h ILE 22 N 0.65 1.15 -1.00 1.49 1.08 -0.93 -2.39 117.51 117.56 2bns h ILE 22 Ca 0.13 -0.45 0.21 0.00 -0.39 0.00 0.00 64.86 64.36 2bns h ILE 22 Cb 0.40 1.46 -0.11 0.00 -3.07 0.00 0.00 36.82 35.50 2bns h ILE 22 CO 0.02 0.12 0.61 0.15 -0.69 0.00 0.00 178.15 178.35 2bns h PHE 23 N -0.19 1.04 -0.03 1.37 3.57 -0.95 -1.92 116.94 119.83 2bns h PHE 23 Ca 0.00 0.03 -0.20 0.00 3.53 0.00 0.00 57.97 61.34 2bns h PHE 23 Cb 0.19 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.62 2bns h PHE 23 CO -0.01 0.18 -0.83 1.25 -2.23 0.00 0.00 178.31 176.67 2bns h LEU 24 N 0.70 0.40 -0.59 0.59 5.85 -0.78 -0.27 115.31 121.21 2bns h LEU 24 Ca 0.60 -0.30 -0.13 0.00 0.84 0.00 0.00 57.88 58.90 2bns h LEU 24 Cb 1.01 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 2bns h LEU 24 CO -0.41 1.07 -0.23 0.00 -0.34 0.00 0.00 178.44 178.53 2bns h ALA 25 N 0.91 0.78 -0.73 1.25 0.00 -1.15 0.21 119.26 120.54 2bns h ALA 25 Ca -0.05 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.43 2bns h ALA 25 Cb 1.44 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 2bns h ALA 25 CO 0.14 0.65 0.26 0.78 0.00 0.00 0.00 179.25 181.08 2bns h GLY 26 N 0.92 1.19 0.91 0.00 0.00 -1.03 -2.00 103.07 103.05 2bns h GLY 26 Ca 0.10 -0.66 -0.12 0.00 0.00 0.00 0.00 47.33 46.65 2bns h GLY 26 CO 0.06 0.62 -0.34 -2.00 0.00 0.00 0.00 176.54 174.89 2bns h LEU 27 N 1.07 0.65 -1.38 3.11 5.85 -0.79 -1.80 115.31 122.02 2bns h LEU 27 Ca 0.24 -0.53 -0.02 0.00 0.84 0.00 0.00 57.88 58.42 2bns h LEU 27 Cb 0.25 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 2bns h LEU 27 CO -0.02 1.05 0.22 0.40 -0.34 0.00 0.00 178.44 179.76 2bns h ILE 28 N 0.27 1.16 -0.24 4.05 2.04 -0.89 0.01 117.51 123.90 2bns h ILE 28 Ca 0.02 -0.44 -0.06 0.00 1.00 0.00 0.00 64.86 65.37 2bns h ILE 28 Cb 0.92 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 2bns h ILE 28 CO 0.08 0.18 -0.08 0.22 0.00 0.00 0.00 178.15 178.55 2bns h TYR 29 N 0.64 0.55 -0.49 1.37 3.20 -1.23 -1.19 116.97 119.83 2bns h TYR 29 Ca 0.16 -0.13 0.01 0.00 3.14 0.00 0.00 58.73 61.92 2bns h TYR 29 Cb 0.07 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.18 2bns h TYR 29 CO 0.00 0.73 0.31 -0.92 -1.64 0.00 0.00 178.16 176.64 2bns h TYR 30 N 0.22 0.58 -0.17 -3.82 3.20 -1.00 -2.61 116.97 113.36 2bns h TYR 30 Ca 0.06 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.88 2bns h TYR 30 Cb 0.56 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.64 2bns h TYR 30 CO 0.06 0.35 -0.14 -0.07 -1.64 0.00 0.00 178.16 176.72 2bns h LEU 31 N 0.62 0.42 -1.22 2.82 3.38 -0.81 -1.07 115.31 119.46 2bns h LEU 31 Ca 0.19 -0.45 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 2bns h LEU 31 Cb -0.02 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 2bns h LEU 31 CO -0.07 0.79 0.34 -0.61 0.09 0.00 0.00 178.44 178.98 2bns h GLN 32 N 0.06 0.88 -0.04 1.13 5.75 -1.25 -1.83 115.11 119.80 2bns h GLN 32 Ca 0.03 -0.10 -0.21 0.00 -0.15 0.00 0.00 58.65 58.23 2bns h GLN 32 Cb 0.65 -0.18 -0.00 0.00 1.07 0.00 0.00 27.48 29.03 2bns h GLN 32 CO 0.04 0.65 -0.84 1.79 -2.65 0.00 0.00 178.83 177.82 2bns h THR 33 N 0.89 1.39 -0.06 2.39 1.35 -1.26 -2.38 112.91 115.22 2bns h THR 33 Ca 0.22 -2.31 0.01 0.00 -0.55 0.00 0.00 66.41 63.79 2bns h THR 33 Cb 0.04 2.27 -0.00 0.00 -1.73 0.00 0.00 68.15 68.73 2bns h THR 33 CO -0.04 0.69 0.04 -0.33 -0.25 0.00 0.00 175.52 175.64 2bns h GLU 34 N 0.26 0.05 -0.45 4.72 4.39 -0.95 -2.44 114.58 120.16 2bns h GLU 34 Ca -0.06 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.64 2bns h GLU 34 Cb 1.45 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 30.09 2bns h GLU 34 CO 0.15 0.03 0.00 0.09 -1.16 0.00 0.00 179.01 178.12 2bns n ASN 35 N -4.53 2.42 -1.03 1.42 3.02 -0.71 -3.27 115.26 112.59 2bns n ASN 35 Ca -0.02 -2.01 0.08 0.00 -0.03 0.00 0.00 54.58 52.60 2bns n ASN 35 Cb 0.11 -0.31 0.27 0.00 -0.61 0.00 0.00 39.78 39.24 2bns n ASN 35 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 2bns n MET 36 N 0.80 3.22 0.12 3.52 2.81 -0.92 -4.61 117.12 122.07 2bns n MET 36 Ca 0.15 -2.77 0.13 0.00 -1.81 0.00 0.00 57.70 53.40 2bns n MET 36 Cb 0.39 -1.82 0.40 0.00 -0.71 0.00 0.00 33.22 31.48 2bns n MET 36 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2bns h ARG 37 N 2.26 0.00 -6.23 0.03 3.08 -1.68 -3.39 114.38 108.45 2bns h ARG 37 Ca 0.00 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.44 2bns h ARG 37 Cb 1.41 0.00 -0.26 0.00 0.08 0.00 0.00 29.97 31.20 2bns h ARG 37 CO 0.22 0.00 -0.85 -1.21 -1.07 0.00 0.00 179.97 177.06 2bns s GLU 38 N -3.16 1.50 0.00 0.04 0.41 -1.26 -3.84 118.70 112.40 2bns s GLU 38 Ca 0.09 -0.97 0.00 0.00 -0.41 0.00 0.00 54.97 53.68 2bns s GLU 38 Cb 0.11 -1.62 0.00 0.00 -1.78 0.00 0.00 34.13 30.84 2bns s GLU 38 CO 0.57 0.42 0.00 0.41 -0.49 0.00 0.00 175.26 176.17 2bns n GLY 39 N 1.87 2.51 3.90 -1.39 0.00 -1.26 -5.02 105.19 105.80 2bns n GLY 39 Ca -0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 2bns n GLY 39 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bns s TYR 40 N -2.29 3.41 0.65 1.61 1.51 -1.26 -4.26 117.35 116.72 2bns s TYR 40 Ca 0.00 0.12 -0.15 0.00 -1.01 0.00 0.00 57.07 56.02 2bns s TYR 40 Cb 0.00 -1.65 -0.01 0.00 -0.11 0.00 0.00 41.96 40.19 2bns s TYR 40 CO 0.00 0.53 1.11 -2.14 -1.11 0.00 0.00 175.55 173.94 2bns s PRO 41 N -3.01 2.86 0.86 -1.71 0.02 -1.26 -4.84 135.00 127.92 2bns s PRO 41 Ca 0.34 1.40 -0.12 0.00 0.02 0.00 0.00 61.00 62.64 2bns s PRO 41 Cb -0.11 -1.96 0.11 0.00 0.02 0.00 0.00 34.50 32.56 2bns s PRO 41 CO 0.27 -1.21 1.15 1.28 -0.33 0.00 0.00 177.00 178.16 2bns n LEU 42 N -2.32 3.75 -4.13 -5.54 4.77 -1.26 -4.95 117.00 107.32 2bns n LEU 42 Ca 0.10 0.50 -0.18 0.00 -0.03 0.00 0.00 56.01 56.40 2bns n LEU 42 Cb 0.52 -1.48 -0.13 0.00 -2.33 0.00 0.00 43.42 40.00 2bns n LEU 42 CO 0.47 -1.98 -0.45 -1.61 -1.33 0.00 0.00 177.39 172.49 2bns s GLU 43 N -4.33 0.82 0.98 3.23 2.02 -1.26 -2.26 118.70 117.90 2bns s GLU 43 Ca 0.70 -0.76 -0.12 0.00 0.02 0.00 0.00 54.97 54.81 2bns s GLU 43 Cb -0.26 -0.80 0.18 0.00 0.10 0.00 0.00 34.13 33.35 2bns s GLU 43 CO 0.55 0.19 1.08 -0.80 0.02 0.00 0.00 175.26 176.30 2bns s ASN 44 N -1.25 2.69 0.55 -0.19 0.01 0.11 -4.64 114.94 112.23 2bns s ASN 44 Ca -0.01 1.46 0.34 0.00 -0.71 0.00 0.00 52.86 53.94 2bns s ASN 44 Cb -0.08 -2.14 1.47 0.00 0.41 0.00 0.00 41.25 40.91 2bns s ASN 44 CO 0.01 -3.13 2.03 -0.33 -1.51 0.00 0.00 177.10 174.17 2bns h GLU 45 N -1.89 0.00 0.00 -0.60 5.08 -2.01 -2.12 114.58 113.04 2bns h GLU 45 Ca -0.53 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.83 2bns h GLU 45 Cb 1.31 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.56 2bns h GLU 45 CO 0.54 0.03 0.00 -0.40 -1.00 0.00 0.00 179.01 178.18 2bns n ASP 46 N -3.16 0.00 0.00 1.42 5.68 -1.26 -4.93 116.55 114.30 2bns n ASP 46 Ca -0.00 -0.91 0.00 0.00 -0.50 0.00 0.00 54.79 53.38 2bns n ASP 46 Cb 0.28 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.25 2bns n ASP 46 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2bns n GLY 47 N 0.92 2.77 3.79 6.12 0.00 -0.80 -5.07 105.19 112.92 2bns n GLY 47 Ca 0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.93 2bns n GLY 47 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bns s THR 48 N -2.66 3.55 0.13 2.61 -4.23 -1.26 -4.73 115.64 109.06 2bns s THR 48 Ca 0.00 0.59 -0.31 0.00 -1.18 0.00 0.00 61.69 60.79 2bns s THR 48 Cb 0.00 -3.15 -0.09 0.00 1.34 0.00 0.00 72.50 70.60 2bns s THR 48 CO 0.00 -0.58 1.60 -2.84 -0.54 0.00 0.00 174.62 172.26 2bns s PRO 49 N -4.61 4.21 0.40 3.99 0.02 -1.26 0.09 135.00 137.84 2bns s PRO 49 Ca 0.62 2.35 -0.26 0.00 0.02 0.00 0.00 61.00 63.73 2bns s PRO 49 Cb -0.17 -3.30 -0.09 0.00 0.02 0.00 0.00 34.50 30.96 2bns s PRO 49 CO 0.49 -0.65 1.27 0.00 -0.33 0.00 0.00 177.00 177.78 2bns s ALA 50 N 1.64 3.24 0.30 -1.55 0.00 -0.96 -4.63 121.76 119.81 2bns s ALA 50 Ca 0.71 1.16 0.03 0.00 0.00 0.00 0.00 51.96 53.87 2bns s ALA 50 Cb -0.42 -3.46 0.47 0.00 0.00 0.00 0.00 23.12 19.71 2bns s ALA 50 CO 0.32 -0.74 1.77 0.00 0.00 0.00 0.00 175.76 177.11 2bns h ALA 51 N 2.71 1.18 -2.28 0.00 0.00 -1.94 -3.41 119.26 115.53 2bns h ALA 51 Ca -0.49 -0.30 -0.68 0.00 0.00 0.00 0.00 54.91 53.43 2bns h ALA 51 Cb 1.24 -0.13 -0.17 0.00 0.00 0.00 0.00 17.79 18.73 2bns h ALA 51 CO 0.63 0.52 -0.07 1.21 0.00 0.00 0.00 179.25 181.53 2bns s ASN 52 N -6.79 6.24 0.00 0.00 2.47 -1.26 -4.92 114.94 110.68 2bns s ASN 52 Ca -0.07 -0.58 0.13 0.00 0.42 0.00 0.00 52.86 52.76 2bns s ASN 52 Cb 0.14 -2.26 0.27 0.00 -1.45 0.00 0.00 41.25 37.95 2bns s ASN 52 CO 0.78 -0.67 1.17 0.00 -3.72 0.00 0.00 177.10 174.65 2bns n GLN 53 N 5.87 2.13 0.00 0.43 1.13 -1.26 -4.87 117.38 120.80 2bns n GLN 53 Ca -0.05 -1.85 0.00 0.00 -1.94 0.00 0.00 57.00 53.16 2bns n GLN 53 Cb 0.47 -1.30 0.00 0.00 0.11 0.00 0.00 30.24 29.53 2bns n GLN 53 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2bns n GLY 54 N 0.73 -0.33 0.16 1.08 0.00 -1.26 -4.69 105.19 100.88 2bns n GLY 54 Ca 0.12 -1.81 0.05 0.00 0.00 0.00 0.00 46.02 44.38 2bns n GLY 54 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bns h PRO 55 N 0.00 0.00 -6.21 1.61 0.13 -2.04 -3.45 132.00 122.04 2bns h PRO 55 Ca 0.00 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.56 2bns h PRO 55 Cb 0.00 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.08 2bns h PRO 55 CO 0.00 0.35 -0.03 -0.06 -0.23 0.00 0.00 178.00 178.03 2bns s PHE 56 N -3.03 3.78 0.38 1.56 0.08 -1.26 -5.07 117.98 114.42 2bns s PHE 56 Ca 0.04 1.27 -0.19 0.00 0.12 0.00 0.00 56.93 58.17 2bns s PHE 56 Cb 0.07 -2.53 -0.10 0.00 -0.57 0.00 0.00 43.02 39.89 2bns s PHE 56 CO 0.73 0.54 0.86 -1.25 -0.10 0.00 0.00 175.22 176.00 2bns s PRO 57 N -0.92 4.17 0.21 0.24 0.04 -1.26 -5.01 135.00 132.47 2bns s PRO 57 Ca 0.29 0.96 -0.31 0.00 0.04 0.00 0.00 61.00 61.99 2bns s PRO 57 Cb -0.19 -2.33 -0.15 0.00 0.04 0.00 0.00 34.50 31.86 2bns s PRO 57 CO 0.19 0.07 1.06 1.28 0.04 0.00 0.00 177.00 179.64 2bns n LEU 58 N -0.42 1.36 -4.81 -3.56 4.77 -1.26 -4.82 117.00 108.26 2bns n LEU 58 Ca 0.05 1.15 -0.33 0.00 -0.03 0.00 0.00 56.01 56.85 2bns n LEU 58 Cb 0.53 -1.21 -0.04 0.00 -2.33 0.00 0.00 43.42 40.37 2bns n LEU 58 CO 0.39 -1.48 0.70 -2.16 -1.33 0.00 0.00 177.39 173.51 2bns s PRO 59 N -0.79 3.86 0.21 3.23 0.04 -1.26 -4.99 135.00 135.29 2bns s PRO 59 Ca 0.68 1.24 -0.30 0.00 0.04 0.00 0.00 61.00 62.66 2bns s PRO 59 Cb -0.82 -2.11 -0.09 0.00 0.04 0.00 0.00 34.50 31.52 2bns s PRO 59 CO 0.55 -0.36 1.28 0.15 0.04 0.00 0.00 177.00 178.65 2bns s LYS 60 N -3.42 4.42 0.66 4.56 3.01 -1.26 -4.55 119.74 123.16 2bns s LYS 60 Ca 0.65 2.02 -0.18 0.00 -1.01 0.00 0.00 55.97 57.45 2bns s LYS 60 Cb -0.14 -3.19 -0.00 0.00 -1.01 0.00 0.00 37.83 33.49 2bns s LYS 60 CO 0.22 -0.20 1.29 -2.30 0.51 0.00 0.00 175.35 174.87 2bns n PRO 61 N 2.39 1.05 -4.23 -1.68 -0.02 -1.26 -4.77 135.00 126.48 2bns n PRO 61 Ca 0.05 0.42 -0.16 0.00 -2.02 0.00 0.00 63.50 61.79 2bns n PRO 61 Cb 0.43 -2.53 -0.11 0.00 -0.02 0.00 0.00 33.50 31.27 2bns n PRO 61 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2bns s LYS 62 N -3.43 1.00 -0.06 -0.52 -2.85 -0.10 -4.93 119.74 108.86 2bns s LYS 62 Ca 0.82 -1.28 0.06 0.00 -1.00 0.00 0.00 55.97 54.57 2bns s LYS 62 Cb -0.37 -0.76 -0.01 0.00 -2.06 0.00 0.00 37.83 34.63 2bns s LYS 62 CO 0.41 0.13 -0.24 0.99 0.10 0.00 0.00 175.35 176.74 2bns s THR 63 N -2.50 1.94 -0.09 3.79 2.01 -1.26 -1.38 115.64 118.14 2bns s THR 63 Ca 0.10 -1.00 -0.02 0.00 0.31 0.00 0.00 61.69 61.08 2bns s THR 63 Cb -0.03 -1.64 -0.03 0.00 0.01 0.00 0.00 72.50 70.81 2bns s THR 63 CO 0.02 0.54 0.02 -0.36 -0.69 0.00 0.00 174.62 174.15 2bns s PHE 64 N -0.12 3.22 -0.35 4.92 0.08 -0.50 -4.99 117.98 120.25 2bns s PHE 64 Ca -0.04 0.24 -0.11 0.00 0.12 0.00 0.00 56.93 57.14 2bns s PHE 64 Cb -0.13 -1.81 0.00 0.00 -0.57 0.00 0.00 43.02 40.51 2bns s PHE 64 CO 0.04 0.51 0.20 0.42 -0.10 0.00 0.00 175.22 176.29 2bns s ILE 65 N -0.91 4.80 0.33 0.64 1.01 -1.26 -2.14 121.20 123.66 2bns s ILE 65 Ca 0.14 -0.54 -0.27 0.00 0.00 0.00 0.00 60.65 59.98 2bns s ILE 65 Cb -0.11 -3.55 -0.09 0.00 0.01 0.00 0.00 42.46 38.72 2bns s ILE 65 CO 0.03 -0.08 1.04 -0.76 0.00 0.00 0.00 174.94 175.16 2bns s LEU 66 N 1.62 4.37 0.89 2.97 1.43 -0.71 -5.03 118.68 124.23 2bns s LEU 66 Ca 0.04 2.07 -0.11 0.00 -1.03 0.00 0.00 54.13 55.10 2bns s LEU 66 Cb -0.18 -3.90 0.13 0.00 0.03 0.00 0.00 46.19 42.26 2bns s LEU 66 CO 0.08 -0.23 1.09 -2.16 0.23 0.00 0.00 176.35 175.36 2bns s PRO 67 N -1.92 1.28 -1.20 1.29 0.04 -1.26 -4.05 135.00 129.18 2bns s PRO 67 Ca 0.50 0.84 0.00 0.00 0.04 0.00 0.00 61.00 62.38 2bns s PRO 67 Cb -0.25 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.48 2bns s PRO 67 CO 0.32 -2.23 0.00 0.72 0.04 0.00 0.00 177.00 175.85 2bns n HIS 68 N -3.88 -0.65 -1.15 0.56 8.25 -1.26 -2.62 115.22 114.46 2bns n HIS 68 Ca 0.07 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.48 2bns n HIS 68 Cb 0.55 -2.99 -0.02 0.00 1.12 0.00 0.00 29.99 28.65 2bns n HIS 68 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bns n GLY 69 N -1.02 0.74 0.00 -1.41 0.00 -1.26 -4.90 105.19 97.33 2bns n GLY 69 Ca -0.17 -0.36 0.10 0.00 0.00 0.00 0.00 46.02 45.60 2bns n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bns n ARG 70 N -2.12 0.90 0.00 1.61 5.12 -1.08 -4.99 116.66 116.11 2bns n ARG 70 Ca -0.05 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.87 2bns n ARG 70 Cb 0.26 -1.36 0.00 0.00 -1.16 0.00 0.00 32.46 30.20 2bns n ARG 70 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2bns n GLY 71 N 0.69 -0.35 3.06 -0.13 0.00 -1.26 -4.89 105.19 102.31 2bns n GLY 71 Ca 0.15 -1.86 -0.11 0.00 0.00 0.00 0.00 46.02 44.20 2bns n GLY 71 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bns s THR 72 N 0.00 0.06 -0.13 2.61 -4.23 -1.26 -1.74 115.64 110.95 2bns s THR 72 Ca 0.00 -0.49 -0.01 0.00 -1.18 0.00 0.00 61.69 60.01 2bns s THR 72 Cb 0.00 -0.33 -0.02 0.00 1.34 0.00 0.00 72.50 73.49 2bns s THR 72 CO 0.00 -0.27 -0.09 -0.22 -0.54 0.00 0.00 174.62 173.50 2bns s LEU 73 N -0.91 2.94 -0.15 4.79 1.98 -0.91 -4.97 118.68 121.45 2bns s LEU 73 Ca -0.10 -0.22 0.00 0.00 -2.89 0.00 0.00 54.13 50.92 2bns s LEU 73 Cb -0.06 -1.67 -0.00 0.00 0.66 0.00 0.00 46.19 45.12 2bns s LEU 73 CO 0.01 0.19 -0.15 -0.89 -1.89 0.00 0.00 176.35 173.62 2bns s THR 74 N 0.19 2.68 -0.01 3.68 2.01 -1.26 -1.41 115.64 121.52 2bns s THR 74 Ca -0.05 -0.77 -0.00 0.00 0.31 0.00 0.00 61.69 61.17 2bns s THR 74 Cb -0.15 -2.13 0.01 0.00 0.01 0.00 0.00 72.50 70.25 2bns s THR 74 CO 0.04 0.52 0.02 0.68 -0.69 0.00 0.00 174.62 175.19 2bns s VAL 75 N 0.73 -0.03 0.70 3.82 -7.23 -0.48 -3.93 120.40 113.99 2bns s VAL 75 Ca -0.07 0.09 -0.11 0.00 -1.81 0.00 0.00 61.98 60.08 2bns s VAL 75 Cb -0.16 -0.05 0.01 0.00 0.56 0.00 0.00 36.38 36.75 2bns s VAL 75 CO 0.01 0.04 1.06 -2.16 -0.31 0.00 0.00 175.10 173.74 2bns s PRO 76 N 0.46 2.86 0.21 4.82 0.04 -1.25 -0.92 135.00 141.22 2bns s PRO 76 Ca -0.04 1.01 -0.10 0.00 0.04 0.00 0.00 61.00 61.92 2bns s PRO 76 Cb -0.05 -1.98 0.04 0.00 0.04 0.00 0.00 34.50 32.54 2bns s PRO 76 CO -0.01 -1.16 0.50 0.41 0.04 0.00 0.00 177.00 176.78 2bns n GLY 77 N -1.77 1.27 3.42 0.56 0.00 -1.25 -4.68 105.19 102.74 2bns n GLY 77 Ca 0.08 -1.14 -0.52 0.00 0.00 0.00 0.00 46.02 44.44 2bns n GLY 77 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2bns n PRO 78 N -0.34 0.93 -4.22 1.61 -0.02 -1.26 -4.92 135.00 126.78 2bns n PRO 78 Ca -0.04 0.25 -0.34 0.00 -2.02 0.00 0.00 63.50 61.35 2bns n PRO 78 Cb 0.35 -2.32 -0.10 0.00 -0.02 0.00 0.00 33.50 31.41 2bns n PRO 78 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2bns s GLU 79 N 6.12 3.69 0.04 -0.52 2.56 -1.26 -5.10 118.70 124.22 2bns s GLU 79 Ca 1.11 -0.42 -0.10 0.00 0.00 0.00 0.00 54.97 55.57 2bns s GLU 79 Cb -0.95 -3.03 0.00 0.00 2.00 0.00 0.00 34.13 32.15 2bns s GLU 79 CO 0.52 0.35 0.20 -1.54 -0.56 0.00 0.00 175.26 174.22 2bns s SER 80 N 0.12 0.03 -0.55 -1.70 1.04 -1.26 -5.07 113.70 106.31 2bns s SER 80 Ca 0.02 -0.35 -0.24 0.00 0.48 0.00 0.00 55.95 55.87 2bns s SER 80 Cb -0.13 0.29 0.04 0.00 0.10 0.00 0.00 66.02 66.32 2bns s SER 80 CO 0.02 -0.55 0.91 -1.61 0.98 0.00 0.00 173.24 172.98 2bns s GLU 81 N -2.51 3.30 -1.24 4.02 0.41 -1.26 -4.96 118.70 116.46 2bns s GLU 81 Ca -0.05 -0.35 -0.16 0.00 -0.41 0.00 0.00 54.97 54.00 2bns s GLU 81 Cb -0.01 -4.06 0.12 0.00 -1.78 0.00 0.00 34.13 28.39 2bns s GLU 81 CO -0.04 -1.47 1.58 0.16 -0.49 0.00 0.00 175.26 175.01 2bns s ASP 82 N 2.85 6.94 -0.28 -0.19 3.84 -1.26 -4.76 116.67 123.81 2bns s ASP 82 Ca 0.28 -2.67 -0.26 0.00 -0.00 0.00 0.00 52.55 49.90 2bns s ASP 82 Cb -0.13 -2.49 0.17 0.00 -1.38 0.00 0.00 42.92 39.09 2bns s ASP 82 CO 0.18 -0.98 1.32 0.00 -0.00 0.00 0.00 175.17 175.69 2bns s ARG 83 N 2.98 0.18 0.38 2.11 1.70 -1.26 -4.90 118.95 120.14 2bns s ARG 83 Ca 0.48 0.17 -0.27 0.00 -0.47 0.00 0.00 55.73 55.64 2bns s ARG 83 Cb 0.01 0.09 -0.09 0.00 -0.57 0.00 0.00 34.95 34.38 2bns s ARG 83 CO 0.03 -0.03 1.27 -2.14 -1.08 0.00 0.00 175.30 173.35 2bns s PRO 84 N -0.20 4.12 -0.30 3.89 0.02 -1.26 -5.02 135.00 136.26 2bns s PRO 84 Ca 0.06 2.09 -0.07 0.00 0.02 0.00 0.00 61.00 63.10 2bns s PRO 84 Cb -0.04 -2.84 0.01 0.00 0.02 0.00 0.00 34.50 31.65 2bns s PRO 84 CO -0.11 -0.35 0.09 0.42 -0.33 0.00 0.00 177.00 176.72 2bns s ILE 85 N -1.26 4.01 -1.37 2.83 -1.09 -1.26 -5.02 121.20 118.05 2bns s ILE 85 Ca 0.54 -0.69 -0.11 0.00 -2.23 0.00 0.00 60.65 58.17 2bns s ILE 85 Cb -0.37 -3.07 0.10 0.00 -1.58 0.00 0.00 42.46 37.55 2bns s ILE 85 CO 0.47 0.07 2.08 0.00 -1.23 0.00 0.00 174.94 176.33 2bns n ALA 86 N 4.87 5.57 -2.33 9.38 0.00 -1.26 -4.88 120.51 131.86 2bns n ALA 86 Ca -0.14 -4.10 -0.13 0.00 0.00 0.00 0.00 53.44 49.07 2bns n ALA 86 Cb 0.48 -3.22 -0.10 0.00 0.00 0.00 0.00 19.45 16.60 2bns n ALA 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2bns s LEU 87 N 0.78 2.47 0.06 0.00 1.43 -1.26 -2.24 118.68 119.92 2bns s LEU 87 Ca 0.44 -0.92 0.04 0.00 -1.03 0.00 0.00 54.13 52.67 2bns s LEU 87 Cb 0.12 -0.22 -0.03 0.00 0.03 0.00 0.00 46.19 46.09 2bns s LEU 87 CO -0.04 -0.35 -0.13 0.00 0.23 0.00 0.00 176.35 176.06 2bns s ALA 88 N -3.04 1.04 0.44 4.21 0.00 -0.55 -4.84 121.76 119.02 2bns s ALA 88 Ca 0.10 -0.92 -0.26 0.00 0.00 0.00 0.00 51.96 50.89 2bns s ALA 88 Cb 0.01 -0.08 -0.08 0.00 0.00 0.00 0.00 23.12 22.97 2bns s ALA 88 CO -0.02 0.14 1.41 0.50 0.00 0.00 0.00 175.76 177.79 2bns s ARG 89 N -1.60 3.76 0.00 0.00 3.52 -1.26 -1.63 118.95 121.74 2bns s ARG 89 Ca -0.03 2.38 0.15 0.00 -0.13 0.00 0.00 55.73 58.10 2bns s ARG 89 Cb -0.10 -2.69 0.11 0.00 -1.56 0.00 0.00 34.95 30.72 2bns s ARG 89 CO 0.02 -0.74 0.98 2.41 -0.81 0.00 0.00 175.30 177.15 2bns n THR 90 N -0.10 0.00 -3.58 4.11 -1.04 -1.23 -4.85 114.28 107.59 2bns n THR 90 Ca 0.05 -0.49 -0.10 0.00 -2.04 0.00 0.00 64.05 61.46 2bns n THR 90 Cb 0.42 1.31 -0.05 0.00 -1.82 0.00 0.00 70.33 70.19 2bns n THR 90 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2bns s ALA 91 N -1.33 -1.94 0.11 2.41 0.00 -1.26 -5.02 121.76 114.73 2bns s ALA 91 Ca 0.18 1.61 -0.22 0.00 0.00 0.00 0.00 51.96 53.52 2bns s ALA 91 Cb 0.13 -0.77 -0.07 0.00 0.00 0.00 0.00 23.12 22.41 2bns s ALA 91 CO 0.21 -0.30 1.71 0.28 0.00 0.00 0.00 175.76 177.65 2bns h VAL 92 N 2.62 0.81 -3.48 0.00 2.07 -2.03 -3.44 116.25 112.80 2bns h VAL 92 Ca -0.19 0.00 -0.47 0.00 0.82 0.00 0.00 66.70 66.86 2bns h VAL 92 Cb 1.16 0.81 0.05 0.00 -1.52 0.00 0.00 31.29 31.79 2bns h VAL 92 CO 0.30 0.00 0.12 -0.94 0.02 0.00 0.00 177.57 177.07 2bns s SER 93 N -5.13 5.71 0.50 0.57 1.04 -1.26 -5.07 113.70 110.06 2bns s SER 93 Ca -0.14 0.66 -0.16 0.00 0.48 0.00 0.00 55.95 56.79 2bns s SER 93 Cb 0.08 -1.73 -0.08 0.00 0.10 0.00 0.00 66.02 64.39 2bns s SER 93 CO 0.67 -0.94 0.97 -1.61 0.98 0.00 0.00 173.24 173.30 2bns s GLU 94 N -4.88 3.95 0.00 4.02 2.02 -1.26 -4.46 118.70 118.09 2bns s GLU 94 Ca 0.52 0.93 0.00 0.00 0.02 0.00 0.00 54.97 56.44 2bns s GLU 94 Cb -0.10 -2.16 0.00 0.00 0.10 0.00 0.00 34.13 31.97 2bns s GLU 94 CO 0.44 -0.24 0.00 0.41 0.02 0.00 0.00 175.26 175.89 2bns n GLY 95 N -1.51 0.86 3.78 -1.39 0.00 -1.26 -5.11 105.19 100.57 2bns n GLY 95 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 2bns n GLY 95 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2bns s PHE 96 N -2.00 3.13 0.67 1.61 0.08 -1.26 -5.09 117.98 115.11 2bns s PHE 96 Ca 0.00 -0.02 -0.17 0.00 0.12 0.00 0.00 56.93 56.86 2bns s PHE 96 Cb 0.00 -1.51 -0.04 0.00 -0.57 0.00 0.00 43.02 40.90 2bns s PHE 96 CO 0.00 0.52 0.69 -2.30 -0.10 0.00 0.00 175.22 174.03 2bns n PRO 97 N -0.25 0.49 -4.39 0.24 -0.02 -1.26 -4.80 135.00 125.00 2bns n PRO 97 Ca -0.08 0.21 -0.34 0.00 -2.02 0.00 0.00 63.50 61.27 2bns n PRO 97 Cb 0.54 -1.94 -0.13 0.00 -0.02 0.00 0.00 33.50 31.96 2bns n PRO 97 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2bns s HIS 98 N -1.78 2.98 -0.06 6.00 3.76 -1.26 -3.53 115.29 121.41 2bns s HIS 98 Ca 0.70 -0.42 -0.12 0.00 -0.15 0.00 0.00 55.06 55.06 2bns s HIS 98 Cb -0.38 -1.96 -0.05 0.00 1.11 0.00 0.00 32.58 31.30 2bns s HIS 98 CO 0.53 -0.13 0.32 0.00 -0.85 0.00 0.00 174.74 174.62 2bns s ALA 99 N 0.51 3.73 0.21 -1.40 0.00 -0.65 -4.76 121.76 119.40 2bns s ALA 99 Ca -0.04 -0.37 -0.32 0.00 0.00 0.00 0.00 51.96 51.23 2bns s ALA 99 Cb -0.15 -2.27 -0.13 0.00 0.00 0.00 0.00 23.12 20.57 2bns s ALA 99 CO 0.03 0.46 1.56 -2.30 0.00 0.00 0.00 175.76 175.51 2bns n PRO 100 N 2.14 2.29 0.06 0.00 -0.02 -1.26 -1.48 135.00 136.73 2bns n PRO 100 Ca -0.15 0.82 -0.02 0.00 -2.02 0.00 0.00 63.50 62.13 2bns n PRO 100 Cb 0.53 -2.58 -0.06 0.00 -0.02 0.00 0.00 33.50 31.37 2bns n PRO 100 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 2bns h THR 101 N 3.47 0.86 0.00 3.45 1.35 -1.77 -3.47 112.91 116.80 2bns h THR 101 Ca -0.45 -2.40 0.00 0.00 -0.55 0.00 0.00 66.41 63.01 2bns h THR 101 Cb 1.25 2.34 0.00 0.00 -1.73 0.00 0.00 68.15 70.01 2bns h THR 101 CO 0.85 0.49 0.00 0.61 -0.25 0.00 0.00 175.52 177.22 2bns n GLY 102 N 1.36 4.24 3.54 5.82 0.00 -1.26 -5.07 105.19 113.82 2bns n GLY 102 Ca -0.05 -1.14 -0.42 0.00 0.00 0.00 0.00 46.02 44.40 2bns n GLY 102 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bns s ASP 103 N 0.97 6.36 0.32 1.61 -1.08 -1.26 -4.95 116.67 118.64 2bns s ASP 103 Ca 0.00 -0.15 0.03 0.00 -0.52 0.00 0.00 52.55 51.92 2bns s ASP 103 Cb 0.00 -2.32 0.56 0.00 -1.46 0.00 0.00 42.92 39.70 2bns s ASP 103 CO 0.00 -0.71 1.86 1.55 0.52 0.00 0.00 175.17 178.39 2bns h PRO 104 N 8.72 0.57 -0.38 4.34 0.13 -1.94 -0.02 132.00 143.42 2bns h PRO 104 Ca -0.26 -0.12 -0.05 0.00 -0.87 0.00 0.00 66.00 64.70 2bns h PRO 104 Cb 1.10 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.14 2bns h PRO 104 CO 0.87 0.59 0.05 0.52 -0.23 0.00 0.00 178.00 179.79 2bns h MET 105 N 0.54 0.63 0.00 0.86 2.86 -1.92 -0.42 114.93 117.48 2bns h MET 105 Ca 0.11 -0.18 -0.10 0.00 -2.06 0.00 0.00 59.70 57.48 2bns h MET 105 Cb 0.34 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 2bns h MET 105 CO 0.01 0.70 -0.48 0.87 1.06 0.00 0.00 176.91 179.07 2bns h LYS 106 N 0.47 0.00 0.00 1.72 1.57 -1.86 -3.28 116.57 115.19 2bns h LYS 106 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2bns h LYS 106 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.70 2bns h LYS 106 CO 0.01 0.48 -0.59 -0.25 -0.57 0.00 0.00 179.45 178.53 2bns n ASP 107 N -3.34 0.57 -1.78 0.86 8.00 -0.05 -5.00 116.55 115.81 2bns n ASP 107 Ca 0.01 -0.27 -0.05 0.00 0.71 0.00 0.00 54.79 55.19 2bns n ASP 107 Cb 0.66 0.35 0.03 0.00 -0.02 0.00 0.00 41.12 42.14 2bns n ASP 107 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bns n GLY 108 N 1.47 0.22 3.45 0.44 0.00 -0.22 -4.71 105.19 105.84 2bns n GLY 108 Ca 0.05 -0.26 -0.22 0.00 0.00 0.00 0.00 46.02 45.60 2bns n GLY 108 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bns s VAL 109 N -3.11 1.37 0.00 1.61 -7.23 -0.88 -3.83 120.40 108.33 2bns s VAL 109 Ca 0.02 -2.04 0.00 0.00 -1.81 0.00 0.00 61.98 58.16 2bns s VAL 109 Cb -0.00 -2.67 0.00 0.00 0.56 0.00 0.00 36.38 34.27 2bns s VAL 109 CO 0.22 -0.12 0.00 0.61 -0.31 0.00 0.00 175.10 175.50 2bns n GLY 110 N -0.66 2.42 0.00 2.32 0.00 -1.26 -1.05 105.19 106.97 2bns n GLY 110 Ca -0.04 -0.25 0.05 0.00 0.00 0.00 0.00 46.02 45.79 2bns n GLY 110 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2bns n PRO 111 N 14.00 0.11 -0.17 1.61 -0.04 -1.26 -1.09 135.00 148.16 2bns n PRO 111 Ca 0.00 0.22 0.07 0.00 -0.04 0.00 0.00 63.50 63.76 2bns n PRO 111 Cb 0.00 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.18 2bns n PRO 111 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bns n ALA 112 N -1.35 2.46 -1.70 0.55 0.00 -0.21 -2.97 120.51 117.28 2bns n ALA 112 Ca 0.04 -0.65 -0.35 0.00 0.00 0.00 0.00 53.44 52.48 2bns n ALA 112 Cb 0.10 -1.00 0.03 0.00 0.00 0.00 0.00 19.45 18.58 2bns n ALA 112 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2bns s SER 113 N -1.15 5.31 0.11 0.00 0.01 -0.25 -3.91 113.70 113.82 2bns s SER 113 Ca 0.28 2.26 0.03 0.00 1.31 0.00 0.00 55.95 59.83 2bns s SER 113 Cb 0.15 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.75 2bns s SER 113 CO 0.20 -1.51 -0.08 -1.66 0.41 0.00 0.00 173.24 170.61 2bns s TRP 114 N -1.78 1.01 0.03 2.43 1.48 -1.25 -4.33 118.94 116.54 2bns s TRP 114 Ca 0.74 -0.85 0.05 0.00 -1.06 0.00 0.00 56.10 54.98 2bns s TRP 114 Cb -0.27 -0.56 -0.03 0.00 -1.16 0.00 0.00 33.47 31.45 2bns s TRP 114 CO 0.33 -0.07 -0.09 0.08 -4.06 0.00 0.00 176.95 173.13 2bns s VAL 115 N -3.45 3.44 -1.24 -0.66 1.01 -1.26 -5.02 120.40 113.21 2bns s VAL 115 Ca 0.13 -0.94 -0.18 0.00 0.00 0.00 0.00 61.98 60.98 2bns s VAL 115 Cb 0.04 -2.51 -0.00 0.00 0.00 0.00 0.00 36.38 33.91 2bns s VAL 115 CO -0.03 0.33 1.93 0.00 0.00 0.00 0.00 175.10 177.33 2bns n ALA 116 N 1.39 3.68 -1.90 5.51 0.00 -1.26 -4.84 120.51 123.09 2bns n ALA 116 Ca -0.15 -3.62 -0.29 0.00 0.00 0.00 0.00 53.44 49.38 2bns n ALA 116 Cb 0.52 -3.57 0.08 0.00 0.00 0.00 0.00 19.45 16.48 2bns n ALA 116 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2bns s ARG 117 N 4.52 2.17 0.18 0.00 0.52 -1.26 -4.98 118.95 120.10 2bns s ARG 117 Ca 0.56 0.16 -0.33 0.00 -0.52 0.00 0.00 55.73 55.60 2bns s ARG 117 Cb 0.07 -1.98 -0.14 0.00 0.52 0.00 0.00 34.95 33.42 2bns s ARG 117 CO 0.05 -1.46 1.53 -2.13 0.02 0.00 0.00 175.30 173.32 2bns n ARG 118 N -3.23 2.10 -0.89 3.54 0.63 -1.26 -4.22 116.66 113.33 2bns n ARG 118 Ca 0.08 0.76 -0.11 0.00 -0.92 0.00 0.00 57.85 57.66 2bns n ARG 118 Cb 0.60 -2.49 -0.15 0.00 0.45 0.00 0.00 32.46 30.87 2bns n ARG 118 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 2bns n ASP 119 N 3.06 4.75 -4.09 6.15 2.03 -1.26 -1.99 116.55 125.19 2bns n ASP 119 Ca 0.16 -2.38 -0.12 0.00 0.52 0.00 0.00 54.79 52.96 2bns n ASP 119 Cb 0.29 -1.28 -0.11 0.00 -0.72 0.00 0.00 41.12 39.31 2bns n ASP 119 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2bns s LEU 120 N 0.00 2.35 0.48 -2.67 1.43 -1.26 -4.90 118.68 114.11 2bns s LEU 120 Ca 0.59 -0.72 -0.20 0.00 -1.03 0.00 0.00 54.13 52.77 2bns s LEU 120 Cb 0.28 -0.11 -0.09 0.00 0.03 0.00 0.00 46.19 46.31 2bns s LEU 120 CO 0.00 -0.31 1.02 -2.16 0.23 0.00 0.00 176.35 175.13 2bns s PRO 121 N -2.41 3.87 0.26 1.29 0.05 -1.26 -1.40 135.00 135.40 2bns s PRO 121 Ca -0.02 1.30 -0.30 0.00 0.05 0.00 0.00 61.00 62.03 2bns s PRO 121 Cb -0.04 -2.11 -0.10 0.00 0.05 0.00 0.00 34.50 32.30 2bns s PRO 121 CO -0.02 -0.36 1.42 -2.00 0.05 0.00 0.00 177.00 176.09 2bns s GLU 122 N -3.27 4.28 -0.02 4.56 2.12 -1.26 -4.89 118.70 120.22 2bns s GLU 122 Ca 0.66 2.29 -0.01 0.00 0.36 0.00 0.00 54.97 58.26 2bns s GLU 122 Cb -0.15 -3.10 -0.04 0.00 0.26 0.00 0.00 34.13 31.10 2bns s GLU 122 CO 0.19 -0.38 0.10 -0.51 -0.54 0.00 0.00 175.26 174.12 2bns s LEU 123 N -0.64 4.00 0.00 2.70 1.02 -1.26 -1.40 118.68 123.10 2bns s LEU 123 Ca 0.57 0.21 -0.07 0.00 0.02 0.00 0.00 54.13 54.86 2bns s LEU 123 Cb -0.41 -2.28 0.11 0.00 0.02 0.00 0.00 46.19 43.62 2bns s LEU 123 CO 0.45 0.29 0.48 -0.90 0.02 0.00 0.00 176.35 176.69 2bns n ASP 124 N 1.29 -0.75 -0.17 2.29 5.68 -0.26 -4.76 116.55 119.87 2bns n ASP 124 Ca -0.14 -0.96 0.02 0.00 -0.50 0.00 0.00 54.79 53.21 2bns n ASP 124 Cb 0.53 -0.40 0.30 0.00 -1.14 0.00 0.00 41.12 40.40 2bns n ASP 124 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 2bns h GLY 125 N -1.07 0.94 -1.31 6.12 0.00 -2.00 -2.22 103.07 103.53 2bns h GLY 125 Ca -0.17 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.82 2bns h GLY 125 CO 0.11 0.33 0.00 1.42 0.00 0.00 0.00 176.54 178.40 2bns n HIS 126 N -4.44 0.47 -0.97 5.60 8.25 -1.26 -4.94 115.22 117.93 2bns n HIS 126 Ca 0.07 -0.24 0.00 0.00 -0.26 0.00 0.00 57.72 57.30 2bns n HIS 126 Cb 0.06 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.17 2bns n HIS 126 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bns n GLY 127 N 1.08 0.75 3.89 -1.41 0.00 -0.84 -5.05 105.19 103.62 2bns n GLY 127 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 2bns n GLY 127 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2bns s HIS 128 N -2.98 3.59 0.31 1.61 3.76 -1.26 -4.77 115.29 115.54 2bns s HIS 128 Ca 0.00 0.99 -0.29 0.00 -0.15 0.00 0.00 55.06 55.61 2bns s HIS 128 Cb 0.00 -2.47 -0.11 0.00 1.11 0.00 0.00 32.58 31.11 2bns s HIS 128 CO 0.00 -0.44 1.50 -0.80 -0.85 0.00 0.00 174.74 174.14 2bns s ASN 129 N -4.14 6.48 0.10 1.40 0.01 -1.26 -1.10 114.94 116.44 2bns s ASN 129 Ca 0.50 2.87 -0.16 0.00 -0.71 0.00 0.00 52.86 55.37 2bns s ASN 129 Cb -0.11 -2.64 -0.06 0.00 0.41 0.00 0.00 41.25 38.85 2bns s ASN 129 CO 0.48 -0.81 1.49 0.50 -1.51 0.00 0.00 177.10 177.25 2bns h LYS 130 N 4.28 0.65 -5.07 -0.60 3.64 -1.53 -3.43 116.57 114.50 2bns h LYS 130 Ca -0.48 -0.27 -0.66 0.00 -1.27 0.00 0.00 60.65 57.97 2bns h LYS 130 Cb 1.22 -0.03 -0.28 0.00 -0.41 0.00 0.00 32.23 32.74 2bns h LYS 130 CO 0.74 0.85 -0.73 0.42 -2.27 0.00 0.00 179.45 178.45 2bns s ILE 131 N -4.68 3.28 0.05 2.00 1.01 -1.26 -1.01 121.20 120.59 2bns s ILE 131 Ca -0.13 -0.54 0.03 0.00 0.00 0.00 0.00 60.65 60.02 2bns s ILE 131 Cb 0.09 -2.46 -0.03 0.00 0.01 0.00 0.00 42.46 40.07 2bns s ILE 131 CO 0.80 0.45 -0.10 -0.54 0.00 0.00 0.00 174.94 175.55 2bns s LYS 132 N 1.21 0.63 0.60 2.79 1.02 -0.73 -4.57 119.74 120.68 2bns s LYS 132 Ca 0.02 -0.82 -0.19 0.00 0.02 0.00 0.00 55.97 55.01 2bns s LYS 132 Cb -0.14 -0.48 -0.03 0.00 -0.52 0.00 0.00 37.83 36.66 2bns s LYS 132 CO -0.02 0.10 1.22 -1.25 -0.92 0.00 0.00 175.35 174.48 2bns s PRO 133 N -1.62 2.92 0.45 -1.68 0.04 -1.26 -0.66 135.00 133.19 2bns s PRO 133 Ca -0.07 1.87 0.21 0.00 0.04 0.00 0.00 61.00 63.04 2bns s PRO 133 Cb -0.10 -1.93 1.08 0.00 0.04 0.00 0.00 34.50 33.59 2bns s PRO 133 CO 0.01 -1.25 1.94 1.98 0.04 0.00 0.00 177.00 179.72 2bns h MET 134 N 0.86 0.00 0.00 4.56 4.05 -1.18 -0.73 114.93 122.49 2bns h MET 134 Ca -0.51 0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 58.89 2bns h MET 134 Cb 1.30 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 32.10 2bns h MET 134 CO 0.55 0.23 -0.13 0.87 0.23 0.00 0.00 176.91 178.66 2bns h LYS 135 N 0.00 0.00 -0.69 0.39 1.57 -1.91 -2.45 116.57 113.48 2bns h LYS 135 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2bns h LYS 135 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 2bns h LYS 135 CO 0.03 0.13 0.00 0.00 -0.57 0.00 0.00 179.45 179.04 2bns n ALA 136 N -2.29 2.39 -3.88 3.86 0.00 -0.29 -4.84 120.51 115.46 2bns n ALA 136 Ca -0.02 -1.22 -0.30 0.00 0.00 0.00 0.00 53.44 51.90 2bns n ALA 136 Cb 0.25 -0.94 -0.14 0.00 0.00 0.00 0.00 19.45 18.61 2bns n ALA 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bns s ALA 137 N -1.08 2.67 -0.12 0.00 0.00 -0.92 -4.94 121.76 117.37 2bns s ALA 137 Ca 0.47 -2.71 -0.35 0.00 0.00 0.00 0.00 51.96 49.36 2bns s ALA 137 Cb 0.24 -1.97 -0.12 0.00 0.00 0.00 0.00 23.12 21.27 2bns s ALA 137 CO 0.32 -1.91 1.85 0.00 0.00 0.00 0.00 175.76 176.02 2bns n ALA 138 N 3.72 0.70 0.00 0.00 0.00 -1.26 -2.21 120.51 121.46 2bns n ALA 138 Ca 0.05 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.79 2bns n ALA 138 Cb 0.36 -2.45 0.00 0.00 0.00 0.00 0.00 19.45 17.36 2bns n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bns n GLY 139 N 4.35 3.16 3.75 0.00 0.00 -1.26 -5.06 105.19 110.13 2bns n GLY 139 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 2bns n GLY 139 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2bns s PHE 140 N -2.89 3.26 0.22 1.61 0.40 -0.94 -5.01 117.98 114.63 2bns s PHE 140 Ca 0.00 1.36 -0.20 0.00 -0.60 0.00 0.00 56.93 57.49 2bns s PHE 140 Cb 0.00 -3.57 0.03 0.00 0.51 0.00 0.00 43.02 40.00 2bns s PHE 140 CO 0.00 -1.63 0.62 -3.38 0.70 0.00 0.00 175.22 171.52 2bns s HIS 141 N -0.42 -0.23 -0.19 0.36 -3.43 -1.26 -4.98 115.29 105.13 2bns s HIS 141 Ca 0.53 -0.12 -0.29 0.00 -0.80 0.00 0.00 55.06 54.37 2bns s HIS 141 Cb -0.36 0.55 -0.01 0.00 -1.43 0.00 0.00 32.58 31.33 2bns s HIS 141 CO 0.42 -1.03 1.20 0.08 -2.00 0.00 0.00 174.74 173.41 2bns s VAL 142 N -3.87 4.40 -0.12 -5.38 1.01 -1.26 -4.90 120.40 110.28 2bns s VAL 142 Ca 0.08 1.69 0.21 0.00 0.00 0.00 0.00 61.98 63.96 2bns s VAL 142 Cb -0.03 -4.10 -0.21 0.00 0.00 0.00 0.00 36.38 32.05 2bns s VAL 142 CO -0.01 -0.16 0.63 -1.54 0.00 0.00 0.00 175.10 174.02 2bns n SER 143 N 6.55 0.37 -3.80 3.32 3.41 -1.26 -5.03 113.62 117.19 2bns n SER 143 Ca 0.13 0.15 -0.05 0.00 -0.26 0.00 0.00 58.87 58.84 2bns n SER 143 Cb 0.45 1.14 -0.02 0.00 -0.26 0.00 0.00 64.21 65.52 2bns n SER 143 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bns s ALA 144 N -3.23 -1.47 0.20 7.33 0.00 -1.26 -5.15 121.76 118.18 2bns s ALA 144 Ca -0.05 -0.05 0.00 0.00 0.00 0.00 0.00 51.96 51.85 2bns s ALA 144 Cb 0.11 0.73 0.00 0.00 0.00 0.00 0.00 23.12 23.96 2bns s ALA 144 CO 0.85 -1.04 0.00 0.41 0.00 0.00 0.00 175.76 175.98 2bns n GLY 145 N -0.46 -1.65 3.71 0.00 0.00 -1.26 -4.76 105.19 100.76 2bns n GLY 145 Ca -0.05 -1.31 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 2bns n GLY 145 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2bns s LYS 146 N -1.75 4.40 -0.08 1.61 2.47 -1.26 -4.99 119.74 120.13 2bns s LYS 146 Ca 0.00 1.83 -0.30 0.00 -1.56 0.00 0.00 55.97 55.94 2bns s LYS 146 Cb 0.00 -3.36 -0.04 0.00 -1.46 0.00 0.00 37.83 32.97 2bns s LYS 146 CO 0.00 -0.32 1.55 1.21 0.16 0.00 0.00 175.35 177.94 2bns s ASN 147 N 1.15 6.74 0.13 1.43 3.84 -1.26 -4.94 114.94 122.04 2bns s ASN 147 Ca 0.60 2.09 0.25 0.00 0.21 0.00 0.00 52.86 56.00 2bns s ASN 147 Cb -0.31 -2.53 0.46 0.00 -0.55 0.00 0.00 41.25 38.32 2bns s ASN 147 CO 0.29 -0.88 1.43 -0.81 -2.79 0.00 0.00 177.10 174.33 2bns n PRO 148 N 6.98 0.27 -1.86 0.43 -0.04 -1.26 -4.83 135.00 134.69 2bns n PRO 148 Ca 0.16 0.11 -0.42 0.00 -0.04 0.00 0.00 63.50 63.32 2bns n PRO 148 Cb 0.43 -1.70 -0.02 0.00 -0.04 0.00 0.00 33.50 32.16 2bns n PRO 148 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2bns s ILE 149 N -3.15 2.35 0.00 0.52 1.01 -1.26 -1.88 121.20 118.79 2bns s ILE 149 Ca 0.07 0.27 0.00 0.00 0.00 0.00 0.00 60.65 60.99 2bns s ILE 149 Cb 0.13 -3.17 0.00 0.00 0.01 0.00 0.00 42.46 39.43 2bns s ILE 149 CO 0.69 0.03 0.00 0.61 0.00 0.00 0.00 174.94 176.27 2bns n GLY 150 N 3.09 3.14 3.75 6.18 0.00 0.64 -5.00 105.19 117.01 2bns n GLY 150 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 2bns n GLY 150 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bns s LEU 151 N 0.00 3.81 0.60 0.99 1.43 -0.79 -4.71 118.68 120.01 2bns s LEU 151 Ca 0.00 2.53 -0.16 0.00 -1.03 0.00 0.00 54.13 55.47 2bns s LEU 151 Cb 0.00 -4.39 -0.03 0.00 0.03 0.00 0.00 46.19 41.80 2bns s LEU 151 CO 0.00 -1.46 1.07 -2.16 0.23 0.00 0.00 176.35 174.04 2bns s PRO 152 N -3.02 3.22 -0.12 1.29 0.04 -1.26 -1.55 135.00 133.60 2bns s PRO 152 Ca 0.72 1.27 -0.01 0.00 0.04 0.00 0.00 61.00 63.02 2bns s PRO 152 Cb -0.34 -2.02 -0.02 0.00 0.04 0.00 0.00 34.50 32.16 2bns s PRO 152 CO 0.40 -0.90 -0.09 0.08 0.04 0.00 0.00 177.00 176.52 2bns s VAL 153 N -2.39 3.42 -0.05 -0.36 1.01 0.64 -1.15 120.40 121.53 2bns s VAL 153 Ca 0.65 -0.54 0.04 0.00 0.00 0.00 0.00 61.98 62.13 2bns s VAL 153 Cb -0.17 -2.44 -0.00 0.00 0.00 0.00 0.00 36.38 33.76 2bns s VAL 153 CO 0.37 0.53 -0.18 -0.60 0.00 0.00 0.00 175.10 175.22 2bns s ARG 154 N 0.08 1.90 0.77 2.72 3.52 0.63 -0.39 118.95 128.17 2bns s ARG 154 Ca -0.03 -0.64 -0.05 0.00 -0.13 0.00 0.00 55.73 54.88 2bns s ARG 154 Cb -0.14 -1.63 0.16 0.00 -1.56 0.00 0.00 34.95 31.78 2bns s ARG 154 CO 0.04 0.24 1.05 0.41 -0.81 0.00 0.00 175.30 176.23 2bns n GLY 155 N 3.17 0.01 0.26 8.12 0.00 -0.80 -0.80 105.19 115.15 2bns n GLY 155 Ca -0.18 -1.93 0.12 0.00 0.00 0.00 0.00 46.02 44.02 2bns n GLY 155 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bns n ASP 157 N -3.82 0.00 -0.06 0.00 5.75 -1.26 -4.91 116.55 112.24 2bns n ASP 157 Ca -0.02 -0.79 -0.01 0.00 -0.01 0.00 0.00 54.79 53.96 2bns n ASP 157 Cb 0.21 0.00 -0.00 0.00 -1.03 0.00 0.00 41.12 40.29 2bns n ASP 157 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2bns n LEU 158 N -0.99 0.30 -4.93 -2.12 4.77 -0.15 -5.01 117.00 108.88 2bns n LEU 158 Ca 0.18 0.02 -0.27 0.00 -0.03 0.00 0.00 56.01 55.91 2bns n LEU 158 Cb 0.08 -1.31 -0.03 0.00 -2.33 0.00 0.00 43.42 39.83 2bns n LEU 158 CO 0.13 -0.40 -0.12 -1.61 -1.33 0.00 0.00 177.39 174.06 2bns s GLU 159 N -0.98 3.39 0.00 3.23 0.41 -1.26 -4.81 118.70 118.67 2bns s GLU 159 Ca 0.00 -0.59 -0.30 0.00 -0.41 0.00 0.00 54.97 53.67 2bns s GLU 159 Cb 0.00 -2.95 -0.03 0.00 -1.78 0.00 0.00 34.13 29.37 2bns s GLU 159 CO 0.00 0.54 0.98 0.42 -0.49 0.00 0.00 175.26 176.71 2bns s ILE 160 N -1.69 4.86 -0.10 -1.63 1.01 -1.26 -1.91 121.20 120.48 2bns s ILE 160 Ca 0.34 2.05 0.21 0.00 0.00 0.00 0.00 60.65 63.25 2bns s ILE 160 Cb -0.11 -4.32 -0.27 0.00 0.01 0.00 0.00 42.46 37.77 2bns s ILE 160 CO 0.28 0.16 0.46 0.00 0.00 0.00 0.00 174.94 175.84 2bns n ALA 161 N 3.89 2.39 0.00 9.38 0.00 0.47 -4.93 120.51 131.71 2bns n ALA 161 Ca 0.06 -0.70 0.00 0.00 0.00 0.00 0.00 53.44 52.80 2bns n ALA 161 Cb 0.51 -0.66 0.00 0.00 0.00 0.00 0.00 19.45 19.30 2bns n ALA 161 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bns n GLY 162 N 1.39 -1.84 3.35 0.00 0.00 -1.25 -4.12 105.19 102.72 2bns n GLY 162 Ca -0.11 -1.18 -0.29 0.00 0.00 0.00 0.00 46.02 44.44 2bns n GLY 162 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bns s LYS 163 N -1.71 1.54 -0.08 1.61 -2.85 -0.89 -0.26 119.74 117.09 2bns s LYS 163 Ca 0.00 -1.19 -0.30 0.00 -1.00 0.00 0.00 55.97 53.49 2bns s LYS 163 Cb 0.00 -1.84 -0.04 0.00 -2.06 0.00 0.00 37.83 33.89 2bns s LYS 163 CO 0.00 0.46 1.48 0.08 0.10 0.00 0.00 175.35 177.46 2bns s VAL 164 N -0.94 3.83 -0.05 1.79 1.01 -0.60 -0.97 120.40 124.48 2bns s VAL 164 Ca 0.12 1.05 0.19 0.00 0.00 0.00 0.00 61.98 63.34 2bns s VAL 164 Cb -0.10 -3.68 -0.29 0.00 0.00 0.00 0.00 36.38 32.31 2bns s VAL 164 CO 0.04 -0.08 0.37 1.33 0.00 0.00 0.00 175.10 176.76 2bns n VAL 165 N 5.29 0.19 -3.90 2.92 0.24 -0.68 -0.26 118.33 122.14 2bns n VAL 165 Ca 0.15 -0.49 -0.09 0.00 -2.04 0.00 0.00 64.34 61.87 2bns n VAL 165 Cb 0.44 -0.03 -0.01 0.00 -1.47 0.00 0.00 33.84 32.76 2bns n VAL 165 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2bns s ASP 166 N -4.38 -0.01 -0.08 -1.34 -1.08 -1.23 -4.86 116.67 103.68 2bns s ASP 166 Ca -0.07 -0.94 0.05 0.00 -0.52 0.00 0.00 52.55 51.06 2bns s ASP 166 Cb 0.11 0.73 -0.00 0.00 -1.46 0.00 0.00 42.92 42.30 2bns s ASP 166 CO 0.79 -1.41 -0.24 -0.63 0.52 0.00 0.00 175.17 174.20 2bns s ILE 167 N -3.32 2.04 -0.23 4.11 1.01 -1.26 -2.39 121.20 121.16 2bns s ILE 167 Ca 0.17 -1.03 -0.17 0.00 0.00 0.00 0.00 60.65 59.61 2bns s ILE 167 Cb -0.04 -1.75 -0.03 0.00 0.01 0.00 0.00 42.46 40.65 2bns s ILE 167 CO 0.10 0.56 0.46 0.26 0.00 0.00 0.00 174.94 176.33 2bns s TRP 168 N 0.11 3.32 -0.08 3.97 0.52 -0.18 -0.55 118.94 126.04 2bns s TRP 168 Ca -0.12 0.63 0.02 0.00 0.02 0.00 0.00 56.10 56.66 2bns s TRP 168 Cb -0.16 -2.64 -0.02 0.00 -1.15 0.00 0.00 33.47 29.51 2bns s TRP 168 CO 0.06 -0.16 -0.15 0.14 0.02 0.00 0.00 176.95 176.86 2bns s VAL 169 N 1.85 2.92 -0.58 4.03 -7.23 0.17 -0.94 120.40 120.61 2bns s VAL 169 Ca 0.20 -0.74 -0.26 0.00 -1.81 0.00 0.00 61.98 59.37 2bns s VAL 169 Cb -0.15 -2.17 -0.04 0.00 0.56 0.00 0.00 36.38 34.58 2bns s VAL 169 CO 0.09 0.56 2.02 -0.62 -0.31 0.00 0.00 175.10 176.85 2bns s ASP 170 N -0.23 5.01 0.07 4.85 -1.08 -0.48 -1.78 116.67 123.04 2bns s ASP 170 Ca 0.01 0.53 -0.29 0.00 -0.52 0.00 0.00 52.55 52.28 2bns s ASP 170 Cb -0.13 -2.52 -0.17 0.00 -1.46 0.00 0.00 42.92 38.63 2bns s ASP 170 CO 0.03 -2.54 1.62 0.40 0.52 0.00 0.00 175.17 175.19 2bns h ILE 171 N 7.13 0.60 -0.31 4.11 2.04 -1.38 0.15 117.51 129.86 2bns h ILE 171 Ca -0.25 -0.08 0.08 0.00 1.00 0.00 0.00 64.86 65.62 2bns h ILE 171 Cb 1.19 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 2bns h ILE 171 CO 1.20 0.02 0.22 -0.65 0.00 0.00 0.00 178.15 178.94 2bns h PRO 172 N -0.59 0.06 -0.01 2.37 0.11 -1.92 -2.63 132.00 129.40 2bns h PRO 172 Ca -0.06 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2bns h PRO 172 Cb 0.44 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.54 2bns h PRO 172 CO 0.09 0.04 -0.55 0.39 -0.21 0.00 0.00 178.00 177.77 2bns n GLU 173 N -4.46 1.40 -3.83 1.05 -0.58 -1.12 -5.01 120.64 108.08 2bns n GLU 173 Ca 0.04 -0.57 -0.23 0.00 -0.42 0.00 0.00 57.16 55.97 2bns n GLU 173 Cb 0.35 -1.35 0.00 0.00 -0.57 0.00 0.00 31.44 29.88 2bns n GLU 173 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 2bns n GLN 174 N -0.55 -3.99 -4.30 3.49 6.02 0.53 -5.00 117.38 113.57 2bns n GLN 174 Ca 0.06 0.50 -0.20 0.00 -0.01 0.00 0.00 57.00 57.35 2bns n GLN 174 Cb 0.35 -4.82 -0.13 0.00 1.02 0.00 0.00 30.24 26.66 2bns n GLN 174 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2bns s MET 175 N -6.28 0.93 -0.04 -1.09 0.23 -1.15 -5.00 119.30 106.90 2bns s MET 175 Ca 0.01 -0.86 -0.30 0.00 -1.03 0.00 0.00 55.69 53.51 2bns s MET 175 Cb -0.00 -0.96 -0.04 0.00 -1.53 0.00 0.00 34.83 32.30 2bns s MET 175 CO 0.85 0.23 1.20 0.00 -2.03 0.00 0.00 175.02 175.28 2bns s ALA 176 N -1.01 3.48 -0.16 3.16 0.00 -1.26 -1.38 121.76 124.60 2bns s ALA 176 Ca 0.01 0.65 0.05 0.00 0.00 0.00 0.00 51.96 52.66 2bns s ALA 176 Cb -0.09 -3.51 -0.13 0.00 0.00 0.00 0.00 23.12 19.40 2bns s ALA 176 CO 0.02 -0.73 -0.09 0.54 0.00 0.00 0.00 175.76 175.50 2bns n ARG 177 N 5.07 0.85 -4.07 0.00 1.74 -0.12 -4.78 116.66 115.36 2bns n ARG 177 Ca 0.11 0.07 -0.09 0.00 -0.77 0.00 0.00 57.85 57.16 2bns n ARG 177 Cb 0.46 -1.34 -0.10 0.00 -1.02 0.00 0.00 32.46 30.45 2bns n ARG 177 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2bns s PHE 178 N -2.34 0.55 -0.18 -1.55 0.08 -1.04 -0.41 117.98 113.11 2bns s PHE 178 Ca -0.18 -0.82 -0.05 0.00 0.12 0.00 0.00 56.93 56.01 2bns s PHE 178 Cb 0.05 -0.37 -0.03 0.00 -0.57 0.00 0.00 43.02 42.11 2bns s PHE 178 CO 0.44 -0.24 -0.01 -0.51 -0.10 0.00 0.00 175.22 174.80 2bns s LEU 179 N -2.38 3.32 0.00 -0.37 1.43 -0.17 -1.01 118.68 119.51 2bns s LEU 179 Ca -0.00 -0.13 -0.26 0.00 -1.03 0.00 0.00 54.13 52.71 2bns s LEU 179 Cb 0.00 -1.82 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 2bns s LEU 179 CO -0.05 0.13 0.80 -0.70 0.23 0.00 0.00 176.35 176.76 2bns s GLU 180 N 0.59 4.50 -0.10 1.70 2.12 -1.01 -0.79 118.70 125.72 2bns s GLU 180 Ca -0.01 1.09 0.00 0.00 0.36 0.00 0.00 54.97 56.41 2bns s GLU 180 Cb -0.14 -3.41 0.02 0.00 0.26 0.00 0.00 34.13 30.86 2bns s GLU 180 CO 0.02 0.15 -0.08 0.08 -0.54 0.00 0.00 175.26 174.88 2bns s VAL 181 N 0.42 1.04 -0.12 3.70 1.01 0.14 -1.69 120.40 124.89 2bns s VAL 181 Ca 0.41 -0.32 -0.24 0.00 0.00 0.00 0.00 61.98 61.83 2bns s VAL 181 Cb -0.20 -1.03 -0.03 0.00 0.00 0.00 0.00 36.38 35.12 2bns s VAL 181 CO 0.23 0.36 0.75 -0.70 0.00 0.00 0.00 175.10 175.74 2bns s GLU 182 N 1.49 4.35 0.68 2.72 2.12 -0.14 -0.87 118.70 129.06 2bns s GLU 182 Ca 0.01 0.91 -0.06 0.00 0.36 0.00 0.00 54.97 56.19 2bns s GLU 182 Cb -0.13 -3.52 0.06 0.00 0.26 0.00 0.00 34.13 30.80 2bns s GLU 182 CO -0.06 -0.13 0.98 -0.51 -0.54 0.00 0.00 175.26 175.00 2bns s LEU 183 N 1.49 2.88 0.48 2.70 1.43 -0.71 -2.09 118.68 124.86 2bns s LEU 183 Ca 0.37 0.43 0.20 0.00 -1.03 0.00 0.00 54.13 54.10 2bns s LEU 183 Cb -0.17 -3.11 1.23 0.00 0.03 0.00 0.00 46.19 44.17 2bns s LEU 183 CO 0.15 -1.52 1.98 0.11 0.23 0.00 0.00 176.35 177.30 2bns h LYS 184 N -0.51 0.18 0.00 1.70 6.56 -1.90 -1.89 116.57 120.71 2bns h LYS 184 Ca -0.44 -0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.14 2bns h LYS 184 Cb 1.31 -0.04 0.00 0.00 -0.57 0.00 0.00 32.23 32.93 2bns h LYS 184 CO 0.60 0.12 -0.02 -0.40 -2.06 0.00 0.00 179.45 177.69 2bns n ASP 185 N -4.43 0.25 0.00 0.86 5.75 -1.26 -4.94 116.55 112.78 2bns n ASP 185 Ca 0.10 0.50 0.00 0.00 -0.01 0.00 0.00 54.79 55.38 2bns n ASP 185 Cb 0.52 -0.56 0.00 0.00 -1.03 0.00 0.00 41.12 40.06 2bns n ASP 185 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2bns n GLY 186 N 1.44 1.93 3.49 6.12 0.00 -0.71 -5.08 105.19 112.38 2bns n GLY 186 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 2bns n GLY 186 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bns s SER 187 N -0.23 0.58 0.19 1.61 1.04 -1.26 -4.74 113.70 110.89 2bns s SER 187 Ca 0.00 1.03 0.04 0.00 0.48 0.00 0.00 55.95 57.51 2bns s SER 187 Cb 0.00 -1.55 -0.05 0.00 0.10 0.00 0.00 66.02 64.53 2bns s SER 187 CO 0.00 -4.38 -0.06 0.42 0.98 0.00 0.00 173.24 170.20 2bns s THR 188 N -2.62 1.17 0.12 2.02 -4.23 -1.26 -1.73 115.64 109.10 2bns s THR 188 Ca 0.69 -2.06 0.01 0.00 -1.18 0.00 0.00 61.69 59.14 2bns s THR 188 Cb -0.17 -2.11 -0.04 0.00 1.34 0.00 0.00 72.50 71.52 2bns s THR 188 CO 0.59 -0.53 -0.02 -0.13 -0.54 0.00 0.00 174.62 173.99 2bns s ARG 189 N -3.79 0.89 -0.16 3.99 1.81 -0.05 -4.88 118.95 116.76 2bns s ARG 189 Ca 0.23 -1.39 -0.08 0.00 -1.72 0.00 0.00 55.73 52.77 2bns s ARG 189 Cb 0.04 -0.09 -0.04 0.00 -0.45 0.00 0.00 34.95 34.41 2bns s ARG 189 CO 0.05 -0.10 0.13 -0.51 -0.68 0.00 0.00 175.30 174.18 2bns s LEU 190 N -3.06 4.25 -0.17 2.53 1.43 -1.26 0.26 118.68 122.66 2bns s LEU 190 Ca 0.16 0.33 -0.00 0.00 -1.03 0.00 0.00 54.13 53.59 2bns s LEU 190 Cb 0.06 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 44.22 2bns s LEU 190 CO -0.02 0.29 -0.14 -0.76 0.23 0.00 0.00 176.35 175.95 2bns s LEU 191 N -0.32 2.49 0.40 1.79 2.01 0.03 -4.95 118.68 120.13 2bns s LEU 191 Ca 0.11 -0.48 -0.26 0.00 0.01 0.00 0.00 54.13 53.50 2bns s LEU 191 Cb -0.12 -1.58 -0.10 0.00 0.01 0.00 0.00 46.19 44.41 2bns s LEU 191 CO 0.01 0.06 1.34 -2.65 1.01 0.00 0.00 176.35 176.12 2bns n PRO 192 N 4.24 2.16 0.04 1.29 -0.02 -1.26 -1.00 135.00 140.45 2bns n PRO 192 Ca -0.19 0.76 -0.00 0.00 -2.02 0.00 0.00 63.50 62.05 2bns n PRO 192 Cb 0.51 -2.47 0.30 0.00 -0.02 0.00 0.00 33.50 31.83 2bns n PRO 192 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 2bns h MET 193 N 2.36 0.42 -0.05 -0.52 2.86 -1.03 -2.47 114.93 116.50 2bns h MET 193 Ca -0.49 -0.11 0.00 0.00 -2.06 0.00 0.00 59.70 57.05 2bns h MET 193 Cb 1.28 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.89 2bns h MET 193 CO 0.61 0.54 0.00 0.00 1.06 0.00 0.00 176.91 179.12 2bns n GLN 194 N -4.23 1.23 -0.17 1.72 0.00 -1.26 -2.62 117.38 112.04 2bns n GLN 194 Ca 0.00 -0.34 0.05 0.00 0.00 0.00 0.00 57.00 56.72 2bns n GLN 194 Cb 0.30 -1.33 0.14 0.00 0.00 0.00 0.00 30.24 29.35 2bns n GLN 194 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 2bns n MET 195 N -0.45 2.88 -4.46 2.61 2.81 -0.93 -5.00 117.12 114.58 2bns n MET 195 Ca 0.15 -2.04 -0.27 0.00 -1.81 0.00 0.00 57.70 53.73 2bns n MET 195 Cb 0.15 -1.28 -0.13 0.00 -0.71 0.00 0.00 33.22 31.25 2bns n MET 195 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2bns s VAL 196 N -1.14 1.96 -0.32 2.03 -7.23 -1.08 -4.53 120.40 110.10 2bns s VAL 196 Ca 0.22 -1.55 -0.05 0.00 -1.81 0.00 0.00 61.98 58.79 2bns s VAL 196 Cb 0.12 -1.74 0.04 0.00 0.56 0.00 0.00 36.38 35.37 2bns s VAL 196 CO 0.13 0.09 0.06 -0.75 -0.31 0.00 0.00 175.10 174.33 2bns s LYS 197 N -1.77 2.54 -0.08 4.82 2.47 -0.67 -5.00 119.74 122.05 2bns s LYS 197 Ca 0.10 -1.21 -0.30 0.00 -1.56 0.00 0.00 55.97 53.00 2bns s LYS 197 Cb -0.10 -3.35 -0.03 0.00 -1.46 0.00 0.00 37.83 32.90 2bns s LYS 197 CO 0.04 -0.65 1.17 0.08 0.16 0.00 0.00 175.35 176.15 2bns s VAL 198 N 1.34 4.37 0.52 4.02 1.01 -1.26 -1.54 120.40 128.86 2bns s VAL 198 Ca -0.03 1.68 0.01 0.00 0.00 0.00 0.00 61.98 63.64 2bns s VAL 198 Cb -0.20 -4.08 0.01 0.00 0.00 0.00 0.00 36.38 32.12 2bns s VAL 198 CO 0.01 -0.02 0.09 0.00 0.00 0.00 0.00 175.10 175.18 2bns n GLN 199 N 5.36 0.74 0.12 2.72 6.02 -0.26 -5.00 117.38 127.08 2bns n GLN 199 Ca 0.11 -3.68 -0.02 0.00 -0.01 0.00 0.00 57.00 53.40 2bns n GLN 199 Cb 0.46 0.86 0.20 0.00 1.02 0.00 0.00 30.24 32.79 2bns n GLN 199 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2bns h SER 200 N 1.11 0.12 -0.00 1.08 4.64 -2.00 -3.32 113.55 115.18 2bns h SER 200 Ca -0.41 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2bns h SER 200 Cb 1.29 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2bns h SER 200 CO 0.67 0.63 -0.00 -0.46 -0.87 0.00 0.00 176.83 176.80 2bns n ASN 201 N -3.92 1.00 -3.66 4.97 6.94 -1.26 -5.09 115.26 114.24 2bns n ASN 201 Ca -0.02 -1.00 -0.04 0.00 -0.02 0.00 0.00 54.58 53.50 2bns n ASN 201 Cb 0.55 0.01 -0.01 0.00 -2.36 0.00 0.00 39.78 37.97 2bns n ASN 201 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2bns s ARG 202 N -0.03 0.93 -0.20 -3.83 3.03 -1.25 -4.57 118.95 113.04 2bns s ARG 202 Ca 0.00 -0.47 -0.02 0.00 2.03 0.00 0.00 55.73 57.26 2bns s ARG 202 Cb 0.00 0.34 -0.00 0.00 -1.03 0.00 0.00 34.95 34.26 2bns s ARG 202 CO 0.00 -0.42 -0.09 0.08 -1.13 0.00 0.00 175.30 173.74 2bns s VAL 203 N -3.06 3.04 0.06 4.99 1.01 -0.30 -1.10 120.40 125.04 2bns s VAL 203 Ca 0.11 -0.61 -0.08 0.00 0.00 0.00 0.00 61.98 61.39 2bns s VAL 203 Cb -0.00 -2.35 -0.05 0.00 0.00 0.00 0.00 36.38 33.97 2bns s VAL 203 CO -0.02 0.46 0.35 -2.28 0.00 0.00 0.00 175.10 173.61 2bns s HIS 204 N 1.32 3.57 -0.36 5.22 2.46 -0.59 -0.27 115.29 126.63 2bns s HIS 204 Ca 0.04 0.68 0.00 0.00 0.47 0.00 0.00 55.06 56.26 2bns s HIS 204 Cb -0.14 -2.08 0.14 0.00 -0.13 0.00 0.00 32.58 30.37 2bns s HIS 204 CO -0.05 0.54 0.21 0.08 -2.47 0.00 0.00 174.74 173.06 2bns s VAL 205 N -1.39 0.34 0.57 0.89 1.01 0.02 -1.67 120.40 120.17 2bns s VAL 205 Ca 0.32 -1.83 0.27 0.00 0.00 0.00 0.00 61.98 60.74 2bns s VAL 205 Cb -0.13 -1.26 0.37 0.00 0.00 0.00 0.00 36.38 35.36 2bns s VAL 205 CO 0.18 -0.97 2.04 -1.13 0.00 0.00 0.00 175.10 175.22 2bns h ASN 206 N 6.99 0.00 0.81 3.32 -0.00 -1.84 -2.70 115.58 122.16 2bns h ASN 206 Ca 0.04 0.00 -0.14 0.00 -0.00 0.00 0.00 56.30 56.21 2bns h ASN 206 Cb 0.96 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 39.26 2bns h ASN 206 CO 0.30 0.00 -0.65 0.00 -0.00 0.00 0.00 177.43 177.08 2bns h ALA 207 N 1.72 0.82 -3.97 1.57 0.00 -1.88 -3.40 119.26 114.11 2bns h ALA 207 Ca 0.15 -0.59 -0.42 0.00 0.00 0.00 0.00 54.91 54.05 2bns h ALA 207 Cb 0.72 -0.10 -0.28 0.00 0.00 0.00 0.00 17.79 18.13 2bns h ALA 207 CO -0.00 0.81 -0.79 -0.51 0.00 0.00 0.00 179.25 178.76 2bns s LEU 208 N -7.23 2.07 0.64 0.00 1.02 -1.19 -3.52 118.68 110.47 2bns s LEU 208 Ca -0.00 -0.27 -0.12 0.00 0.02 0.00 0.00 54.13 53.75 2bns s LEU 208 Cb 0.11 -0.55 -0.02 0.00 0.02 0.00 0.00 46.19 45.76 2bns s LEU 208 CO 0.76 0.09 1.05 -0.94 0.02 0.00 0.00 176.35 177.33 2bns s SER 209 N -0.52 5.76 0.26 2.29 1.04 -1.26 -1.20 113.70 120.06 2bns s SER 209 Ca 0.03 1.61 -0.02 0.00 0.48 0.00 0.00 55.95 58.05 2bns s SER 209 Cb -0.05 -2.50 0.52 0.00 0.10 0.00 0.00 66.02 64.09 2bns s SER 209 CO 0.00 -1.19 1.72 0.77 0.98 0.00 0.00 173.24 175.52 2bns h SER 210 N -0.24 0.29 0.15 7.02 4.64 -1.89 -1.13 113.55 122.38 2bns h SER 210 Ca -0.45 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 60.99 2bns h SER 210 Cb 1.21 0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 2bns h SER 210 CO 0.58 0.08 0.00 -0.90 -0.87 0.00 0.00 176.83 175.73 2bns n ASP 211 N -5.01 0.00 -0.64 4.97 5.75 -1.26 -2.96 116.55 117.39 2bns n ASP 211 Ca 0.16 -0.37 0.09 0.00 -0.01 0.00 0.00 54.79 54.66 2bns n ASP 211 Cb 0.47 -0.12 0.05 0.00 -1.03 0.00 0.00 41.12 40.50 2bns n ASP 211 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2bns n LEU 212 N -1.12 2.31 0.20 -2.12 4.77 -0.43 -4.43 117.00 116.18 2bns n LEU 212 Ca 0.13 -0.93 0.03 0.00 -0.03 0.00 0.00 56.01 55.21 2bns n LEU 212 Cb 0.10 0.00 0.40 0.00 -2.33 0.00 0.00 43.42 41.60 2bns n LEU 212 CO 0.13 0.41 0.78 -0.26 -1.33 0.00 0.00 177.39 177.12 2bns h PHE 213 N 3.16 0.00 0.00 -1.77 -1.00 -1.60 -2.93 116.94 112.80 2bns h PHE 213 Ca 0.00 0.00 -0.09 0.00 2.81 0.00 0.00 57.97 60.69 2bns h PHE 213 Cb 0.72 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.27 2bns h PHE 213 CO 0.00 0.31 -0.41 0.00 -1.61 0.00 0.00 178.31 176.60 2bns h ALA 214 N 1.69 0.93 0.00 2.45 0.00 -1.81 -2.69 119.26 119.82 2bns h ALA 214 Ca -0.00 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2bns h ALA 214 Cb 0.56 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2bns h ALA 214 CO 0.04 0.51 0.00 0.41 0.00 0.00 0.00 179.25 180.21 2bns n GLY 215 N 0.41 -1.38 3.68 0.00 0.00 -1.11 -4.72 105.19 102.07 2bns n GLY 215 Ca 0.00 -0.03 -0.48 0.00 0.00 0.00 0.00 46.02 45.52 2bns n GLY 215 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2bns n ILE 216 N -1.85 0.36 -1.65 -0.61 5.41 -1.02 -4.90 119.36 115.10 2bns n ILE 216 Ca 0.05 -0.06 -0.43 0.00 1.00 0.00 0.00 62.75 63.31 2bns n ILE 216 Cb 0.30 -1.73 -0.00 0.00 -0.71 0.00 0.00 39.64 37.49 2bns n ILE 216 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2bns n PRO 217 N 5.39 1.71 -3.76 0.38 -0.02 -1.26 -4.98 135.00 132.45 2bns n PRO 217 Ca 0.21 0.60 -0.29 0.00 -2.02 0.00 0.00 63.50 62.00 2bns n PRO 217 Cb 0.29 -2.12 -0.04 0.00 -0.02 0.00 0.00 33.50 31.61 2bns n PRO 217 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2bns s THR 218 N -1.13 5.25 0.00 3.45 -4.23 -1.26 -4.80 115.64 112.91 2bns s THR 218 Ca 0.58 -0.31 -0.11 0.00 -1.18 0.00 0.00 61.69 60.68 2bns s THR 218 Cb -0.60 -3.69 -0.05 0.00 1.34 0.00 0.00 72.50 69.50 2bns s THR 218 CO 0.60 -0.05 0.34 0.27 -0.54 0.00 0.00 174.62 175.24 2bns s ILE 219 N -1.73 5.18 0.04 2.99 -4.36 -1.26 -5.02 121.20 117.03 2bns s ILE 219 Ca 0.38 0.51 -0.29 0.00 -0.26 0.00 0.00 60.65 60.99 2bns s ILE 219 Cb -0.12 -3.61 -0.17 0.00 1.25 0.00 0.00 42.46 39.81 2bns s ILE 219 CO 0.28 0.47 1.41 0.11 0.24 0.00 0.00 174.94 177.45 2bns h LYS 220 N 4.36 -0.70 -6.20 0.37 1.57 -1.99 -3.43 116.57 110.56 2bns h LYS 220 Ca -0.51 0.05 -0.58 0.00 -1.87 0.00 0.00 60.65 57.74 2bns h LYS 220 Cb 1.21 0.16 -0.04 0.00 0.08 0.00 0.00 32.23 33.64 2bns h LYS 220 CO 0.63 -0.40 -0.13 0.45 -0.57 0.00 0.00 179.45 179.43 2bns s SER 221 N -4.66 6.84 0.00 0.86 0.15 -1.26 -5.00 113.70 110.63 2bns s SER 221 Ca -0.16 1.05 0.28 0.00 0.70 0.00 0.00 55.95 57.82 2bns s SER 221 Cb 0.03 -2.28 1.15 0.00 -1.71 0.00 0.00 66.02 63.21 2bns s SER 221 CO 0.56 0.20 1.85 -0.81 1.20 0.00 0.00 173.24 176.24 2bns n PRO 222 N 1.26 0.18 -0.01 5.44 -0.04 -1.26 -3.90 135.00 136.66 2bns n PRO 222 Ca -0.09 -0.04 0.04 0.00 -0.04 0.00 0.00 63.50 63.37 2bns n PRO 222 Cb 0.52 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.52 2bns n PRO 222 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2bns n THR 223 N -1.38 0.04 -4.00 0.52 -2.24 -1.26 -4.93 114.28 101.03 2bns n THR 223 Ca 0.09 -0.52 -0.10 0.00 -2.27 0.00 0.00 64.05 61.25 2bns n THR 223 Cb 0.31 1.14 -0.08 0.00 -2.10 0.00 0.00 70.33 69.61 2bns n THR 223 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2bns s GLU 224 N -0.69 1.10 -0.02 -0.78 -1.05 -1.25 -4.41 118.70 111.59 2bns s GLU 224 Ca 0.10 -1.23 -0.01 0.00 -0.15 0.00 0.00 54.97 53.68 2bns s GLU 224 Cb 0.07 0.35 0.02 0.00 -0.44 0.00 0.00 34.13 34.12 2bns s GLU 224 CO 0.10 -0.38 0.05 0.54 0.95 0.00 0.00 175.26 176.52 2bns s VAL 225 N -3.98 -0.03 0.66 1.83 0.11 -1.26 -4.49 120.40 113.23 2bns s VAL 225 Ca 0.19 0.12 -0.08 0.00 -2.93 0.00 0.00 61.98 59.28 2bns s VAL 225 Cb 0.04 -0.10 0.03 0.00 -1.53 0.00 0.00 36.38 34.83 2bns s VAL 225 CO 0.00 0.05 0.99 0.42 -3.33 0.00 0.00 175.10 173.23 2bns s THR 226 N 0.64 3.13 0.12 5.04 -4.23 -1.26 -4.24 115.64 114.84 2bns s THR 226 Ca -0.05 0.03 -0.15 0.00 -1.18 0.00 0.00 61.69 60.34 2bns s THR 226 Cb -0.07 -3.30 -0.03 0.00 1.34 0.00 0.00 72.50 70.43 2bns s THR 226 CO -0.02 -0.34 1.54 -0.07 -0.54 0.00 0.00 174.62 175.18 2bns h LEU 227 N -0.45 0.70 -0.57 4.79 3.38 -1.23 -0.94 115.31 120.99 2bns h LEU 227 Ca -0.45 -0.34 0.10 0.00 0.09 0.00 0.00 57.88 57.28 2bns h LEU 227 Cb 1.28 -0.19 -0.08 0.00 0.09 0.00 0.00 40.66 41.76 2bns h LEU 227 CO 0.62 0.88 0.15 0.25 0.09 0.00 0.00 178.44 180.42 2bns h LEU 228 N 0.51 0.06 -0.45 1.67 5.85 -1.57 -1.37 115.31 120.00 2bns h LEU 228 Ca 0.10 0.10 -0.06 0.00 0.84 0.00 0.00 57.88 58.86 2bns h LEU 228 Cb 0.55 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 2bns h LEU 228 CO 0.03 0.05 0.05 -0.33 -0.34 0.00 0.00 178.44 177.90 2bns h GLU 229 N 0.29 0.77 -0.68 1.25 5.08 -1.80 -2.45 114.58 117.04 2bns h GLU 229 Ca 0.29 -0.22 0.06 0.00 -1.00 0.00 0.00 59.36 58.49 2bns h GLU 229 Cb 0.41 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.52 2bns h GLU 229 CO -0.35 0.80 0.39 0.93 -1.00 0.00 0.00 179.01 179.77 2bns h GLU 230 N 0.62 0.70 -0.26 2.33 5.08 -0.72 0.51 114.58 122.84 2bns h GLU 230 Ca 0.13 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 2bns h GLU 230 Cb 0.42 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 2bns h GLU 230 CO 0.01 0.46 0.10 0.22 -1.00 0.00 0.00 179.01 178.81 2bns h ASP 231 N 0.72 0.36 -0.84 1.42 3.58 -1.07 -0.33 116.42 120.27 2bns h ASP 231 Ca 0.30 -0.17 0.04 0.00 0.42 0.00 0.00 57.03 57.62 2bns h ASP 231 Cb 0.16 -0.09 -0.05 0.00 1.72 0.00 0.00 39.33 41.07 2bns h ASP 231 CO -0.17 0.43 0.53 0.11 -2.88 0.00 0.00 179.24 177.27 2bns h LYS 232 N 0.27 1.00 -0.00 0.28 1.57 -1.13 0.15 116.57 118.70 2bns h LYS 232 Ca 0.09 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2bns h LYS 232 Cb 0.19 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.27 2bns h LYS 232 CO -0.01 0.66 -0.00 0.82 -0.57 0.00 0.00 179.45 180.35 2bns h ILE 233 N 1.03 1.32 -0.27 1.86 2.04 -0.61 -1.07 117.51 121.81 2bns h ILE 233 Ca 0.34 -0.94 -0.14 0.00 1.00 0.00 0.00 64.86 65.12 2bns h ILE 233 Cb 0.03 1.95 -0.01 0.00 -0.74 0.00 0.00 36.82 38.05 2bns h ILE 233 CO -0.12 0.24 -0.40 0.00 0.00 0.00 0.00 178.15 177.88 2bns h GLY 235 N 1.01 -0.28 0.74 0.00 0.00 -0.75 -1.28 103.07 102.50 2bns h GLY 235 Ca 0.05 0.10 0.04 0.00 0.00 0.00 0.00 47.33 47.52 2bns h GLY 235 CO 0.08 -0.10 0.22 -1.82 0.00 0.00 0.00 176.54 174.92 2bns h TYR 236 N -0.38 0.40 -0.25 5.60 5.03 -1.13 -0.79 116.97 125.45 2bns h TYR 236 Ca -0.03 0.02 -0.09 0.00 2.58 0.00 0.00 58.73 61.22 2bns h TYR 236 Cb 0.29 -0.11 -0.01 0.00 1.55 0.00 0.00 36.73 38.46 2bns h TYR 236 CO -0.03 0.19 -0.18 0.28 -1.32 0.00 0.00 178.16 177.10 2bns h VAL 237 N 0.44 1.31 -0.72 1.81 2.07 -1.37 -2.57 116.25 117.22 2bns h VAL 237 Ca 0.20 -1.31 -0.04 0.00 0.82 0.00 0.00 66.70 66.37 2bns h VAL 237 Cb 0.12 1.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.48 2bns h VAL 237 CO -0.15 0.41 0.29 0.00 0.02 0.00 0.00 177.57 178.14 2bns h ALA 238 N 0.70 1.16 -0.18 1.67 0.00 -1.12 -2.90 119.26 118.58 2bns h ALA 238 Ca 0.05 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.83 2bns h ALA 238 Cb 0.72 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2bns h ALA 238 CO 0.05 0.61 0.25 0.78 0.00 0.00 0.00 179.25 180.94 2bns h GLY 239 N 1.09 0.00 2.00 0.00 0.00 -0.73 -1.87 103.07 103.57 2bns h GLY 239 Ca 0.24 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.51 2bns h GLY 239 CO -0.02 0.00 -0.28 -1.33 0.00 0.00 0.00 176.54 174.91 2bns h GLY 240 N 0.00 0.00 0.40 4.60 0.00 -1.35 -1.23 103.07 105.49 2bns h GLY 240 Ca 0.09 0.00 0.16 0.00 0.00 0.00 0.00 47.33 47.58 2bns h GLY 240 CO -0.00 0.00 0.59 1.41 0.00 0.00 0.00 176.54 178.54 2bns h LEU 241 N 0.00 0.68 0.08 3.11 3.38 -1.37 -0.76 115.31 120.43 2bns h LEU 241 Ca -0.00 0.05 -0.37 0.00 0.09 0.00 0.00 57.88 57.65 2bns h LEU 241 Cb 0.63 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 2bns h LEU 241 CO 0.04 0.32 -2.10 0.80 0.09 0.00 0.00 178.44 177.58 2bns n MET 242 N -4.60 0.72 -0.00 1.13 1.56 -1.10 -4.27 117.12 110.55 2bns n MET 242 Ca 0.19 0.25 0.10 0.00 -0.27 0.00 0.00 57.70 57.97 2bns n MET 242 Cb 0.51 -1.65 -0.12 0.00 2.15 0.00 0.00 33.22 34.10 2bns n MET 242 CO 0.00 0.00 0.00 0.66 -0.73 0.00 0.00 175.97 175.90 2bns n TYR 243 N -3.50 0.00 0.31 1.12 4.01 -0.48 -3.78 117.16 114.84 2bns n TYR 243 Ca -0.36 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.45 2bns n TYR 243 Cb 1.01 -0.05 0.12 0.00 -0.31 0.00 0.00 39.34 40.11 2bns n TYR 243 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2bns n ALA 244 N -1.56 2.39 -0.16 -0.72 0.00 -0.30 -4.81 120.51 115.35 2bns n ALA 244 Ca 0.03 -0.83 -0.09 0.00 0.00 0.00 0.00 53.44 52.55 2bns n ALA 244 Cb 0.35 -0.54 -0.00 0.00 0.00 0.00 0.00 19.45 19.25 2bns n ALA 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bns h ALA 245 N 2.89 0.60 -0.72 0.00 0.00 -1.64 -3.02 119.26 117.38 2bns h ALA 245 Ca 0.00 -0.23 0.13 0.00 0.00 0.00 0.00 54.91 54.81 2bns h ALA 245 Cb 0.70 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.27 2bns h ALA 245 CO 0.00 0.33 0.48 -1.35 0.00 0.00 0.00 179.25 178.71 2bns h PRO 246 N 0.62 0.44 0.00 0.00 0.11 -1.87 -3.52 132.00 127.78 2bns h PRO 246 Ca 0.14 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.22 2bns h PRO 246 Cb 0.39 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.40 2bns h PRO 246 CO 0.01 0.29 0.00 1.63 -0.21 0.00 0.00 178.00 179.72