#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nut h TYR 4 N 0.00 0.00 -0.04 -1.42 0.99 -1.99 -1.21 116.97 113.30 2nut h TYR 4 Ca 0.00 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 2nut h TYR 4 Cb 0.00 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 37.73 2nut h TYR 4 CO 0.00 0.16 -0.06 -0.07 -0.00 0.00 0.00 178.16 178.19 2nut h LEU 5 N 0.00 0.12 -1.32 3.88 3.38 -1.99 -2.15 115.31 117.22 2nut h LEU 5 Ca -0.00 -0.54 0.07 0.00 0.09 0.00 0.00 57.88 57.50 2nut h LEU 5 Cb 0.28 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.94 2nut h LEU 5 CO 0.02 0.64 0.51 -0.33 0.09 0.00 0.00 178.44 179.36 2nut h GLU 6 N -0.40 0.79 -0.11 1.13 5.08 -1.90 -0.88 114.58 118.29 2nut h GLU 6 Ca 0.00 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2nut h GLU 6 Cb 0.61 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.68 2nut h GLU 6 CO 0.01 0.52 0.04 0.35 -1.00 0.00 0.00 179.01 178.94 2nut h PHE 7 N 0.81 0.17 -0.41 4.33 3.04 -1.16 -0.12 116.94 123.61 2nut h PHE 7 Ca 0.34 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.28 2nut h PHE 7 Cb 0.28 -0.05 -0.02 0.00 2.56 0.00 0.00 35.95 38.72 2nut h PHE 7 CO -0.00 0.28 0.27 0.82 -2.02 0.00 0.00 178.31 177.66 2nut h ILE 8 N 0.01 1.10 0.27 1.41 2.04 -0.69 -2.23 117.51 119.42 2nut h ILE 8 Ca 0.04 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 2nut h ILE 8 Cb 0.19 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 2nut h ILE 8 CO -0.00 0.10 -0.13 1.56 0.00 0.00 0.00 178.15 179.68 2nut h GLN 9 N 0.55 -0.35 -0.06 2.37 4.20 -1.07 -2.41 115.11 118.33 2nut h GLN 9 Ca 0.15 0.02 -0.03 0.00 0.06 0.00 0.00 58.65 58.85 2nut h GLN 9 Cb -0.06 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 2nut h GLN 9 CO -0.03 -0.13 -0.12 1.96 -0.67 0.00 0.00 178.83 179.84 2nut h GLN 10 N -0.52 0.10 0.00 1.46 4.20 -1.02 -1.60 115.11 117.72 2nut h GLN 10 Ca -0.04 -0.02 -0.17 0.00 0.06 0.00 0.00 58.65 58.48 2nut h GLN 10 Cb 0.39 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.13 2nut h GLN 10 CO 0.06 0.22 -0.82 -0.91 -0.67 0.00 0.00 178.83 176.71 2nut h ASN 11 N 0.09 0.00 0.51 1.46 4.21 -1.36 -1.88 115.58 118.61 2nut h ASN 11 Ca 0.02 0.00 -0.21 0.00 1.21 0.00 0.00 56.30 57.32 2nut h ASN 11 Cb 0.27 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.47 2nut h ASN 11 CO 0.02 0.82 -0.90 -0.08 -1.29 0.00 0.00 177.43 176.00 2nut h GLU 12 N 0.00 0.26 -0.27 0.81 4.81 -1.00 -0.66 114.58 118.52 2nut h GLU 12 Ca -0.01 -0.28 -0.07 0.00 -0.13 0.00 0.00 59.36 58.86 2nut h GLU 12 Cb 1.57 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 31.02 2nut h GLU 12 CO 0.11 1.00 -0.12 0.93 -0.73 0.00 0.00 179.01 180.20 2nut h GLU 13 N 0.14 0.56 0.21 1.92 5.08 -1.28 0.18 114.58 121.39 2nut h GLU 13 Ca -0.06 -0.24 -0.33 0.00 -1.00 0.00 0.00 59.36 57.74 2nut h GLU 13 Cb 1.53 -0.02 0.02 0.00 0.50 0.00 0.00 28.75 30.79 2nut h GLU 13 CO 0.14 0.80 -1.50 -0.09 -1.00 0.00 0.00 179.01 177.36 2nut h ARG 14 N 0.30 0.44 -0.10 2.33 2.43 -1.39 -3.39 114.38 114.99 2nut h ARG 14 Ca 0.06 -0.76 0.00 0.00 -0.81 0.00 0.00 59.98 58.48 2nut h ARG 14 Cb 0.63 0.28 0.00 0.00 -0.42 0.00 0.00 29.97 30.46 2nut h ARG 14 CO 0.04 1.35 0.00 -0.25 -1.51 0.00 0.00 179.97 179.60 2nut n ASP 15 N -3.64 2.02 -4.04 -3.80 8.00 -0.26 -4.84 116.55 110.00 2nut n ASP 15 Ca -0.17 -1.65 -0.32 0.00 0.71 0.00 0.00 54.79 53.37 2nut n ASP 15 Cb 1.08 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 42.12 2nut n ASP 15 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2nut n GLY 16 N 0.17 -0.45 3.05 0.44 0.00 0.64 -4.76 105.19 104.28 2nut n GLY 16 Ca 0.05 0.16 -0.12 0.00 0.00 0.00 0.00 46.02 46.11 2nut n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nut s VAL 17 N -3.35 0.46 -0.17 1.61 0.11 -1.25 -0.55 120.40 117.25 2nut s VAL 17 Ca 0.63 -1.06 -0.06 0.00 -2.93 0.00 0.00 61.98 58.56 2nut s VAL 17 Cb -0.33 -0.56 0.08 0.00 -1.53 0.00 0.00 36.38 34.05 2nut s VAL 17 CO 0.87 -0.41 0.34 -0.13 -3.33 0.00 0.00 175.10 172.44 2nut s ARG 18 N -1.59 0.25 0.08 1.54 0.52 -0.65 -3.69 118.95 115.40 2nut s ARG 18 Ca -0.11 0.85 -0.05 0.00 -0.52 0.00 0.00 55.73 55.90 2nut s ARG 18 Cb -0.10 0.07 -0.05 0.00 0.52 0.00 0.00 34.95 35.39 2nut s ARG 18 CO 0.00 -0.31 0.32 -0.06 0.02 0.00 0.00 175.30 175.27 2nut s PHE 19 N 2.52 3.53 0.29 -0.53 0.40 -1.26 -0.39 117.98 122.54 2nut s PHE 19 Ca 0.01 0.54 0.01 0.00 -0.60 0.00 0.00 56.93 56.89 2nut s PHE 19 Cb -0.12 -1.98 0.45 0.00 0.51 0.00 0.00 43.02 41.88 2nut s PHE 19 CO -0.11 0.53 1.79 0.66 0.70 0.00 0.00 175.22 178.79 2nut h SER 20 N 3.34 0.60 -3.44 1.36 4.64 -1.45 -3.39 113.55 115.21 2nut h SER 20 Ca -0.47 -0.14 -0.46 0.00 -0.47 0.00 0.00 61.79 60.24 2nut h SER 20 Cb 1.18 -0.16 -0.34 0.00 -0.31 0.00 0.00 62.40 62.77 2nut h SER 20 CO 0.70 0.71 -0.79 0.26 -0.87 0.00 0.00 176.83 176.84 2nut s TRP 21 N -4.88 1.08 -2.36 4.77 0.52 -1.26 -1.31 118.94 115.51 2nut s TRP 21 Ca -0.08 -0.36 0.25 0.00 0.02 0.00 0.00 56.10 55.92 2nut s TRP 21 Cb 0.15 -0.86 0.35 0.00 -1.15 0.00 0.00 33.47 31.96 2nut s TRP 21 CO 0.79 -0.23 1.33 0.09 0.02 0.00 0.00 176.95 178.95 2nut n ASN 22 N 3.93 2.07 -3.90 2.95 3.02 -0.58 -4.78 115.26 117.97 2nut n ASN 22 Ca -0.24 -1.55 -0.24 0.00 -0.03 0.00 0.00 54.58 52.52 2nut n ASN 22 Cb 0.51 0.20 -0.17 0.00 -0.61 0.00 0.00 39.78 39.71 2nut n ASN 22 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2nut s VAL 23 N -2.26 0.82 0.07 2.41 1.01 -1.26 -4.15 120.40 117.04 2nut s VAL 23 Ca 0.25 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 62.04 2nut s VAL 23 Cb 0.19 -0.84 -0.04 0.00 0.00 0.00 0.00 36.38 35.69 2nut s VAL 23 CO 0.44 0.31 0.11 0.26 0.00 0.00 0.00 175.10 176.23 2nut s TRP 24 N 1.36 3.27 0.08 5.22 0.51 -0.92 -4.73 118.94 123.74 2nut s TRP 24 Ca -0.03 0.12 -0.32 0.00 -2.12 0.00 0.00 56.10 53.75 2nut s TRP 24 Cb -0.14 -1.66 -0.11 0.00 -0.81 0.00 0.00 33.47 30.75 2nut s TRP 24 CO -0.03 0.54 1.80 -0.35 -0.51 0.00 0.00 176.95 178.40 2nut n PRO 25 N 0.43 2.55 -0.01 4.98 -0.04 -1.26 0.63 135.00 142.28 2nut n PRO 25 Ca -0.08 0.93 0.14 0.00 -0.04 0.00 0.00 63.50 64.45 2nut n PRO 25 Cb 0.51 -2.79 0.52 0.00 -0.04 0.00 0.00 33.50 31.71 2nut n PRO 25 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2nut n SER 26 N 5.49 1.44 -4.21 3.54 3.41 -1.26 -4.76 113.62 117.28 2nut n SER 26 Ca 0.19 -1.50 -0.13 0.00 -0.26 0.00 0.00 58.87 57.16 2nut n SER 26 Cb 0.34 -0.01 -0.10 0.00 -0.26 0.00 0.00 64.21 64.18 2nut n SER 26 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2nut s SER 27 N -1.94 1.54 0.31 4.04 1.04 -1.26 -5.02 113.70 112.40 2nut s SER 27 Ca 0.38 -0.96 0.11 0.00 0.48 0.00 0.00 55.95 55.95 2nut s SER 27 Cb 0.21 0.02 0.49 0.00 0.10 0.00 0.00 66.02 66.84 2nut s SER 27 CO 0.33 -0.35 1.70 -0.09 0.98 0.00 0.00 173.24 175.80 2nut h ARG 28 N 3.02 0.02 0.00 4.02 2.43 -1.93 -1.12 114.38 120.82 2nut h ARG 28 Ca -0.36 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.79 2nut h ARG 28 Cb 1.18 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 2nut h ARG 28 CO 0.61 0.53 0.00 -0.07 -1.51 0.00 0.00 179.97 179.53 2nut h LEU 29 N 0.02 0.00 0.00 3.80 3.38 -2.00 -2.87 115.31 117.64 2nut h LEU 29 Ca -0.00 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.60 2nut h LEU 29 Cb 0.92 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.60 2nut h LEU 29 CO 0.07 0.00 -2.36 1.21 0.09 0.00 0.00 178.44 177.45 2nut n GLU 30 N -2.83 0.57 -0.18 1.13 4.07 -1.08 -4.04 120.64 118.28 2nut n GLU 30 Ca 0.01 0.16 -0.01 0.00 -0.06 0.00 0.00 57.16 57.27 2nut n GLU 30 Cb 0.30 -1.45 0.09 0.00 -0.06 0.00 0.00 31.44 30.31 2nut n GLU 30 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2nut h ALA 31 N -0.22 0.63 0.00 4.31 0.00 -1.22 -0.57 119.26 122.19 2nut h ALA 31 Ca -0.55 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 2nut h ALA 31 Cb 1.75 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.71 2nut h ALA 31 CO -0.16 -0.32 -0.19 1.15 0.00 0.00 0.00 179.25 179.74 2nut h THR 32 N 0.23 0.46 -0.58 0.00 2.02 -1.74 -3.10 112.91 110.21 2nut h THR 32 Ca 0.28 -1.04 -0.10 0.00 0.77 0.00 0.00 66.41 66.33 2nut h THR 32 Cb 0.41 1.74 -0.06 0.00 -1.74 0.00 0.00 68.15 68.50 2nut h THR 32 CO -0.38 0.18 0.13 0.54 0.37 0.00 0.00 175.52 176.36 2nut n ARG 33 N -3.34 3.90 -2.54 6.66 1.74 -0.25 -4.92 116.66 117.91 2nut n ARG 33 Ca 0.00 -2.71 -0.43 0.00 -0.77 0.00 0.00 57.85 53.94 2nut n ARG 33 Cb 0.42 -2.14 -0.02 0.00 -1.02 0.00 0.00 32.46 29.70 2nut n ARG 33 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 2nut s MET 34 N -2.61 4.05 0.14 5.56 1.75 -1.04 -4.92 119.30 122.24 2nut s MET 34 Ca 0.48 1.23 -0.13 0.00 -1.25 0.00 0.00 55.69 56.02 2nut s MET 34 Cb 0.37 -3.78 0.00 0.00 2.84 0.00 0.00 34.83 34.26 2nut s MET 34 CO 0.13 -0.93 1.58 0.28 -0.65 0.00 0.00 175.02 175.43 2nut h VAL 35 N 5.76 1.26 -3.31 10.11 2.07 -1.92 -3.40 116.25 126.83 2nut h VAL 35 Ca -0.23 -1.08 -0.66 0.00 0.82 0.00 0.00 66.70 65.55 2nut h VAL 35 Cb 1.08 1.06 -0.29 0.00 -1.52 0.00 0.00 31.29 31.62 2nut h VAL 35 CO 1.02 0.37 -0.78 -0.69 0.02 0.00 0.00 177.57 177.51 2nut s VAL 36 N -4.97 2.88 0.64 2.57 1.01 -1.26 -5.00 120.40 116.27 2nut s VAL 36 Ca -0.13 -0.71 -0.17 0.00 0.00 0.00 0.00 61.98 60.97 2nut s VAL 36 Cb 0.11 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 34.26 2nut s VAL 36 CO 0.81 0.51 1.22 -2.16 0.00 0.00 0.00 175.10 175.49 2nut s PRO 37 N 0.63 2.65 -0.08 2.72 0.04 -1.26 -4.92 135.00 134.77 2nut s PRO 37 Ca -0.08 1.84 -0.30 0.00 0.04 0.00 0.00 61.00 62.51 2nut s PRO 37 Cb -0.16 -1.89 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 2nut s PRO 37 CO 0.03 -1.46 1.54 0.08 0.04 0.00 0.00 177.00 177.22 2nut s VAL 38 N -1.69 3.76 0.15 -0.36 1.01 -1.26 -4.76 120.40 117.26 2nut s VAL 38 Ca 0.77 0.94 -0.12 0.00 0.00 0.00 0.00 61.98 63.58 2nut s VAL 38 Cb -0.31 -3.61 0.01 0.00 0.00 0.00 0.00 36.38 32.47 2nut s VAL 38 CO 0.38 -0.08 0.35 0.00 0.00 0.00 0.00 175.10 175.75 2nut s ALA 39 N 3.76 -0.42 0.03 5.51 0.00 -1.26 -0.75 121.76 128.63 2nut s ALA 39 Ca 0.68 -0.54 0.01 0.00 0.00 0.00 0.00 51.96 52.11 2nut s ALA 39 Cb -0.30 0.77 -0.02 0.00 0.00 0.00 0.00 23.12 23.57 2nut s ALA 39 CO 0.25 -0.66 -0.05 0.00 0.00 0.00 0.00 175.76 175.30 2nut s ALA 40 N -3.90 0.37 -0.39 0.00 0.00 -0.47 -1.20 121.76 116.17 2nut s ALA 40 Ca 0.11 -0.59 -0.13 0.00 0.00 0.00 0.00 51.96 51.36 2nut s ALA 40 Cb 0.02 0.05 0.03 0.00 0.00 0.00 0.00 23.12 23.22 2nut s ALA 40 CO -0.04 -0.05 0.25 -1.17 0.00 0.00 0.00 175.76 174.75 2nut s LEU 41 N -1.24 4.91 -0.18 0.00 2.96 0.48 -0.89 118.68 124.72 2nut s LEU 41 Ca -0.10 -0.98 -0.04 0.00 -0.22 0.00 0.00 54.13 52.79 2nut s LEU 41 Cb -0.08 -2.08 -0.02 0.00 0.50 0.00 0.00 46.19 44.51 2nut s LEU 41 CO -0.00 -0.42 -0.04 0.12 -1.32 0.00 0.00 176.35 174.69 2nut s PHE 42 N 1.60 2.99 -0.68 5.38 5.36 0.93 -1.64 117.98 131.92 2nut s PHE 42 Ca 0.03 -0.50 -0.02 0.00 -0.96 0.00 0.00 56.93 55.48 2nut s PHE 42 Cb -0.19 -2.00 0.17 0.00 -0.34 0.00 0.00 43.02 40.66 2nut s PHE 42 CO 0.08 -0.21 0.50 0.99 -1.46 0.00 0.00 175.22 175.13 2nut s THR 43 N 0.74 3.76 0.46 0.12 2.01 0.29 -0.59 115.64 122.42 2nut s THR 43 Ca -0.02 -3.23 0.27 0.00 0.31 0.00 0.00 61.69 59.03 2nut s THR 43 Cb -0.15 -3.43 0.47 0.00 0.01 0.00 0.00 72.50 69.41 2nut s THR 43 CO 0.02 -0.92 1.75 1.55 -0.69 0.00 0.00 174.62 176.33 2nut h PRO 44 N 6.71 0.20 -0.18 4.92 0.13 -1.84 -2.70 132.00 139.24 2nut h PRO 44 Ca 0.03 -0.01 -0.08 0.00 -0.87 0.00 0.00 66.00 65.07 2nut h PRO 44 Cb 0.91 -0.04 -0.05 0.00 0.13 0.00 0.00 31.00 31.95 2nut h PRO 44 CO 0.74 0.13 -0.18 1.28 -0.23 0.00 0.00 178.00 179.74 2nut n LEU 45 N -4.47 3.41 -4.67 1.56 4.77 -1.26 -4.99 117.00 111.35 2nut n LEU 45 Ca 0.28 -3.61 -0.43 0.00 -0.03 0.00 0.00 56.01 52.21 2nut n LEU 45 Cb 1.12 -0.56 -0.01 0.00 -2.33 0.00 0.00 43.42 41.64 2nut n LEU 45 CO 0.30 1.14 0.86 1.17 -1.33 0.00 0.00 177.39 179.53 2nut n LYS 46 N -1.09 1.96 -2.98 3.23 4.81 -1.02 -4.24 118.16 118.83 2nut n LYS 46 Ca 0.25 0.69 -0.31 0.00 -0.87 0.00 0.00 58.31 58.07 2nut n LYS 46 Cb 0.85 -2.24 -0.04 0.00 0.02 0.00 0.00 35.03 33.62 2nut n LYS 46 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 2nut s GLU 47 N -1.53 3.83 0.00 1.64 2.02 -1.26 -4.99 118.70 118.40 2nut s GLU 47 Ca 0.58 0.48 0.00 0.00 0.02 0.00 0.00 54.97 56.06 2nut s GLU 47 Cb -0.61 -2.43 0.00 0.00 0.10 0.00 0.00 34.13 31.19 2nut s GLU 47 CO 0.59 0.04 0.00 2.89 0.02 0.00 0.00 175.26 178.81 2nut n ARG 48 N -0.99 0.00 -1.06 1.61 1.85 -1.26 -5.05 116.66 111.76 2nut n ARG 48 Ca 0.02 0.00 -0.43 0.00 -1.00 0.00 0.00 57.85 56.44 2nut n ARG 48 Cb 0.54 0.00 -0.07 0.00 -1.05 0.00 0.00 32.46 31.88 2nut n ARG 48 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 2nut n PRO 49 N 0.00 1.21 -3.13 2.89 -0.04 -1.26 -4.65 135.00 130.03 2nut n PRO 49 Ca 0.00 -1.71 -0.24 0.00 -0.04 0.00 0.00 63.50 61.51 2nut n PRO 49 Cb 0.00 -2.88 0.02 0.00 -0.04 0.00 0.00 33.50 30.60 2nut n PRO 49 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2nut n ASP 50 N 8.11 -3.78 -4.76 3.54 8.00 -1.26 -4.91 116.55 121.49 2nut n ASP 50 Ca 0.49 -0.40 -0.40 0.00 0.71 0.00 0.00 54.79 55.19 2nut n ASP 50 Cb 0.41 -1.17 -0.05 0.00 -0.02 0.00 0.00 41.12 40.29 2nut n ASP 50 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2nut s LEU 51 N -2.88 4.57 -0.28 0.64 1.43 -1.26 -4.97 118.68 115.92 2nut s LEU 51 Ca 0.16 2.10 -0.29 0.00 -1.03 0.00 0.00 54.13 55.07 2nut s LEU 51 Cb -0.02 -3.66 -0.02 0.00 0.03 0.00 0.00 46.19 42.52 2nut s LEU 51 CO 0.65 -0.02 1.63 -2.16 0.23 0.00 0.00 176.35 176.68 2nut s PRO 52 N -1.41 3.63 0.32 1.29 0.04 -1.26 -4.96 135.00 132.66 2nut s PRO 52 Ca 0.44 1.48 -0.29 0.00 0.04 0.00 0.00 61.00 62.66 2nut s PRO 52 Cb -0.28 -4.08 -0.12 0.00 0.04 0.00 0.00 34.50 30.06 2nut s PRO 52 CO 0.36 -1.49 1.48 -0.35 0.04 0.00 0.00 177.00 177.03 2nut n PRO 53 N 7.94 2.48 -3.26 0.56 -0.04 -1.26 -4.82 135.00 136.60 2nut n PRO 53 Ca 0.20 0.88 -0.46 0.00 -0.04 0.00 0.00 63.50 64.08 2nut n PRO 53 Cb 0.46 -2.59 -0.05 0.00 -0.04 0.00 0.00 33.50 31.28 2nut n PRO 53 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2nut s ILE 54 N -0.54 5.10 -1.25 0.52 -1.09 0.35 -4.96 121.20 119.34 2nut s ILE 54 Ca 0.60 -1.35 -0.19 0.00 -2.23 0.00 0.00 60.65 57.48 2nut s ILE 54 Cb -0.53 -4.38 0.01 0.00 -1.58 0.00 0.00 42.46 35.98 2nut s ILE 54 CO 0.56 -0.93 1.90 0.00 -1.23 0.00 0.00 174.94 175.23 2nut n GLN 55 N 5.55 2.60 0.00 2.79 6.02 -1.26 -1.93 117.38 131.14 2nut n GLN 55 Ca -0.13 -2.81 0.00 0.00 -0.01 0.00 0.00 57.00 54.05 2nut n GLN 55 Cb 0.41 -3.45 0.00 0.00 1.02 0.00 0.00 30.24 28.22 2nut n GLN 55 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2nut n TYR 56 N 9.13 0.00 -3.24 1.08 0.53 -1.24 -4.96 117.16 118.46 2nut n TYR 56 Ca 0.49 0.00 -0.05 0.00 -1.02 0.00 0.00 57.90 57.32 2nut n TYR 56 Cb 0.44 0.00 -0.03 0.00 -1.03 0.00 0.00 39.34 38.72 2nut n TYR 56 CO 0.00 0.00 0.00 -1.83 -1.02 0.00 0.00 176.86 174.01 2nut s GLU 57 N 4.28 0.78 0.26 -0.72 1.03 -1.26 -4.81 118.70 118.25 2nut s GLU 57 Ca 0.00 -0.48 0.23 0.00 0.03 0.00 0.00 54.97 54.75 2nut s GLU 57 Cb 0.00 -0.16 0.80 0.00 -0.80 0.00 0.00 34.13 33.97 2nut s GLU 57 CO 0.00 -1.20 0.72 -0.35 -1.33 0.00 0.00 175.26 173.10 2nut n PRO 58 N 4.31 -0.00 -1.56 -4.83 -0.04 -1.26 -4.83 135.00 126.78 2nut n PRO 58 Ca 0.11 0.50 -0.00 0.00 -0.04 0.00 0.00 63.50 64.07 2nut n PRO 58 Cb 0.53 -1.15 -0.00 0.00 -0.04 0.00 0.00 33.50 32.83 2nut n PRO 58 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2nut n VAL 59 N -2.90 -3.84 -4.14 0.52 0.31 -1.26 -4.42 118.33 102.61 2nut n VAL 59 Ca 0.21 0.26 -0.27 0.00 -0.01 0.00 0.00 64.34 64.52 2nut n VAL 59 Cb 0.93 -3.74 -0.07 0.00 -0.91 0.00 0.00 33.84 30.05 2nut n VAL 59 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2nut s LEU 60 N -0.06 3.57 0.50 7.52 1.43 -1.26 -1.76 118.68 128.63 2nut s LEU 60 Ca -0.02 -0.24 -0.22 0.00 -1.03 0.00 0.00 54.13 52.62 2nut s LEU 60 Cb 0.00 -2.21 -0.06 0.00 0.03 0.00 0.00 46.19 43.95 2nut s LEU 60 CO 0.07 0.09 1.26 0.00 0.23 0.00 0.00 176.35 178.00 2nut n SER 62 N -0.78 7.20 -3.77 0.00 3.41 -1.26 -4.04 113.62 114.39 2nut n SER 62 Ca 0.09 -3.54 -0.29 0.00 -0.26 0.00 0.00 58.87 54.87 2nut n SER 62 Cb 0.47 -1.05 -0.12 0.00 -0.26 0.00 0.00 64.21 63.24 2nut n SER 62 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2nut s ARG 63 N -3.09 1.76 0.00 4.33 3.52 -1.26 -5.03 118.95 119.18 2nut s ARG 63 Ca 0.53 -2.60 0.00 0.00 -0.13 0.00 0.00 55.73 53.53 2nut s ARG 63 Cb 0.41 -2.73 0.00 0.00 -1.56 0.00 0.00 34.95 31.07 2nut s ARG 63 CO -0.12 -1.23 0.00 2.41 -0.81 0.00 0.00 175.30 175.55 2nut n THR 64 N 2.80 0.00 -0.08 4.11 -1.04 -1.26 0.22 114.28 119.03 2nut n THR 64 Ca 0.15 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 62.04 2nut n THR 64 Cb 0.36 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.82 2nut n THR 64 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 2nut h THR 65 N 0.00 1.30 0.00 12.58 2.02 -1.96 -3.39 112.91 123.45 2nut h THR 65 Ca 0.00 -1.16 0.00 0.00 0.77 0.00 0.00 66.41 66.02 2nut h THR 65 Cb 0.00 1.57 0.00 0.00 -1.74 0.00 0.00 68.15 67.98 2nut h THR 65 CO 0.00 0.36 0.00 0.00 0.37 0.00 0.00 175.52 176.25 2nut n ARG 67 N -1.14 -1.48 -0.71 0.00 1.74 -1.23 -4.96 116.66 108.89 2nut n ARG 67 Ca 0.00 1.22 -0.32 0.00 -0.77 0.00 0.00 57.85 57.98 2nut n ARG 67 Cb 0.00 -5.63 0.16 0.00 -1.02 0.00 0.00 32.46 25.96 2nut n ARG 67 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2nut n ALA 68 N 1.10 -2.03 -2.32 7.54 0.00 -1.26 -4.00 120.51 119.53 2nut n ALA 68 Ca -0.21 -0.69 -0.39 0.00 0.00 0.00 0.00 53.44 52.15 2nut n ALA 68 Cb 0.69 -1.96 -0.06 0.00 0.00 0.00 0.00 19.45 18.12 2nut n ALA 68 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2nut s VAL 69 N -2.48 4.78 -0.11 0.00 1.01 -1.26 -0.61 120.40 121.73 2nut s VAL 69 Ca 0.62 1.21 -0.35 0.00 0.00 0.00 0.00 61.98 63.45 2nut s VAL 69 Cb -0.22 -3.90 -0.12 0.00 0.00 0.00 0.00 36.38 32.14 2nut s VAL 69 CO 0.63 0.53 1.85 -0.11 0.00 0.00 0.00 175.10 178.00 2nut n LEU 70 N 1.92 3.26 -4.43 3.92 7.94 -0.72 -4.95 117.00 123.95 2nut n LEU 70 Ca -0.10 0.99 -0.23 0.00 -1.11 0.00 0.00 56.01 55.57 2nut n LEU 70 Cb 0.51 -1.34 -0.08 0.00 0.53 0.00 0.00 43.42 43.04 2nut n LEU 70 CO 0.41 -0.13 -0.18 0.54 -1.11 0.00 0.00 177.39 176.93 2nut s ASN 71 N 3.84 2.30 0.53 1.96 2.20 -1.26 -4.83 114.94 119.68 2nut s ASN 71 Ca 0.93 -1.67 0.35 0.00 -0.94 0.00 0.00 52.86 51.53 2nut s ASN 71 Cb -0.75 0.49 1.78 0.00 -2.00 0.00 0.00 41.25 40.77 2nut s ASN 71 CO 0.53 -0.95 2.07 -0.65 -2.94 0.00 0.00 177.10 175.16 2nut h PRO 72 N 1.95 0.00 -0.00 3.55 0.11 -1.63 -1.97 132.00 134.02 2nut h PRO 72 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2nut h PRO 72 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2nut h PRO 72 CO 0.51 0.00 -0.05 1.28 -0.21 0.00 0.00 178.00 179.53 2nut n LEU 73 N -2.83 0.05 -4.74 2.35 4.77 -1.26 -4.85 117.00 110.50 2nut n LEU 73 Ca -0.01 0.43 -0.41 0.00 -0.03 0.00 0.00 56.01 55.98 2nut n LEU 73 Cb 0.14 -0.45 -0.04 0.00 -2.33 0.00 0.00 43.42 40.73 2nut n LEU 73 CO 0.20 0.01 0.76 0.00 -1.33 0.00 0.00 177.39 177.03 2nut s GLN 75 N -0.33 4.21 0.51 0.00 -0.21 -1.04 -4.91 119.66 117.89 2nut s GLN 75 Ca 0.49 0.97 0.07 0.00 0.02 0.00 0.00 55.36 56.91 2nut s GLN 75 Cb -0.28 -3.63 0.03 0.00 1.00 0.00 0.00 33.01 30.13 2nut s GLN 75 CO 0.34 -0.48 0.52 0.08 -2.12 0.00 0.00 175.29 173.63 2nut s VAL 76 N 2.70 2.17 -0.48 1.09 1.01 -1.26 0.64 120.40 126.28 2nut s VAL 76 Ca 0.36 -1.27 0.06 0.00 0.00 0.00 0.00 61.98 61.13 2nut s VAL 76 Cb -0.16 -2.45 0.18 0.00 0.00 0.00 0.00 36.38 33.96 2nut s VAL 76 CO 0.08 0.00 0.63 -0.62 0.00 0.00 0.00 175.10 175.20 2nut s ASP 77 N -4.35 -0.84 0.00 3.32 -1.08 0.19 -4.91 116.67 108.99 2nut s ASP 77 Ca 0.47 -1.85 0.00 0.00 -0.52 0.00 0.00 52.55 50.65 2nut s ASP 77 Cb -0.04 1.45 0.00 0.00 -1.46 0.00 0.00 42.92 42.87 2nut s ASP 77 CO 0.29 -0.09 0.85 -1.22 0.52 0.00 0.00 175.17 175.51 2nut n TYR 78 N 3.15 0.00 -0.09 -5.34 4.02 -1.26 -1.18 117.16 116.46 2nut n TYR 78 Ca 0.19 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.90 2nut n TYR 78 Cb 0.54 -0.36 -0.10 0.00 -0.02 0.00 0.00 39.34 39.40 2nut n TYR 78 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 2nut h ARG 79 N 0.00 0.00 -0.08 -0.72 2.43 -1.95 -3.36 114.38 110.71 2nut h ARG 79 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2nut h ARG 79 Cb 0.18 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 2nut h ARG 79 CO 0.00 0.85 0.00 0.00 -1.51 0.00 0.00 179.97 179.31 2nut n ALA 80 N -3.27 2.57 -3.87 2.80 0.00 -0.69 -4.91 120.51 113.14 2nut n ALA 80 Ca -0.24 -0.31 -0.27 0.00 0.00 0.00 0.00 53.44 52.62 2nut n ALA 80 Cb 0.57 -1.20 -0.00 0.00 0.00 0.00 0.00 19.45 18.82 2nut n ALA 80 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2nut n LYS 81 N -0.27 -2.84 -4.00 0.00 4.76 -0.32 -4.96 118.16 110.53 2nut n LYS 81 Ca 0.15 0.42 -0.08 0.00 -2.87 0.00 0.00 58.31 55.93 2nut n LYS 81 Cb 0.19 -4.42 -0.10 0.00 -1.84 0.00 0.00 35.03 28.86 2nut n LYS 81 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2nut s LEU 82 N -6.84 2.19 -0.03 -0.35 1.43 -1.13 -3.02 118.68 110.93 2nut s LEU 82 Ca 0.13 -0.67 -0.01 0.00 -1.03 0.00 0.00 54.13 52.54 2nut s LEU 82 Cb -0.05 0.29 0.02 0.00 0.03 0.00 0.00 46.19 46.48 2nut s LEU 82 CO 0.88 -0.46 0.05 -1.66 0.23 0.00 0.00 176.35 175.39 2nut s TRP 83 N -2.62 -0.02 -0.16 0.29 1.48 -0.79 -0.64 118.94 116.49 2nut s TRP 83 Ca -0.05 0.18 -0.13 0.00 -1.06 0.00 0.00 56.10 55.04 2nut s TRP 83 Cb -0.01 -0.14 -0.05 0.00 -1.16 0.00 0.00 33.47 32.11 2nut s TRP 83 CO -0.05 -0.08 0.27 0.00 -4.06 0.00 0.00 176.95 173.03 2nut s ALA 84 N 0.77 3.62 0.55 2.67 0.00 0.21 -0.14 121.76 129.44 2nut s ALA 84 Ca -0.06 -0.49 -0.20 0.00 0.00 0.00 0.00 51.96 51.21 2nut s ALA 84 Cb -0.09 -2.34 -0.05 0.00 0.00 0.00 0.00 23.12 20.64 2nut s ALA 84 CO -0.03 0.14 1.22 0.00 0.00 0.00 0.00 175.76 177.10 2nut n ASN 86 N -1.19 0.73 -0.01 0.00 6.94 -1.26 -2.77 115.26 117.69 2nut n ASN 86 Ca 0.11 -0.58 -0.21 0.00 -0.02 0.00 0.00 54.58 53.89 2nut n ASN 86 Cb 0.48 0.70 -0.14 0.00 -2.36 0.00 0.00 39.78 38.47 2nut n ASN 86 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 2nut n PHE 87 N -1.58 1.13 -0.43 -2.53 3.01 -1.26 -4.64 117.46 111.16 2nut n PHE 87 Ca 0.04 0.24 0.00 0.00 1.01 0.00 0.00 57.45 58.74 2nut n PHE 87 Cb 0.35 -1.15 0.00 0.00 -0.01 0.00 0.00 39.48 38.68 2nut n PHE 87 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2nut n TYR 89 N -0.25 0.00 -1.77 0.00 4.02 -1.12 -4.94 117.16 113.11 2nut n TYR 89 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.47 2nut n TYR 89 Cb 0.33 -1.16 -0.03 0.00 -0.02 0.00 0.00 39.34 38.46 2nut n TYR 89 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 176.86 174.71 2nut s GLN 90 N -0.87 4.15 -0.11 -0.72 2.00 -1.26 -4.48 119.66 118.37 2nut s GLN 90 Ca 0.00 2.55 -0.19 0.00 -2.00 0.00 0.00 55.36 55.72 2nut s GLN 90 Cb 0.00 -3.29 -0.04 0.00 0.80 0.00 0.00 33.01 30.48 2nut s GLN 90 CO 0.00 -0.76 0.53 1.03 -0.50 0.00 0.00 175.29 175.59 2nut s ARG 91 N 1.77 4.36 0.17 1.67 0.52 -1.26 -0.77 118.95 125.41 2nut s ARG 91 Ca 0.76 0.55 0.09 0.00 -0.52 0.00 0.00 55.73 56.61 2nut s ARG 91 Cb -0.47 -3.45 -0.04 0.00 0.52 0.00 0.00 34.95 31.51 2nut s ARG 91 CO 0.33 0.12 -0.10 -0.80 0.02 0.00 0.00 175.30 174.87 2nut s ASN 92 N 0.70 4.24 0.06 0.23 0.01 0.80 -4.92 114.94 116.06 2nut s ASN 92 Ca 0.29 -0.56 -0.12 0.00 -0.71 0.00 0.00 52.86 51.76 2nut s ASN 92 Cb -0.16 -0.72 -0.06 0.00 0.41 0.00 0.00 41.25 40.72 2nut s ASN 92 CO 0.12 0.12 0.42 -1.58 -1.51 0.00 0.00 177.10 174.67 2nut s GLN 93 N -2.71 3.85 0.06 -0.60 0.74 -1.26 -1.88 119.66 117.87 2nut s GLN 93 Ca 0.24 0.31 -0.30 0.00 0.05 0.00 0.00 55.36 55.66 2nut s GLN 93 Cb -0.09 -3.07 -0.05 0.00 1.10 0.00 0.00 33.01 30.90 2nut s GLN 93 CO 0.15 0.60 1.10 -0.06 -0.55 0.00 0.00 175.29 176.52 2nut s PHE 94 N -1.29 3.56 0.79 1.67 0.40 -1.17 -4.94 117.98 117.00 2nut s PHE 94 Ca 0.30 1.51 -0.14 0.00 -0.60 0.00 0.00 56.93 58.00 2nut s PHE 94 Cb -0.15 -3.28 0.04 0.00 0.51 0.00 0.00 43.02 40.15 2nut s PHE 94 CO 0.16 -0.66 0.98 -0.35 0.70 0.00 0.00 175.22 176.05 2nut n PRO 95 N 3.60 0.24 -0.28 0.24 -0.04 -1.26 -4.80 135.00 132.69 2nut n PRO 95 Ca 0.07 0.15 0.09 0.00 -0.04 0.00 0.00 63.50 63.76 2nut n PRO 95 Cb 0.48 -2.25 0.22 0.00 -0.04 0.00 0.00 33.50 31.91 2nut n PRO 95 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 2nut h PRO 96 N -0.73 0.14 0.00 0.54 0.13 -2.02 0.62 132.00 130.68 2nut h PRO 96 Ca -0.46 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2nut h PRO 96 Cb 1.31 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2nut h PRO 96 CO 0.45 0.09 0.00 -1.13 -0.23 0.00 0.00 178.00 177.18 2nut n SER 97 N -5.31 0.00 -0.80 1.44 3.41 -1.26 -0.82 113.62 110.28 2nut n SER 97 Ca 0.18 0.42 0.09 0.00 -0.26 0.00 0.00 58.87 59.29 2nut n SER 97 Cb 0.58 -0.43 0.14 0.00 -0.26 0.00 0.00 64.21 64.24 2nut n SER 97 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2nut n TYR 98 N -1.43 0.29 -0.37 7.33 4.02 0.21 -4.66 117.16 122.54 2nut n TYR 98 Ca 0.01 -0.20 0.29 0.00 -0.01 0.00 0.00 57.90 57.98 2nut n TYR 98 Cb 0.03 -0.01 0.56 0.00 -0.02 0.00 0.00 39.34 39.91 2nut n TYR 98 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2nut h ALA 99 N 3.24 2.37 -0.53 -0.72 0.00 -1.01 -1.71 119.26 120.90 2nut h ALA 99 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2nut h ALA 99 Cb 0.77 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2nut h ALA 99 CO 0.00 -0.92 0.00 0.41 0.00 0.00 0.00 179.25 178.74 2nut n GLY 100 N -1.45 3.13 3.76 0.00 0.00 -1.26 -4.98 105.19 104.39 2nut n GLY 100 Ca 0.32 -0.92 -0.40 0.00 0.00 0.00 0.00 46.02 45.01 2nut n GLY 100 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2nut s ILE 101 N -2.57 3.39 0.46 -0.61 -4.36 -0.65 -5.03 121.20 111.83 2nut s ILE 101 Ca 0.51 1.40 0.03 0.00 -0.26 0.00 0.00 60.65 62.33 2nut s ILE 101 Cb 0.38 -3.88 -0.02 0.00 1.25 0.00 0.00 42.46 40.19 2nut s ILE 101 CO 0.16 0.33 0.08 -0.94 0.24 0.00 0.00 174.94 174.81 2nut s SER 102 N -0.85 3.37 0.08 4.36 1.04 -0.88 -5.02 113.70 115.80 2nut s SER 102 Ca 0.45 -1.68 -0.18 0.00 0.48 0.00 0.00 55.95 55.02 2nut s SER 102 Cb -0.33 0.54 -0.09 0.00 0.10 0.00 0.00 66.02 66.24 2nut s SER 102 CO 0.42 -0.92 1.46 -0.33 0.98 0.00 0.00 173.24 174.86 2nut h GLU 103 N 1.59 0.49 -0.96 4.02 4.39 -1.96 -2.88 114.58 119.28 2nut h GLU 103 Ca -0.39 -0.20 -0.13 0.00 0.34 0.00 0.00 59.36 58.99 2nut h GLU 103 Cb 1.29 -0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 29.84 2nut h GLU 103 CO 0.63 0.73 0.16 1.28 -1.16 0.00 0.00 179.01 180.66 2nut n LEU 104 N -4.53 3.83 0.00 1.33 4.77 -1.26 -4.23 117.00 116.91 2nut n LEU 104 Ca -0.04 -1.98 0.00 0.00 -0.03 0.00 0.00 56.01 53.97 2nut n LEU 104 Cb 0.32 -0.60 0.00 0.00 -2.33 0.00 0.00 43.42 40.80 2nut n LEU 104 CO 0.40 0.60 0.00 0.59 -1.33 0.00 0.00 177.39 177.65 2nut n ASN 105 N 0.01 0.00 -4.81 -1.43 4.13 -1.13 -5.18 115.26 106.84 2nut n ASN 105 Ca 0.18 0.00 -0.22 0.00 1.68 0.00 0.00 54.58 56.22 2nut n ASN 105 Cb 0.82 0.00 -0.04 0.00 -1.54 0.00 0.00 39.78 39.01 2nut n ASN 105 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2nut s GLN 106 N 0.00 2.71 0.20 3.52 -2.07 -1.10 -2.08 119.66 120.84 2nut s GLN 106 Ca 0.00 -1.26 -0.32 0.00 -1.82 0.00 0.00 55.36 51.96 2nut s GLN 106 Cb 0.00 -2.44 -0.12 0.00 -1.09 0.00 0.00 33.01 29.36 2nut s GLN 106 CO 0.00 0.21 1.69 -1.25 -1.32 0.00 0.00 175.29 174.62 2nut s PRO 107 N -3.91 4.14 0.35 9.60 0.04 -1.26 -4.91 135.00 139.06 2nut s PRO 107 Ca 0.37 2.56 0.17 0.00 0.04 0.00 0.00 61.00 64.15 2nut s PRO 107 Cb -0.06 -3.10 1.19 0.00 0.04 0.00 0.00 34.50 32.57 2nut s PRO 107 CO 0.25 -0.73 1.63 0.00 0.04 0.00 0.00 177.00 178.20 2nut h ALA 108 N 6.84 2.06 0.00 8.56 0.00 -1.98 -0.74 119.26 133.99 2nut h ALA 108 Ca -0.43 0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2nut h ALA 108 Cb 1.20 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2nut h ALA 108 CO 0.95 -0.73 0.00 -0.85 0.00 0.00 0.00 179.25 178.62 2nut n GLU 109 N -5.11 0.12 -0.01 0.00 0.00 -1.26 -2.00 120.64 112.39 2nut n GLU 109 Ca 0.34 0.00 0.08 0.00 0.00 0.00 0.00 57.16 57.58 2nut n GLU 109 Cb 1.10 -1.50 -0.12 0.00 0.00 0.00 0.00 31.44 30.92 2nut n GLU 109 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2nut n LEU 110 N -1.00 0.04 -4.70 -1.84 4.77 -0.28 -2.14 117.00 111.84 2nut n LEU 110 Ca 0.03 -0.03 -0.42 0.00 -0.03 0.00 0.00 56.01 55.56 2nut n LEU 110 Cb 0.01 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.07 2nut n LEU 110 CO 0.02 0.01 0.87 -0.76 -1.33 0.00 0.00 177.39 176.20 2nut s LEU 111 N -4.04 4.34 0.67 2.23 1.43 -0.85 -4.35 118.68 118.10 2nut s LEU 111 Ca -0.05 1.88 0.25 0.00 -1.03 0.00 0.00 54.13 55.18 2nut s LEU 111 Cb 0.10 -3.57 1.37 0.00 0.03 0.00 0.00 46.19 44.12 2nut s LEU 111 CO 0.67 -0.47 1.77 -0.65 0.23 0.00 0.00 176.35 177.90 2nut h PRO 112 N 7.01 0.00 0.00 1.29 0.11 -1.92 0.32 132.00 138.81 2nut h PRO 112 Ca -0.39 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.62 2nut h PRO 112 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 2nut h PRO 112 CO 0.82 0.00 -0.49 1.96 -0.21 0.00 0.00 178.00 180.08 2nut h GLN 113 N 0.00 0.00 -0.73 1.05 4.20 -1.92 -3.16 115.11 114.55 2nut h GLN 113 Ca 0.00 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.34 2nut h GLN 113 Cb 0.89 0.00 -0.22 0.00 0.30 0.00 0.00 27.48 28.45 2nut h GLN 113 CO -0.00 0.49 0.35 1.19 -0.67 0.00 0.00 178.83 180.19 2nut n PHE 114 N -3.53 2.26 -2.32 2.96 0.99 0.11 -4.90 117.46 113.04 2nut n PHE 114 Ca -0.00 -1.71 -0.41 0.00 -0.00 0.00 0.00 57.45 55.34 2nut n PHE 114 Cb 0.60 -0.75 -0.03 0.00 -1.00 0.00 0.00 39.48 38.29 2nut n PHE 114 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 2nut s SER 115 N -1.76 7.06 -0.09 4.37 1.04 -1.20 -3.84 113.70 119.28 2nut s SER 115 Ca 0.52 2.43 -0.04 0.00 0.48 0.00 0.00 55.95 59.34 2nut s SER 115 Cb 0.45 -2.63 0.01 0.00 0.10 0.00 0.00 66.02 63.95 2nut s SER 115 CO 0.07 -0.32 0.08 -0.24 0.98 0.00 0.00 173.24 173.81 2nut n SER 116 N 1.17 -2.03 -3.83 7.02 2.88 -0.91 -4.85 113.62 113.07 2nut n SER 116 Ca -0.00 0.54 -0.09 0.00 -1.33 0.00 0.00 58.87 57.99 2nut n SER 116 Cb 0.44 -2.70 -0.07 0.00 -0.75 0.00 0.00 64.21 61.12 2nut n SER 116 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 2nut s ILE 117 N -0.35 0.13 -0.08 2.46 2.07 0.32 -4.92 121.20 120.81 2nut s ILE 117 Ca -0.09 -1.03 0.03 0.00 -1.41 0.00 0.00 60.65 58.15 2nut s ILE 117 Cb 0.01 -1.19 -0.01 0.00 0.13 0.00 0.00 42.46 41.40 2nut s ILE 117 CO 0.32 -0.57 -0.18 -0.70 -1.91 0.00 0.00 174.94 171.89 2nut s GLU 118 N -3.42 2.87 0.14 3.50 2.12 -1.26 0.09 118.70 122.74 2nut s GLU 118 Ca 0.01 -0.78 0.08 0.00 0.36 0.00 0.00 54.97 54.64 2nut s GLU 118 Cb 0.03 -2.38 -0.04 0.00 0.26 0.00 0.00 34.13 31.99 2nut s GLU 118 CO -0.09 0.36 -0.08 0.71 -0.54 0.00 0.00 175.26 175.63 2nut s TYR 119 N -0.08 2.73 -0.11 5.30 1.51 0.11 -0.49 117.35 126.32 2nut s TYR 119 Ca -0.04 -0.17 0.01 0.00 -1.01 0.00 0.00 57.07 55.86 2nut s TYR 119 Cb -0.14 -1.38 -0.02 0.00 -0.11 0.00 0.00 41.96 40.31 2nut s TYR 119 CO 0.04 0.47 -0.14 0.08 -1.11 0.00 0.00 175.55 174.89 2nut s VAL 120 N -1.48 2.97 -0.33 0.71 1.01 -0.81 -0.96 120.40 121.51 2nut s VAL 120 Ca 0.24 -0.70 -0.03 0.00 0.00 0.00 0.00 61.98 61.48 2nut s VAL 120 Cb -0.10 -2.22 0.06 0.00 0.00 0.00 0.00 36.38 34.12 2nut s VAL 120 CO 0.15 0.54 0.07 -0.69 0.00 0.00 0.00 175.10 175.17 2nut s VAL 121 N 0.11 3.26 -0.30 2.92 1.01 -0.64 -3.68 120.40 123.08 2nut s VAL 121 Ca -0.07 -1.45 -0.03 0.00 0.00 0.00 0.00 61.98 60.44 2nut s VAL 121 Cb -0.15 -2.93 0.04 0.00 0.00 0.00 0.00 36.38 33.34 2nut s VAL 121 CO 0.05 -0.24 0.01 -0.76 0.00 0.00 0.00 175.10 174.16 2nut s LEU 122 N 1.27 3.82 0.00 3.92 1.43 -1.26 -4.08 118.68 123.78 2nut s LEU 122 Ca -0.02 -1.13 0.00 0.00 -1.03 0.00 0.00 54.13 51.95 2nut s LEU 122 Cb -0.20 -1.74 0.00 0.00 0.03 0.00 0.00 46.19 44.28 2nut s LEU 122 CO -0.01 -0.24 0.00 -1.14 0.23 0.00 0.00 176.35 175.19 2nut n ARG 123 N 4.68 0.00 -4.67 1.70 0.63 -1.26 -5.13 116.66 112.60 2nut n ARG 123 Ca -0.14 0.00 -0.29 0.00 -0.92 0.00 0.00 57.85 56.50 2nut n ARG 123 Cb 0.45 -0.16 -0.14 0.00 0.45 0.00 0.00 32.46 33.06 2nut n ARG 123 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2nut s GLY 124 N -1.25 1.41 0.32 5.14 0.00 -1.26 -5.10 107.32 106.59 2nut s GLY 124 Ca 0.00 -1.30 -0.26 0.00 0.00 0.00 0.00 44.72 43.15 2nut s GLY 124 CO 0.00 -1.23 0.88 -1.55 0.00 0.00 0.00 173.10 171.20 2nut n PRO 125 N 1.47 1.09 -2.97 2.90 -0.04 -1.26 -4.91 135.00 131.28 2nut n PRO 125 Ca -0.17 0.38 -0.38 0.00 -0.04 0.00 0.00 63.50 63.29 2nut n PRO 125 Cb 0.53 -1.73 -0.06 0.00 -0.04 0.00 0.00 33.50 32.19 2nut n PRO 125 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2nut s GLN 126 N -1.58 4.51 0.22 0.54 -0.21 -1.26 -5.05 119.66 116.83 2nut s GLN 126 Ca 0.61 1.13 -0.25 0.00 0.02 0.00 0.00 55.36 56.87 2nut s GLN 126 Cb -0.68 -3.09 -0.09 0.00 1.00 0.00 0.00 33.01 30.15 2nut s GLN 126 CO 0.59 0.48 0.83 -1.64 -2.12 0.00 0.00 175.29 173.42 2nut s MET 127 N -1.51 4.55 0.67 2.91 -1.94 -1.26 -5.05 119.30 117.68 2nut s MET 127 Ca 0.40 1.19 -0.13 0.00 -1.71 0.00 0.00 55.69 55.44 2nut s MET 127 Cb -0.21 -3.09 -0.00 0.00 2.01 0.00 0.00 34.83 33.54 2nut s MET 127 CO 0.25 0.46 1.07 -1.25 -0.01 0.00 0.00 175.02 175.54 2nut s PRO 128 N -1.52 2.97 0.73 2.03 0.04 -1.26 -4.75 135.00 133.24 2nut s PRO 128 Ca 0.41 1.11 -0.11 0.00 0.04 0.00 0.00 61.00 62.45 2nut s PRO 128 Cb -0.21 -1.99 0.03 0.00 0.04 0.00 0.00 34.50 32.37 2nut s PRO 128 CO 0.26 -1.08 1.08 -0.51 0.04 0.00 0.00 177.00 176.78 2nut s LEU 129 N -5.17 3.11 -0.05 -3.56 1.43 -1.26 -4.85 118.68 108.33 2nut s LEU 129 Ca 0.61 1.74 0.02 0.00 -1.03 0.00 0.00 54.13 55.47 2nut s LEU 129 Cb -0.16 -4.51 0.01 0.00 0.03 0.00 0.00 46.19 41.57 2nut s LEU 129 CO 0.48 -1.73 -0.10 -0.63 0.23 0.00 0.00 176.35 174.60 2nut s ILE 130 N -2.93 0.91 -0.18 -0.59 1.01 -1.21 -0.89 121.20 117.33 2nut s ILE 130 Ca 0.60 -0.36 -0.00 0.00 0.00 0.00 0.00 60.65 60.89 2nut s ILE 130 Cb -0.16 -0.85 0.05 0.00 0.01 0.00 0.00 42.46 41.51 2nut s ILE 130 CO 0.54 0.30 -0.05 -0.36 0.00 0.00 0.00 174.94 175.37 2nut s PHE 131 N 0.65 1.83 -0.28 3.97 0.40 0.43 0.28 117.98 125.26 2nut s PHE 131 Ca -0.12 -1.21 -0.05 0.00 -0.60 0.00 0.00 56.93 54.95 2nut s PHE 131 Cb -0.14 -1.37 0.02 0.00 0.51 0.00 0.00 43.02 42.04 2nut s PHE 131 CO 0.02 -0.65 0.03 -1.17 0.70 0.00 0.00 175.22 174.15 2nut s LEU 132 N 1.59 3.63 -0.08 -0.37 2.96 0.13 -1.68 118.68 124.85 2nut s LEU 132 Ca -0.00 -0.79 -0.22 0.00 -0.22 0.00 0.00 54.13 52.90 2nut s LEU 132 Cb -0.16 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 2nut s LEU 132 CO -0.08 -0.17 0.64 -0.31 -1.32 0.00 0.00 176.35 175.11 2nut s TYR 133 N 1.43 3.56 -0.27 5.38 1.51 -0.40 -1.30 117.35 127.26 2nut s TYR 133 Ca 0.01 1.15 0.02 0.00 -1.01 0.00 0.00 57.07 57.25 2nut s TYR 133 Cb -0.17 -2.74 0.07 0.00 -0.11 0.00 0.00 41.96 39.01 2nut s TYR 133 CO -0.00 0.11 -0.05 0.08 -1.11 0.00 0.00 175.55 174.58 2nut s VAL 134 N 0.77 1.96 -0.14 0.71 1.01 0.10 -0.44 120.40 124.37 2nut s VAL 134 Ca 0.34 -1.67 0.00 0.00 0.00 0.00 0.00 61.98 60.66 2nut s VAL 134 Cb -0.17 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 33.99 2nut s VAL 134 CO 0.16 -0.20 -0.15 -0.69 0.00 0.00 0.00 175.10 174.22 2nut s VAL 135 N 1.16 2.83 0.25 2.92 1.01 0.67 -0.88 120.40 128.35 2nut s VAL 135 Ca -0.03 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 60.92 2nut s VAL 135 Cb -0.19 -2.18 -0.09 0.00 0.00 0.00 0.00 36.38 33.91 2nut s VAL 135 CO -0.07 0.52 1.02 -0.62 0.00 0.00 0.00 175.10 175.95 2nut s ASP 136 N 0.54 7.45 0.00 3.32 2.15 -0.64 -0.90 116.67 128.59 2nut s ASP 136 Ca -0.09 2.09 0.03 0.00 0.43 0.00 0.00 52.55 55.00 2nut s ASP 136 Cb -0.16 -2.62 0.06 0.00 -0.30 0.00 0.00 42.92 39.91 2nut s ASP 136 CO 0.04 -0.01 0.98 0.35 -0.17 0.00 0.00 175.17 176.36 2nut n THR 137 N 1.50 0.83 -2.80 1.71 -2.24 -0.36 -4.84 114.28 108.07 2nut n THR 137 Ca -0.01 -0.91 -0.43 0.00 -2.27 0.00 0.00 64.05 60.42 2nut n THR 137 Cb 0.46 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.29 2nut n THR 137 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nut s MET 139 N 0.24 1.20 0.62 0.00 0.23 -1.26 -4.68 119.30 115.64 2nut s MET 139 Ca 0.39 -0.48 -0.18 0.00 -1.03 0.00 0.00 55.69 54.39 2nut s MET 139 Cb 0.01 0.53 -0.03 0.00 -1.53 0.00 0.00 34.83 33.81 2nut s MET 139 CO 0.00 -0.53 1.10 0.39 -2.03 0.00 0.00 175.02 173.96 2nut n GLU 140 N -0.35 1.00 -0.21 3.16 -0.58 -1.26 -4.72 120.64 117.68 2nut n GLU 140 Ca -0.13 0.39 0.01 0.00 -0.42 0.00 0.00 57.16 57.01 2nut n GLU 140 Cb 0.63 -2.32 0.12 0.00 -0.57 0.00 0.00 31.44 29.31 2nut n GLU 140 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 2nut h ASP 141 N 0.53 0.22 -0.37 1.62 5.19 -1.98 -0.61 116.42 121.01 2nut h ASP 141 Ca -0.49 0.09 -0.02 0.00 -0.62 0.00 0.00 57.03 55.98 2nut h ASP 141 Cb 1.35 0.07 -0.02 0.00 0.18 0.00 0.00 39.33 40.92 2nut h ASP 141 CO 0.52 0.12 0.17 -0.33 -3.12 0.00 0.00 179.24 176.60 2nut h GLU 142 N 0.40 0.58 -0.08 3.56 5.08 -1.99 0.15 114.58 122.28 2nut h GLU 142 Ca 0.33 -0.07 -0.23 0.00 -1.00 0.00 0.00 59.36 58.39 2nut h GLU 142 Cb 0.44 -0.11 0.02 0.00 0.50 0.00 0.00 28.75 29.59 2nut h GLU 142 CO -0.34 0.47 -0.87 -0.44 -1.00 0.00 0.00 179.01 176.84 2nut h ASP 143 N 0.58 0.90 -0.37 1.42 3.45 -1.70 -2.51 116.42 118.19 2nut h ASP 143 Ca 0.14 -0.68 -0.09 0.00 0.43 0.00 0.00 57.03 56.83 2nut h ASP 143 Cb 0.10 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.59 2nut h ASP 143 CO -0.02 1.45 -0.14 0.25 -1.57 0.00 0.00 179.24 179.21 2nut h LEU 144 N 0.42 0.77 -0.28 1.55 5.85 -0.65 -0.47 115.31 122.50 2nut h LEU 144 Ca -0.09 -0.39 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 2nut h LEU 144 Cb 1.51 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.32 2nut h LEU 144 CO 0.17 0.98 0.14 -0.61 -0.34 0.00 0.00 178.44 178.79 2nut h GLN 145 N 0.55 0.41 -0.80 1.25 5.75 -0.79 0.23 115.11 121.71 2nut h GLN 145 Ca 0.09 -0.06 0.02 0.00 -0.15 0.00 0.00 58.65 58.55 2nut h GLN 145 Cb 0.67 -0.08 -0.04 0.00 1.07 0.00 0.00 27.48 29.10 2nut h GLN 145 CO 0.05 0.38 0.52 0.00 -2.65 0.00 0.00 178.83 177.13 2nut h ALA 146 N 1.01 1.03 -0.40 3.38 0.00 -1.36 -1.49 119.26 121.42 2nut h ALA 146 Ca 0.10 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 2nut h ALA 146 Cb 0.10 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2nut h ALA 146 CO -0.01 0.39 0.11 1.25 0.00 0.00 0.00 179.25 180.98 2nut h LEU 147 N 1.05 0.60 -1.16 0.00 5.85 -0.54 -2.12 115.31 118.98 2nut h LEU 147 Ca 0.30 -0.22 0.05 0.00 0.84 0.00 0.00 57.88 58.85 2nut h LEU 147 Cb -0.07 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 40.75 2nut h LEU 147 CO -0.08 0.66 0.58 0.11 -0.34 0.00 0.00 178.44 179.37 2nut h LYS 148 N 0.50 1.02 -0.46 1.25 1.57 -0.08 -1.69 116.57 118.68 2nut h LYS 148 Ca 0.13 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.71 2nut h LYS 148 Cb 0.29 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 2nut h LYS 148 CO -0.00 0.67 -0.24 0.93 -0.57 0.00 0.00 179.45 180.24 2nut h GLU 149 N 1.05 0.97 -0.24 3.15 5.08 -0.98 -1.58 114.58 122.03 2nut h GLU 149 Ca 0.37 -0.43 -0.07 0.00 -1.00 0.00 0.00 59.36 58.22 2nut h GLU 149 Cb 0.12 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 2nut h GLU 149 CO -0.13 1.10 -0.17 0.77 -1.00 0.00 0.00 179.01 179.58 2nut h SER 150 N 0.82 0.41 -0.14 1.42 0.02 -0.87 -1.27 113.55 113.94 2nut h SER 150 Ca 0.10 -0.11 -0.15 0.00 -0.84 0.00 0.00 61.79 60.79 2nut h SER 150 Cb 0.82 -0.11 0.01 0.00 0.14 0.00 0.00 62.40 63.26 2nut h SER 150 CO 0.07 0.60 -0.51 0.24 -1.14 0.00 0.00 176.83 176.09 2nut h MET 151 N 0.38 0.60 -0.64 3.45 2.86 -1.15 -1.98 114.93 118.45 2nut h MET 151 Ca 0.07 -0.45 -0.00 0.00 -2.06 0.00 0.00 59.70 57.25 2nut h MET 151 Cb 0.53 0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.24 2nut h MET 151 CO 0.03 1.07 0.39 1.96 1.06 0.00 0.00 176.91 181.42 2nut h GLN 152 N 0.24 0.86 -0.01 1.72 4.20 -1.12 -2.06 115.11 118.95 2nut h GLN 152 Ca -0.02 -0.08 0.01 0.00 0.06 0.00 0.00 58.65 58.62 2nut h GLN 152 Cb 1.14 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.72 2nut h GLN 152 CO 0.11 0.62 -0.06 1.98 -0.67 0.00 0.00 178.83 180.80 2nut h MET 153 N 0.86 -0.10 -0.23 1.46 4.05 -1.18 -2.06 114.93 117.73 2nut h MET 153 Ca 0.23 0.01 0.07 0.00 -0.28 0.00 0.00 59.70 59.72 2nut h MET 153 Cb -0.03 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 30.79 2nut h MET 153 CO -0.04 -0.07 0.17 0.66 0.23 0.00 0.00 176.91 177.86 2nut h SER 154 N -0.11 0.00 0.54 1.39 4.64 -1.06 0.08 113.55 119.03 2nut h SER 154 Ca 0.03 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.28 2nut h SER 154 Cb 0.14 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 2nut h SER 154 CO -0.07 0.00 -0.32 0.25 -0.87 0.00 0.00 176.83 175.81 2nut h LEU 155 N 0.00 0.00 0.00 5.97 5.85 -0.66 -2.16 115.31 124.31 2nut h LEU 155 Ca 0.11 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.83 2nut h LEU 155 Cb 0.45 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.48 2nut h LEU 155 CO -0.00 0.32 0.00 -1.54 -0.34 0.00 0.00 178.44 176.88 2nut n SER 156 N -3.79 0.00 -0.01 1.25 3.41 0.01 -3.34 113.62 111.15 2nut n SER 156 Ca -0.01 -0.02 0.09 0.00 -0.26 0.00 0.00 58.87 58.67 2nut n SER 156 Cb 0.41 -0.32 -0.13 0.00 -0.26 0.00 0.00 64.21 63.91 2nut n SER 156 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2nut n LEU 157 N -1.32 0.10 -4.74 1.04 4.77 -0.82 -5.01 117.00 111.01 2nut n LEU 157 Ca 0.12 -0.06 -0.35 0.00 -0.03 0.00 0.00 56.01 55.69 2nut n LEU 157 Cb 0.24 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.38 2nut n LEU 157 CO 0.22 0.02 0.82 -0.76 -1.33 0.00 0.00 177.39 176.37 2nut s LEU 158 N -4.04 3.53 0.40 2.23 1.43 -1.16 -4.98 118.68 116.10 2nut s LEU 158 Ca -0.05 2.36 -0.25 0.00 -1.03 0.00 0.00 54.13 55.15 2nut s LEU 158 Cb 0.11 -4.59 -0.08 0.00 0.03 0.00 0.00 46.19 41.66 2nut s LEU 158 CO 0.73 -1.82 1.21 -2.84 0.23 0.00 0.00 176.35 173.85 2nut s PRO 159 N -3.58 4.01 0.32 1.29 0.02 -1.26 -4.92 135.00 130.88 2nut s PRO 159 Ca 0.76 1.94 0.11 0.00 0.02 0.00 0.00 61.00 63.82 2nut s PRO 159 Cb -0.29 -2.69 0.96 0.00 0.02 0.00 0.00 34.50 32.50 2nut s PRO 159 CO 0.38 -0.39 1.67 -1.35 -0.33 0.00 0.00 177.00 176.98 2nut h PRO 160 N 2.62 0.34 0.00 5.54 0.11 -1.96 -0.23 132.00 138.42 2nut h PRO 160 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2nut h PRO 160 Cb 1.24 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2nut h PRO 160 CO 0.62 0.22 -0.15 1.79 -0.21 0.00 0.00 178.00 180.27 2nut h THR 161 N 0.35 0.00 -4.07 -1.15 1.35 -1.95 -1.55 112.91 105.89 2nut h THR 161 Ca 0.67 -0.55 -0.55 0.00 -0.55 0.00 0.00 66.41 65.43 2nut h THR 161 Cb 1.46 1.45 0.15 0.00 -1.73 0.00 0.00 68.15 69.47 2nut h THR 161 CO -0.59 0.00 0.59 0.00 -0.25 0.00 0.00 175.52 175.27 2nut s ALA 162 N -3.13 2.69 -0.07 6.62 0.00 -0.10 -4.60 121.76 123.17 2nut s ALA 162 Ca 0.09 1.32 -0.04 0.00 0.00 0.00 0.00 51.96 53.33 2nut s ALA 162 Cb 0.12 -3.57 -0.04 0.00 0.00 0.00 0.00 23.12 19.63 2nut s ALA 162 CO 0.63 -1.47 0.14 -0.51 0.00 0.00 0.00 175.76 174.56 2nut s LEU 163 N -3.78 4.30 0.05 0.00 1.43 -0.06 0.47 118.68 121.07 2nut s LEU 163 Ca 0.75 0.38 0.04 0.00 -1.03 0.00 0.00 54.13 54.26 2nut s LEU 163 Cb -0.40 -2.28 -0.02 0.00 0.03 0.00 0.00 46.19 43.51 2nut s LEU 163 CO 0.46 0.34 -0.11 0.68 0.23 0.00 0.00 176.35 177.95 2nut s VAL 164 N -1.15 0.84 0.05 -1.59 -7.23 -0.48 -0.43 120.40 110.40 2nut s VAL 164 Ca 0.20 -1.07 -0.02 0.00 -1.81 0.00 0.00 61.98 59.28 2nut s VAL 164 Cb -0.12 -0.82 -0.03 0.00 0.56 0.00 0.00 36.38 35.97 2nut s VAL 164 CO 0.10 -0.21 0.01 -0.83 -0.31 0.00 0.00 175.10 173.86 2nut s GLY 165 N -1.43 0.35 -0.03 2.32 0.00 -0.68 -2.24 107.32 105.63 2nut s GLY 165 Ca -0.04 -0.95 0.02 0.00 0.00 0.00 0.00 44.72 43.75 2nut s GLY 165 CO 0.01 -1.07 -0.08 -2.27 0.00 0.00 0.00 173.10 169.70 2nut s LEU 166 N -2.54 1.71 -0.05 0.66 2.96 -1.26 -1.27 118.68 118.88 2nut s LEU 166 Ca 0.01 -0.16 0.01 0.00 -0.22 0.00 0.00 54.13 53.77 2nut s LEU 166 Cb 0.03 -0.50 0.02 0.00 0.50 0.00 0.00 46.19 46.25 2nut s LEU 166 CO -0.08 0.04 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.30 2nut s ILE 167 N 0.33 0.63 0.23 6.68 1.01 0.41 -1.68 121.20 128.81 2nut s ILE 167 Ca -0.05 -0.17 0.11 0.00 0.00 0.00 0.00 60.65 60.55 2nut s ILE 167 Cb -0.09 -0.65 -0.05 0.00 0.01 0.00 0.00 42.46 41.68 2nut s ILE 167 CO 0.00 0.25 -0.21 0.42 0.00 0.00 0.00 174.94 175.40 2nut s THR 168 N 0.95 2.47 0.22 2.92 -4.23 -0.29 -0.24 115.64 117.45 2nut s THR 168 Ca -0.10 -2.17 -0.20 0.00 -1.18 0.00 0.00 61.69 58.04 2nut s THR 168 Cb -0.14 -2.24 0.03 0.00 1.34 0.00 0.00 72.50 71.49 2nut s THR 168 CO 0.00 -0.24 0.61 0.72 -0.54 0.00 0.00 174.62 175.17 2nut s PHE 169 N -2.03 -0.21 0.00 3.99 -0.12 -0.08 -0.09 117.98 119.45 2nut s PHE 169 Ca 0.25 -0.15 0.00 0.00 -0.05 0.00 0.00 56.93 56.98 2nut s PHE 169 Cb -0.07 0.53 0.00 0.00 -0.63 0.00 0.00 43.02 42.85 2nut s PHE 169 CO 0.12 -1.03 0.00 0.41 -0.05 0.00 0.00 175.22 174.68 2nut n GLY 170 N -0.40 -0.20 0.15 1.99 0.00 -1.26 -1.23 105.19 104.24 2nut n GLY 170 Ca -0.09 0.52 -0.24 0.00 0.00 0.00 0.00 46.02 46.21 2nut n GLY 170 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2nut h ARG 171 N 0.00 0.50 -6.18 1.61 2.43 -1.94 -1.29 114.38 109.51 2nut h ARG 171 Ca 0.00 -0.86 -0.52 0.00 -0.81 0.00 0.00 59.98 57.79 2nut h ARG 171 Cb 0.00 0.32 -0.06 0.00 -0.42 0.00 0.00 29.97 29.81 2nut h ARG 171 CO 0.00 1.41 -0.54 -1.64 -1.51 0.00 0.00 179.97 177.69 2nut s MET 172 N -2.59 2.62 -0.17 0.20 -1.94 -1.26 -2.99 119.30 113.17 2nut s MET 172 Ca -0.11 -1.29 -0.03 0.00 -1.71 0.00 0.00 55.69 52.54 2nut s MET 172 Cb 0.04 -2.37 -0.02 0.00 2.01 0.00 0.00 34.83 34.49 2nut s MET 172 CO 0.92 0.26 -0.05 0.08 -0.01 0.00 0.00 175.02 176.23 2nut s VAL 173 N -2.28 3.70 -0.17 -6.03 1.01 -0.33 -4.35 120.40 111.96 2nut s VAL 173 Ca 0.35 -0.42 -0.01 0.00 0.00 0.00 0.00 61.98 61.91 2nut s VAL 173 Cb -0.06 -2.63 -0.01 0.00 0.00 0.00 0.00 36.38 33.69 2nut s VAL 173 CO 0.24 0.48 -0.12 -1.10 0.00 0.00 0.00 175.10 174.59 2nut s GLN 174 N 0.61 3.29 -0.41 2.72 -0.21 0.87 -0.65 119.66 125.88 2nut s GLN 174 Ca -0.03 -0.70 -0.12 0.00 0.02 0.00 0.00 55.36 54.53 2nut s GLN 174 Cb -0.15 -2.72 0.05 0.00 1.00 0.00 0.00 33.01 31.20 2nut s GLN 174 CO 0.03 0.01 0.27 0.08 -2.12 0.00 0.00 175.29 173.55 2nut s VAL 175 N 0.88 4.63 0.27 1.09 1.01 -0.30 -1.14 120.40 126.84 2nut s VAL 175 Ca -0.03 -1.09 -0.30 0.00 0.00 0.00 0.00 61.98 60.57 2nut s VAL 175 Cb -0.15 -3.71 -0.09 0.00 0.00 0.00 0.00 36.38 32.43 2nut s VAL 175 CO -0.00 -0.41 1.03 -1.00 0.00 0.00 0.00 175.10 174.72 2nut s HIS 176 N 1.53 3.74 -0.41 5.22 0.09 -0.68 -0.74 115.29 124.05 2nut s HIS 176 Ca 0.03 1.79 -0.11 0.00 -0.00 0.00 0.00 55.06 56.77 2nut s HIS 176 Cb -0.22 -3.15 0.06 0.00 -0.00 0.00 0.00 32.58 29.27 2nut s HIS 176 CO 0.05 -0.13 0.26 -2.00 -0.00 0.00 0.00 174.74 172.93 2nut s GLU 177 N -1.37 2.75 0.55 1.40 2.12 0.47 -4.62 118.70 120.01 2nut s GLU 177 Ca 0.43 -1.30 -0.17 0.00 0.36 0.00 0.00 54.97 54.29 2nut s GLU 177 Cb -0.29 -3.83 -0.06 0.00 0.26 0.00 0.00 34.13 30.22 2nut s GLU 177 CO 0.37 -0.88 1.04 -0.51 -0.54 0.00 0.00 175.26 174.74 2nut s LEU 178 N 1.51 3.61 -1.32 2.70 1.43 -1.23 -3.94 118.68 121.45 2nut s LEU 178 Ca 0.03 1.80 -0.07 0.00 -1.03 0.00 0.00 54.13 54.86 2nut s LEU 178 Cb -0.22 -4.54 -0.00 0.00 0.03 0.00 0.00 46.19 41.47 2nut s LEU 178 CO 0.05 -0.96 0.55 0.61 0.23 0.00 0.00 176.35 176.82 2nut n GLY 179 N -0.89 -0.46 0.57 -3.19 0.00 -1.26 -4.84 105.19 95.12 2nut n GLY 179 Ca 0.08 0.24 0.13 0.00 0.00 0.00 0.00 46.02 46.47 2nut n GLY 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nut n GLU 181 N 0.31 -4.62 -1.13 0.00 1.02 -1.26 -4.67 120.64 110.29 2nut n GLU 181 Ca 0.14 3.33 -0.08 0.00 -0.02 0.00 0.00 57.16 60.54 2nut n GLU 181 Cb 0.45 -3.64 -0.03 0.00 -0.02 0.00 0.00 31.44 28.19 2nut n GLU 181 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2nut n GLY 182 N 0.63 0.75 2.15 0.62 0.00 -1.26 -4.54 105.19 103.53 2nut n GLY 182 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2nut n GLY 182 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2nut n ILE 183 N -1.85 0.00 -1.44 -0.61 0.13 -1.26 -5.13 119.36 109.20 2nut n ILE 183 Ca -0.08 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.57 2nut n ILE 183 Cb 0.48 -0.16 0.00 0.00 -0.84 0.00 0.00 39.64 39.12 2nut n ILE 183 CO 0.00 0.00 0.00 -1.54 2.80 0.00 0.00 176.55 177.81 2nut n SER 184 N -3.35 -1.92 -4.52 9.51 3.41 -1.26 -5.10 113.62 110.39 2nut n SER 184 Ca 0.00 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.35 2nut n SER 184 Cb 0.00 -0.96 -0.10 0.00 -0.26 0.00 0.00 64.21 62.89 2nut n SER 184 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 2nut s LYS 185 N -0.41 1.88 0.17 4.33 -2.85 -1.26 -5.04 119.74 116.57 2nut s LYS 185 Ca 0.00 -1.43 -0.04 0.00 -1.00 0.00 0.00 55.97 53.50 2nut s LYS 185 Cb 0.00 -2.02 -0.03 0.00 -2.06 0.00 0.00 37.83 33.72 2nut s LYS 185 CO 0.00 0.40 0.17 -1.54 0.10 0.00 0.00 175.35 174.48 2nut s SER 186 N -2.98 0.17 -0.23 0.03 1.04 -1.26 -0.39 113.70 110.07 2nut s SER 186 Ca 0.25 -1.17 -0.06 0.00 0.48 0.00 0.00 55.95 55.45 2nut s SER 186 Cb -0.08 0.38 -0.02 0.00 0.10 0.00 0.00 66.02 66.40 2nut s SER 186 CO 0.14 -0.84 0.03 -0.31 0.98 0.00 0.00 173.24 173.25 2nut s TYR 187 N -4.06 3.06 -0.12 5.02 1.51 0.08 -4.88 117.35 117.96 2nut s TYR 187 Ca 0.27 -0.50 -0.11 0.00 -1.01 0.00 0.00 57.07 55.73 2nut s TYR 187 Cb 0.06 -2.17 -0.05 0.00 -0.11 0.00 0.00 41.96 39.69 2nut s TYR 187 CO 0.05 -0.34 0.23 0.08 -1.11 0.00 0.00 175.55 174.47 2nut s VAL 188 N 1.37 5.35 0.10 0.71 1.01 -1.26 -1.15 120.40 126.53 2nut s VAL 188 Ca 0.05 0.41 0.05 0.00 0.00 0.00 0.00 61.98 62.49 2nut s VAL 188 Cb -0.15 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 2nut s VAL 188 CO 0.02 0.53 -0.13 -0.36 0.00 0.00 0.00 175.10 175.15 2nut s PHE 189 N -0.44 1.25 0.33 5.22 0.40 0.17 -4.95 117.98 119.96 2nut s PHE 189 Ca 0.16 -0.55 -0.28 0.00 -0.60 0.00 0.00 56.93 55.66 2nut s PHE 189 Cb -0.13 -0.68 -0.10 0.00 0.51 0.00 0.00 43.02 42.63 2nut s PHE 189 CO 0.05 0.08 1.19 1.03 0.70 0.00 0.00 175.22 178.27 2nut s ARG 190 N -2.42 4.40 0.00 0.44 0.52 -1.26 -1.18 118.95 119.46 2nut s ARG 190 Ca 0.05 1.96 0.18 0.00 -0.52 0.00 0.00 55.73 57.40 2nut s ARG 190 Cb -0.06 -3.03 0.69 0.00 0.52 0.00 0.00 34.95 33.08 2nut s ARG 190 CO 0.02 -0.05 1.50 0.41 0.02 0.00 0.00 175.30 177.20 2nut n GLY 191 N 0.91 0.14 0.14 -3.53 0.00 -1.16 -3.94 105.19 97.76 2nut n GLY 191 Ca 0.01 -0.36 0.05 0.00 0.00 0.00 0.00 46.02 45.71 2nut n GLY 191 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2nut h THR 192 N 1.83 0.56 -3.86 2.61 2.02 -1.83 -3.42 112.91 110.82 2nut h THR 192 Ca 0.00 -1.84 -0.25 0.00 0.77 0.00 0.00 66.41 65.09 2nut h THR 192 Cb 0.40 2.19 -0.26 0.00 -1.74 0.00 0.00 68.15 68.75 2nut h THR 192 CO 0.00 0.32 -0.73 -1.59 0.37 0.00 0.00 175.52 173.89 2nut s LYS 193 N -3.04 0.26 0.65 6.66 -2.85 -1.25 -4.50 119.74 115.67 2nut s LYS 193 Ca 0.03 -0.28 -0.11 0.00 -1.00 0.00 0.00 55.97 54.61 2nut s LYS 193 Cb 0.07 -0.14 -0.02 0.00 -2.06 0.00 0.00 37.83 35.69 2nut s LYS 193 CO 0.75 0.03 1.05 0.34 0.10 0.00 0.00 175.35 177.61 2nut s ASP 194 N -0.55 5.85 0.01 0.03 -1.08 -1.26 -4.87 116.67 114.79 2nut s ASP 194 Ca -0.04 1.48 0.04 0.00 -0.52 0.00 0.00 52.55 53.51 2nut s ASP 194 Cb -0.04 -2.45 -0.01 0.00 -1.46 0.00 0.00 42.92 38.96 2nut s ASP 194 CO -0.00 -1.12 -0.12 -0.76 0.52 0.00 0.00 175.17 173.68 2nut s LEU 195 N -5.33 2.07 0.00 -1.34 1.43 -1.26 -5.11 118.68 109.14 2nut s LEU 195 Ca 0.56 -0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.37 2nut s LEU 195 Cb -0.12 -0.59 0.00 0.00 0.03 0.00 0.00 46.19 45.51 2nut s LEU 195 CO 0.54 0.10 0.51 -1.54 0.23 0.00 0.00 176.35 176.19 2nut n SER 196 N 2.49 0.00 0.00 2.29 3.41 -1.26 -4.81 113.62 115.74 2nut n SER 196 Ca -0.15 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.02 2nut n SER 196 Cb 0.56 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 2nut n SER 196 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2nut n ALA 197 N -1.12 0.00 -0.03 7.33 0.00 -1.26 -4.70 120.51 120.74 2nut n ALA 197 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 2nut n ALA 197 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.33 2nut n ALA 197 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2nut h LYS 198 N 0.00 0.15 0.06 0.00 3.64 -1.94 0.63 116.57 119.11 2nut h LYS 198 Ca 0.00 -0.17 0.02 0.00 -1.27 0.00 0.00 60.65 59.23 2nut h LYS 198 Cb 0.00 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 2nut h LYS 198 CO 0.00 0.94 -0.19 1.96 -2.27 0.00 0.00 179.45 179.88 2nut h GLN 199 N -0.57 -0.33 -0.31 1.90 4.20 -1.95 -0.51 115.11 117.54 2nut h GLN 199 Ca -0.03 0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.75 2nut h GLN 199 Cb 1.02 0.08 -0.04 0.00 0.30 0.00 0.00 27.48 28.84 2nut h GLN 199 CO 0.05 -0.22 0.04 1.25 -0.67 0.00 0.00 178.83 179.27 2nut h LEU 200 N -0.35 -0.04 -1.07 1.46 5.85 -1.90 0.68 115.31 119.94 2nut h LEU 200 Ca 0.04 0.06 0.12 0.00 0.84 0.00 0.00 57.88 58.94 2nut h LEU 200 Cb 0.39 0.09 -0.08 0.00 0.37 0.00 0.00 40.66 41.43 2nut h LEU 200 CO -0.14 0.01 0.62 -0.61 -0.34 0.00 0.00 178.44 177.98 2nut h GLN 201 N 0.14 0.92 -0.00 1.25 4.15 -0.36 -0.64 115.11 120.57 2nut h GLN 201 Ca 0.14 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.51 2nut h GLN 201 Cb 0.17 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.66 2nut h GLN 201 CO -0.21 0.61 -0.01 0.93 -1.93 0.00 0.00 178.83 178.22 2nut h GLU 202 N 0.95 0.01 -0.69 1.69 5.08 0.03 -1.41 114.58 120.24 2nut h GLU 202 Ca 0.48 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.87 2nut h GLU 202 Cb 0.51 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.72 2nut h GLU 202 CO -0.24 0.64 0.46 0.52 -1.00 0.00 0.00 179.01 179.38 2nut h MET 203 N -0.62 0.78 0.00 2.33 2.86 -0.59 -2.98 114.93 116.70 2nut h MET 203 Ca -0.00 -0.05 -0.18 0.00 -2.06 0.00 0.00 59.70 57.42 2nut h MET 203 Cb 0.64 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 32.10 2nut h MET 203 CO 0.00 0.52 -1.27 -0.07 1.06 0.00 0.00 176.91 177.15 2nut h LEU 204 N 0.80 0.00 0.00 1.22 3.38 -1.20 -3.51 115.31 116.00 2nut h LEU 204 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 2nut h LEU 204 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2nut h LEU 204 CO -0.08 0.65 0.00 0.61 0.09 0.00 0.00 178.44 179.71 2nut n GLY 205 N 1.39 0.98 3.29 0.83 0.00 -0.53 -5.09 105.19 106.06 2nut n GLY 205 Ca -0.08 -0.53 -0.16 0.00 0.00 0.00 0.00 46.02 45.25 2nut n GLY 205 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2nut s PRO 225 N 0.00 1.19 0.00 1.61 0.04 -1.26 -4.86 135.00 131.72 2nut s PRO 225 Ca 0.00 -1.52 0.00 0.00 0.04 0.00 0.00 61.00 59.52 2nut s PRO 225 Cb 0.00 -0.81 0.00 0.00 0.04 0.00 0.00 34.50 33.73 2nut s PRO 225 CO 0.00 0.10 0.00 -1.13 0.04 0.00 0.00 177.00 176.01 2nut n SER 226 N -0.29 0.00 -0.98 6.66 3.41 -1.26 -4.90 113.62 116.26 2nut n SER 226 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.52 2nut n SER 226 Cb 0.61 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.56 2nut n SER 226 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2nut n ASN 227 N 0.00 0.63 0.11 4.04 3.02 -0.76 -4.97 115.26 117.32 2nut n ASN 227 Ca 0.00 -0.49 0.04 0.00 -0.03 0.00 0.00 54.58 54.10 2nut n ASN 227 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 2nut n ASN 227 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 2nut h ARG 228 N 0.00 0.00 0.00 3.52 3.08 -1.98 -3.32 114.38 115.69 2nut h ARG 228 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2nut h ARG 228 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2nut h ARG 228 CO 0.00 0.29 -0.96 1.19 -1.07 0.00 0.00 179.97 179.42 2nut n PHE 229 N -3.01 0.08 -3.59 3.04 3.01 -1.26 -3.49 117.46 112.24 2nut n PHE 229 Ca -0.02 0.02 -0.29 0.00 1.01 0.00 0.00 57.45 58.17 2nut n PHE 229 Cb 0.72 -0.21 -0.14 0.00 -0.01 0.00 0.00 39.48 39.83 2nut n PHE 229 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2nut s LEU 230 N -3.37 1.28 0.19 4.37 1.43 -1.25 -4.01 118.68 117.33 2nut s LEU 230 Ca 0.06 -1.72 0.09 0.00 -1.03 0.00 0.00 54.13 51.53 2nut s LEU 230 Cb 0.16 -0.56 -0.04 0.00 0.03 0.00 0.00 46.19 45.78 2nut s LEU 230 CO 0.81 -0.39 -0.07 -1.10 0.23 0.00 0.00 176.35 175.84 2nut s GLN 231 N 1.57 2.14 0.29 1.70 -0.21 -0.95 -1.84 119.66 122.36 2nut s GLN 231 Ca 0.12 -1.27 -0.30 0.00 0.02 0.00 0.00 55.36 53.94 2nut s GLN 231 Cb -0.19 -2.19 -0.13 0.00 1.00 0.00 0.00 33.01 31.51 2nut s GLN 231 CO -0.21 0.43 1.36 -2.30 -2.12 0.00 0.00 175.29 172.44 2nut n PRO 232 N -0.11 2.09 -0.10 2.91 -0.02 -1.26 -1.38 135.00 137.14 2nut n PRO 232 Ca -0.10 0.74 -0.06 0.00 -2.02 0.00 0.00 63.50 62.06 2nut n PRO 232 Cb 0.56 -2.36 0.02 0.00 -0.02 0.00 0.00 33.50 31.69 2nut n PRO 232 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2nut h VAL 233 N 2.82 0.80 -0.21 -1.45 2.07 0.23 -1.68 116.25 118.83 2nut h VAL 233 Ca -0.45 -0.06 0.06 0.00 0.82 0.00 0.00 66.70 67.07 2nut h VAL 233 Cb 1.28 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 2nut h VAL 233 CO 0.70 0.03 0.23 0.06 0.02 0.00 0.00 177.57 178.61 2nut h GLN 234 N 0.17 0.00 0.02 1.57 3.07 -1.56 0.65 115.11 119.02 2nut h GLN 234 Ca 0.17 0.00 -0.35 0.00 0.09 0.00 0.00 58.65 58.56 2nut h GLN 234 Cb 0.20 0.00 -0.06 0.00 0.08 0.00 0.00 27.48 27.71 2nut h GLN 234 CO -0.24 0.00 -2.14 1.63 0.09 0.00 0.00 178.83 178.17 2nut n LYS 235 N -3.82 0.68 -0.01 0.06 5.02 -0.92 -4.60 118.16 114.57 2nut n LYS 235 Ca 0.02 0.16 0.10 0.00 -2.02 0.00 0.00 58.31 56.57 2nut n LYS 235 Cb 0.36 -1.63 -0.15 0.00 -0.02 0.00 0.00 35.03 33.59 2nut n LYS 235 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 2nut n ILE 236 N -3.05 0.00 -0.29 -0.18 2.08 -0.68 -4.71 119.36 112.53 2nut n ILE 236 Ca -0.30 -0.34 0.10 0.00 0.56 0.00 0.00 62.75 62.77 2nut n ILE 236 Cb 1.08 0.32 0.24 0.00 -0.75 0.00 0.00 39.64 40.53 2nut n ILE 236 CO 0.00 0.00 0.00 -2.24 0.56 0.00 0.00 176.55 174.87 2nut h ASP 237 N 0.00 -0.17 -0.52 4.38 2.03 0.08 -1.68 116.42 120.54 2nut h ASP 237 Ca 0.00 0.20 -0.02 0.00 -0.73 0.00 0.00 57.03 56.48 2nut h ASP 237 Cb 0.81 0.32 -0.02 0.00 -0.83 0.00 0.00 39.33 39.60 2nut h ASP 237 CO 0.00 -0.18 0.24 0.24 -1.03 0.00 0.00 179.24 178.51 2nut h MET 238 N 0.15 0.76 -0.62 4.15 2.86 -1.84 -1.23 114.93 119.15 2nut h MET 238 Ca 0.51 -0.12 -0.06 0.00 -2.06 0.00 0.00 59.70 57.97 2nut h MET 238 Cb 0.98 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 32.48 2nut h MET 238 CO -0.68 0.64 0.17 -0.91 1.06 0.00 0.00 176.91 177.19 2nut h ASN 239 N 0.70 0.93 -0.32 1.22 4.21 -1.66 -2.64 115.58 118.02 2nut h ASN 239 Ca 0.18 -0.22 -0.13 0.00 1.21 0.00 0.00 56.30 57.33 2nut h ASN 239 Cb 0.14 -0.24 -0.01 0.00 -1.12 0.00 0.00 38.32 37.08 2nut h ASN 239 CO -0.02 0.90 -0.29 0.25 -1.29 0.00 0.00 177.43 176.98 2nut h LEU 240 N 0.90 0.87 -0.46 1.61 6.46 -1.24 -0.80 115.31 122.65 2nut h LEU 240 Ca 0.20 -0.35 -0.00 0.00 -0.12 0.00 0.00 57.88 57.61 2nut h LEU 240 Cb 0.32 -0.24 -0.02 0.00 -0.73 0.00 0.00 40.66 39.99 2nut h LEU 240 CO -0.00 1.10 0.29 0.74 -0.62 0.00 0.00 178.44 179.94 2nut h THR 241 N 0.71 1.14 -0.35 1.05 2.02 -1.11 0.39 112.91 116.75 2nut h THR 241 Ca 0.08 -0.29 -0.05 0.00 0.77 0.00 0.00 66.41 66.92 2nut h THR 241 Cb 0.84 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.74 2nut h THR 241 CO 0.07 0.13 0.03 0.44 0.37 0.00 0.00 175.52 176.56 2nut h ASP 242 N 0.61 0.58 -0.04 4.18 3.32 -1.39 -0.43 116.42 123.25 2nut h ASP 242 Ca 0.17 -0.29 -0.00 0.00 0.02 0.00 0.00 57.03 56.93 2nut h ASP 242 Cb -0.03 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.37 2nut h ASP 242 CO -0.03 0.72 0.02 0.25 -1.72 0.00 0.00 179.24 178.48 2nut h LEU 243 N 0.42 0.05 -1.26 1.55 6.46 -0.80 -0.76 115.31 120.96 2nut h LEU 243 Ca 0.10 -0.06 0.07 0.00 -0.12 0.00 0.00 57.88 57.88 2nut h LEU 243 Cb 0.41 -0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 40.27 2nut h LEU 243 CO 0.01 0.09 0.54 -0.07 -0.62 0.00 0.00 178.44 178.39 2nut h LEU 244 N 0.00 0.77 -1.04 2.25 3.38 -0.15 -0.88 115.31 119.64 2nut h LEU 244 Ca 0.01 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 2nut h LEU 244 Cb 0.05 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2nut h LEU 244 CO -0.00 0.49 -0.37 1.23 0.09 0.00 0.00 178.44 179.87 2nut h GLY 245 N 0.87 0.00 -0.09 0.83 0.00 -0.44 -3.11 103.07 101.14 2nut h GLY 245 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.69 2nut h GLY 245 CO -0.13 0.00 -0.23 1.18 0.00 0.00 0.00 176.54 177.35 2nut n GLU 246 N -3.61 1.07 -1.68 4.80 1.02 -0.35 -4.96 120.64 116.92 2nut n GLU 246 Ca -0.01 -0.67 -0.43 0.00 -0.02 0.00 0.00 57.16 56.03 2nut n GLU 246 Cb 0.48 -1.49 -0.01 0.00 -0.02 0.00 0.00 31.44 30.41 2nut n GLU 246 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2nut n LEU 247 N -0.38 3.32 -4.42 -4.62 4.77 -0.84 -5.00 117.00 109.83 2nut n LEU 247 Ca 0.13 1.20 -0.20 0.00 -0.03 0.00 0.00 56.01 57.11 2nut n LEU 247 Cb 0.37 -1.46 -0.10 0.00 -2.33 0.00 0.00 43.42 39.90 2nut n LEU 247 CO 0.24 -0.59 -0.26 0.00 -1.33 0.00 0.00 177.39 175.45 2nut s GLN 248 N -1.74 1.61 0.65 3.23 -2.07 -1.26 -5.02 119.66 115.05 2nut s GLN 248 Ca 0.57 -1.89 -0.17 0.00 -1.82 0.00 0.00 55.36 52.04 2nut s GLN 248 Cb -0.59 -0.68 -0.03 0.00 -1.09 0.00 0.00 33.01 30.62 2nut s GLN 248 CO 0.61 -0.24 0.98 0.54 -1.32 0.00 0.00 175.29 175.86 2nut n ARG 249 N -0.64 0.78 -1.67 9.60 1.74 -1.26 -4.84 116.66 120.36 2nut n ARG 249 Ca -0.02 0.31 -0.50 0.00 -0.77 0.00 0.00 57.85 56.87 2nut n ARG 249 Cb 0.66 -2.21 -0.05 0.00 -1.02 0.00 0.00 32.46 29.84 2nut n ARG 249 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2nut n ASP 250 N -1.13 2.83 0.31 0.55 4.64 -0.77 -4.83 116.55 118.15 2nut n ASP 250 Ca 0.14 1.05 0.19 0.00 -1.38 0.00 0.00 54.79 54.79 2nut n ASP 250 Cb 0.48 -1.31 1.03 0.00 -1.04 0.00 0.00 41.12 40.28 2nut n ASP 250 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 2nut h PRO 251 N 7.10 0.00 -6.24 -0.67 0.13 -1.93 -3.44 132.00 126.96 2nut h PRO 251 Ca -0.47 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.10 2nut h PRO 251 Cb 1.29 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.39 2nut h PRO 251 CO 0.90 0.02 0.90 -1.58 -0.23 0.00 0.00 178.00 178.01 2nut s TRP 252 N -4.24 2.70 0.85 1.56 0.52 -1.26 -4.99 118.94 114.08 2nut s TRP 252 Ca -0.04 0.82 -0.13 0.00 0.02 0.00 0.00 56.10 56.77 2nut s TRP 252 Cb 0.13 -3.61 0.05 0.00 -1.15 0.00 0.00 33.47 28.89 2nut s TRP 252 CO 0.48 -2.27 0.83 -2.30 0.02 0.00 0.00 176.95 173.72 2nut n PRO 253 N 6.29 -0.02 -3.97 4.98 -0.02 -1.26 -4.99 135.00 136.01 2nut n PRO 253 Ca 0.14 0.06 -0.32 0.00 -2.02 0.00 0.00 63.50 61.36 2nut n PRO 253 Cb 0.44 -2.14 -0.14 0.00 -0.02 0.00 0.00 33.50 31.64 2nut n PRO 253 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2nut s VAL 254 N -2.23 2.50 0.85 -1.45 1.01 -1.26 -4.97 120.40 114.85 2nut s VAL 254 Ca 0.66 -2.22 -0.12 0.00 0.00 0.00 0.00 61.98 60.30 2nut s VAL 254 Cb -0.27 -2.78 0.10 0.00 0.00 0.00 0.00 36.38 33.43 2nut s VAL 254 CO 0.58 -0.57 1.14 -0.81 0.00 0.00 0.00 175.10 175.44 2nut n PRO 255 N 4.34 -0.08 -1.56 2.72 -0.04 -1.26 -4.88 135.00 134.24 2nut n PRO 255 Ca 0.01 0.05 -0.46 0.00 -0.04 0.00 0.00 63.50 63.07 2nut n PRO 255 Cb 0.42 -2.38 -0.02 0.00 -0.04 0.00 0.00 33.50 31.48 2nut n PRO 255 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2nut n GLN 256 N -3.54 1.13 -1.28 0.54 1.13 -1.26 -2.22 117.38 111.89 2nut n GLN 256 Ca 0.13 0.40 -0.10 0.00 -1.94 0.00 0.00 57.00 55.49 2nut n GLN 256 Cb 0.51 -1.74 -0.04 0.00 0.11 0.00 0.00 30.24 29.08 2nut n GLN 256 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2nut n GLY 257 N 1.48 1.01 3.43 1.08 0.00 -1.26 -4.99 105.19 105.94 2nut n GLY 257 Ca 0.12 -0.15 -0.27 0.00 0.00 0.00 0.00 46.02 45.71 2nut n GLY 257 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nut s LYS 258 N -2.61 1.56 0.31 1.61 -0.14 -0.94 -0.55 119.74 118.98 2nut s LYS 258 Ca 0.00 -1.48 -0.04 0.00 -1.36 0.00 0.00 55.97 53.09 2nut s LYS 258 Cb 0.00 -1.88 -0.05 0.00 -1.68 0.00 0.00 37.83 34.22 2nut s LYS 258 CO 0.00 0.41 0.56 1.03 -0.76 0.00 0.00 175.35 176.59 2nut s ARG 259 N -2.62 3.59 0.75 1.68 0.52 0.85 -4.80 118.95 118.93 2nut s ARG 259 Ca 0.20 -0.07 -0.11 0.00 -0.52 0.00 0.00 55.73 55.23 2nut s ARG 259 Cb -0.08 -2.64 0.04 0.00 0.52 0.00 0.00 34.95 32.79 2nut s ARG 259 CO 0.10 0.18 1.08 -2.14 0.02 0.00 0.00 175.30 174.54 2nut s PRO 260 N -3.78 2.43 -0.37 3.54 0.02 -1.26 -4.88 135.00 130.70 2nut s PRO 260 Ca 0.43 1.08 -0.26 0.00 0.02 0.00 0.00 61.00 62.27 2nut s PRO 260 Cb -0.10 -1.92 0.01 0.00 0.02 0.00 0.00 34.50 32.51 2nut s PRO 260 CO 0.32 -1.50 0.92 -0.51 -0.33 0.00 0.00 177.00 175.91 2nut s LEU 261 N -5.81 4.00 -0.21 -5.54 1.43 -1.26 -4.73 118.68 106.55 2nut s LEU 261 Ca 0.60 0.58 0.01 0.00 -1.03 0.00 0.00 54.13 54.30 2nut s LEU 261 Cb -0.16 -3.26 0.03 0.00 0.03 0.00 0.00 46.19 42.83 2nut s LEU 261 CO 0.56 -0.85 -0.16 -0.60 0.23 0.00 0.00 176.35 175.53 2nut s ARG 262 N 3.46 2.72 -1.03 1.70 3.52 -1.26 -3.06 118.95 125.00 2nut s ARG 262 Ca 0.38 -1.02 -0.04 0.00 -0.13 0.00 0.00 55.73 54.92 2nut s ARG 262 Cb -0.12 -2.72 0.17 0.00 -1.56 0.00 0.00 34.95 30.73 2nut s ARG 262 CO 0.18 -0.35 2.31 0.43 -0.81 0.00 0.00 175.30 177.07 2nut n SER 263 N 4.56 7.52 -0.35 -2.12 7.64 -0.49 -1.34 113.62 129.05 2nut n SER 263 Ca -0.18 -3.34 -0.00 0.00 1.01 0.00 0.00 58.87 56.35 2nut n SER 263 Cb 0.47 -1.26 0.15 0.00 -1.01 0.00 0.00 64.21 62.56 2nut n SER 263 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2nut h SER 264 N 4.03 1.07 -0.32 6.43 0.02 -1.87 -1.40 113.55 121.52 2nut h SER 264 Ca 0.59 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.51 2nut h SER 264 Cb 0.37 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 2nut h SER 264 CO 1.28 0.75 0.16 1.23 -1.14 0.00 0.00 176.83 179.12 2nut h GLY 265 N 1.25 0.48 1.54 -3.77 0.00 -1.86 -1.62 103.07 99.09 2nut h GLY 265 Ca 0.37 -0.23 -0.18 0.00 0.00 0.00 0.00 47.33 47.29 2nut h GLY 265 CO -0.10 0.22 -0.70 -2.08 0.00 0.00 0.00 176.54 173.87 2nut h VAL 266 N 0.38 1.36 -0.31 4.60 2.07 -1.62 -1.38 116.25 121.36 2nut h VAL 266 Ca 0.11 -2.07 -0.00 0.00 0.82 0.00 0.00 66.70 65.56 2nut h VAL 266 Cb 0.09 2.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.89 2nut h VAL 266 CO -0.02 0.63 0.19 0.00 0.02 0.00 0.00 177.57 178.39 2nut h ALA 267 N 0.91 0.39 -0.58 1.67 0.00 -1.16 -0.59 119.26 119.90 2nut h ALA 267 Ca -0.03 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 2nut h ALA 267 Cb 1.28 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 2nut h ALA 267 CO 0.12 -0.12 -0.02 1.25 0.00 0.00 0.00 179.25 180.49 2nut h LEU 268 N 0.40 1.00 -1.06 0.00 6.46 -1.20 -1.30 115.31 119.61 2nut h LEU 268 Ca 0.11 -0.28 -0.07 0.00 -0.12 0.00 0.00 57.88 57.52 2nut h LEU 268 Cb -0.00 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 39.64 2nut h LEU 268 CO -0.02 1.06 -0.04 0.77 -0.62 0.00 0.00 178.44 179.59 2nut h SER 269 N 0.93 0.59 0.13 1.25 4.64 -0.95 -0.62 113.55 119.52 2nut h SER 269 Ca 0.16 -0.14 -0.15 0.00 -0.47 0.00 0.00 61.79 61.19 2nut h SER 269 Cb 0.56 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.48 2nut h SER 269 CO 0.03 0.69 -0.56 0.40 -0.87 0.00 0.00 176.83 176.52 2nut h ILE 270 N 0.58 1.34 -0.07 0.95 2.04 -0.81 0.94 117.51 122.48 2nut h ILE 270 Ca 0.12 -1.83 -0.01 0.00 1.00 0.00 0.00 64.86 64.13 2nut h ILE 270 Cb 0.43 1.83 -0.00 0.00 -0.74 0.00 0.00 36.82 38.34 2nut h ILE 270 CO 0.02 0.56 -0.00 0.00 0.00 0.00 0.00 178.15 178.73 2nut h ALA 271 N 1.05 0.09 -0.48 1.87 0.00 -0.81 0.12 119.26 121.10 2nut h ALA 271 Ca 0.00 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.76 2nut h ALA 271 Cb 1.08 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 2nut h ALA 271 CO 0.10 -0.22 0.28 0.28 0.00 0.00 0.00 179.25 179.69 2nut h VAL 272 N -0.17 1.03 -0.76 0.00 2.07 -1.07 -2.44 116.25 114.91 2nut h VAL 272 Ca 0.02 -0.19 -0.04 0.00 0.82 0.00 0.00 66.70 67.30 2nut h VAL 272 Cb 0.35 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.52 2nut h VAL 272 CO 0.00 0.10 0.30 1.23 0.02 0.00 0.00 177.57 179.23 2nut h GLY 273 N 0.55 1.22 0.98 2.17 0.00 -0.65 -1.29 103.07 106.06 2nut h GLY 273 Ca 0.20 -0.66 0.00 0.00 0.00 0.00 0.00 47.33 46.87 2nut h GLY 273 CO -0.10 0.62 0.02 -2.00 0.00 0.00 0.00 176.54 175.08 2nut h LEU 274 N 1.11 0.04 -0.82 3.11 5.85 -0.35 -2.35 115.31 121.90 2nut h LEU 274 Ca 0.25 -0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.85 2nut h LEU 274 Cb 0.21 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 2nut h LEU 274 CO -0.02 0.05 -0.26 -0.07 -0.34 0.00 0.00 178.44 177.80 2nut h LEU 275 N 0.03 0.61 -1.57 2.25 3.38 -1.33 -2.70 115.31 115.98 2nut h LEU 275 Ca 0.01 -0.22 0.02 0.00 0.09 0.00 0.00 57.88 57.78 2nut h LEU 275 Cb 0.01 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 2nut h LEU 275 CO -0.00 0.85 0.31 -0.08 0.09 0.00 0.00 178.44 179.61 2nut h GLU 276 N 0.52 0.56 -0.02 1.13 4.81 -0.96 0.52 114.58 121.14 2nut h GLU 276 Ca 0.07 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2nut h GLU 276 Cb 0.72 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.97 2nut h GLU 276 CO 0.06 0.37 -0.16 0.00 -0.73 0.00 0.00 179.01 178.55 2nut n THR 278 N 0.68 1.17 -3.25 0.00 -2.24 -0.90 -4.93 114.28 104.81 2nut n THR 278 Ca 0.13 0.20 -0.25 0.00 -2.27 0.00 0.00 64.05 61.86 2nut n THR 278 Cb 0.52 -1.83 -0.07 0.00 -2.10 0.00 0.00 70.33 66.85 2nut n THR 278 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2nut n PHE 279 N -3.79 1.93 -2.52 4.78 3.01 0.12 -5.09 117.46 115.90 2nut n PHE 279 Ca -0.09 -3.89 -0.34 0.00 1.01 0.00 0.00 57.45 54.14 2nut n PHE 279 Cb 0.31 -0.46 -0.03 0.00 -0.01 0.00 0.00 39.48 39.28 2nut n PHE 279 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 2nut s PRO 280 N -2.15 3.79 -1.00 -1.08 0.04 -1.21 -4.09 135.00 129.31 2nut s PRO 280 Ca 0.39 1.31 -0.01 0.00 0.04 0.00 0.00 61.00 62.74 2nut s PRO 280 Cb 0.20 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.64 2nut s PRO 280 CO -0.07 -0.43 0.84 0.09 0.04 0.00 0.00 177.00 177.47 2nut n ASN 281 N -1.06 -2.62 -3.59 6.66 3.02 -0.02 -5.03 115.26 112.62 2nut n ASN 281 Ca 0.09 -0.49 -0.15 0.00 -0.03 0.00 0.00 54.58 54.00 2nut n ASN 281 Cb 0.53 -4.25 -0.07 0.00 -0.61 0.00 0.00 39.78 35.38 2nut n ASN 281 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2nut s THR 282 N -3.29 0.00 0.05 3.41 2.01 -1.26 -5.05 115.64 111.51 2nut s THR 282 Ca 0.08 0.00 -0.37 0.00 0.31 0.00 0.00 61.69 61.71 2nut s THR 282 Cb -0.04 -1.00 -0.16 0.00 0.01 0.00 0.00 72.50 71.31 2nut s THR 282 CO 0.59 0.00 1.41 0.61 -0.69 0.00 0.00 174.62 176.55 2nut n GLY 283 N 1.96 0.58 3.34 4.40 0.00 -1.26 -4.72 105.19 109.48 2nut n GLY 283 Ca -0.16 0.73 -0.15 0.00 0.00 0.00 0.00 46.02 46.44 2nut n GLY 283 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nut s ALA 284 N 0.92 -1.13 -0.22 4.61 0.00 -1.26 -3.29 121.76 121.38 2nut s ALA 284 Ca 0.86 0.64 0.01 0.00 0.00 0.00 0.00 51.96 53.47 2nut s ALA 284 Cb -0.94 0.10 0.05 0.00 0.00 0.00 0.00 23.12 22.32 2nut s ALA 284 CO 0.48 -0.33 -0.10 1.03 0.00 0.00 0.00 175.76 176.85 2nut s ARG 285 N -1.47 2.04 -0.50 0.00 0.52 0.14 -2.04 118.95 117.64 2nut s ARG 285 Ca -0.11 -0.96 -0.17 0.00 -0.52 0.00 0.00 55.73 53.96 2nut s ARG 285 Cb -0.03 -2.54 0.07 0.00 0.52 0.00 0.00 34.95 32.97 2nut s ARG 285 CO 0.05 -0.47 0.52 0.42 0.02 0.00 0.00 175.30 175.84 2nut s ILE 286 N 1.34 5.05 -0.41 1.52 1.01 -0.05 -0.70 121.20 128.97 2nut s ILE 286 Ca -0.03 -0.86 -0.13 0.00 0.00 0.00 0.00 60.65 59.62 2nut s ILE 286 Cb -0.17 -4.24 0.04 0.00 0.01 0.00 0.00 42.46 38.09 2nut s ILE 286 CO -0.07 -0.74 0.28 -0.04 0.00 0.00 0.00 174.94 174.37 2nut s MET 287 N 2.12 2.90 -0.20 2.79 -1.94 -0.42 0.30 119.30 124.85 2nut s MET 287 Ca 0.09 -1.13 -0.09 0.00 -1.71 0.00 0.00 55.69 52.86 2nut s MET 287 Cb -0.23 -3.91 -0.04 0.00 2.01 0.00 0.00 34.83 32.66 2nut s MET 287 CO 0.08 -0.80 0.10 1.41 -0.01 0.00 0.00 175.02 175.80 2nut s MET 288 N 1.62 4.02 -0.24 2.03 0.00 -0.02 -0.72 119.30 125.99 2nut s MET 288 Ca 0.04 -0.31 -0.03 0.00 0.00 0.00 0.00 55.69 55.38 2nut s MET 288 Cb -0.20 -3.33 0.01 0.00 0.00 0.00 0.00 34.83 31.31 2nut s MET 288 CO 0.08 0.21 -0.05 -0.06 0.00 0.00 0.00 175.02 175.20 2nut s PHE 289 N 0.58 3.01 0.02 4.11 0.40 -0.06 0.74 117.98 126.78 2nut s PHE 289 Ca 0.05 -1.22 0.08 0.00 -0.60 0.00 0.00 56.93 55.24 2nut s PHE 289 Cb -0.12 -2.09 -0.02 0.00 0.51 0.00 0.00 43.02 41.29 2nut s PHE 289 CO 0.01 -0.64 -0.23 0.96 0.70 0.00 0.00 175.22 176.02 2nut s ILE 290 N 1.41 1.84 -0.21 0.64 -4.36 -0.03 -1.62 121.20 118.87 2nut s ILE 290 Ca 0.03 -1.18 0.14 0.00 -0.26 0.00 0.00 60.65 59.38 2nut s ILE 290 Cb -0.15 -1.57 0.30 0.00 1.25 0.00 0.00 42.46 42.29 2nut s ILE 290 CO -0.04 0.35 1.20 0.61 0.24 0.00 0.00 174.94 177.31 2nut n GLY 291 N 2.05 4.06 0.00 6.27 0.00 -1.26 -1.79 105.19 114.53 2nut n GLY 291 Ca -0.17 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.05 2nut n GLY 291 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nut n GLY 292 N -0.80 0.48 3.78 -0.02 0.00 -1.26 -4.59 105.19 102.78 2nut n GLY 292 Ca 0.14 -0.87 -0.33 0.00 0.00 0.00 0.00 46.02 44.95 2nut n GLY 292 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2nut s PRO 293 N -2.00 2.92 -0.02 1.61 0.04 -1.25 -4.85 135.00 131.44 2nut s PRO 293 Ca 0.00 1.37 -0.30 0.00 0.04 0.00 0.00 61.00 62.11 2nut s PRO 293 Cb 0.00 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.53 2nut s PRO 293 CO 0.00 -1.15 1.25 0.00 0.04 0.00 0.00 177.00 177.14 2nut s ALA 294 N -2.33 3.50 -0.15 8.56 0.00 -1.26 -4.68 121.76 125.40 2nut s ALA 294 Ca 0.67 0.72 0.18 0.00 0.00 0.00 0.00 51.96 53.53 2nut s ALA 294 Cb -0.20 -3.53 0.38 0.00 0.00 0.00 0.00 23.12 19.77 2nut s ALA 294 CO 0.40 -0.76 1.25 0.25 0.00 0.00 0.00 175.76 176.90 2nut n THR 295 N 4.53 2.05 -3.14 0.00 -2.24 -0.45 -0.80 114.28 114.23 2nut n THR 295 Ca 0.11 -2.21 -0.00 0.00 -2.27 0.00 0.00 64.05 59.68 2nut n THR 295 Cb 0.45 -0.25 -0.01 0.00 -2.10 0.00 0.00 70.33 68.43 2nut n THR 295 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 2nut s GLN 296 N -2.89 0.86 1.07 -0.78 0.74 -1.21 -4.59 119.66 112.86 2nut s GLN 296 Ca 0.36 -0.42 -0.16 0.00 0.05 0.00 0.00 55.36 55.19 2nut s GLN 296 Cb 0.31 0.05 0.15 0.00 1.10 0.00 0.00 33.01 34.62 2nut s GLN 296 CO 0.04 -1.21 0.18 0.41 -0.55 0.00 0.00 175.29 174.16 2nut n GLY 297 N 4.16 -2.59 3.71 2.59 0.00 -1.26 -4.58 105.19 107.22 2nut n GLY 297 Ca 0.12 -0.84 -0.43 0.00 0.00 0.00 0.00 46.02 44.87 2nut n GLY 297 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2nut n PRO 298 N -1.98 2.50 0.00 1.61 -0.02 -1.26 -4.60 135.00 131.25 2nut n PRO 298 Ca 0.04 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 2nut n PRO 298 Cb 0.47 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 2nut n PRO 298 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2nut n GLY 299 N 2.93 0.54 3.56 -1.23 0.00 -1.26 -3.79 105.19 105.94 2nut n GLY 299 Ca 0.13 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.70 2nut n GLY 299 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2nut n MET 300 N -1.69 1.16 -0.00 1.61 1.56 -1.26 -4.75 117.12 113.75 2nut n MET 300 Ca 0.00 0.41 0.00 0.00 -0.27 0.00 0.00 57.70 57.84 2nut n MET 300 Cb 0.00 -1.73 -0.01 0.00 2.15 0.00 0.00 33.22 33.64 2nut n MET 300 CO 0.00 0.00 0.00 0.28 -0.73 0.00 0.00 175.97 175.52 2nut n VAL 301 N 0.19 0.01 -3.55 1.12 0.31 0.02 -4.46 118.33 111.97 2nut n VAL 301 Ca 0.11 -0.03 -0.14 0.00 -0.01 0.00 0.00 64.34 64.27 2nut n VAL 301 Cb 0.31 0.26 -0.06 0.00 -0.91 0.00 0.00 33.84 33.44 2nut n VAL 301 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2nut s VAL 302 N -2.07 0.00 1.23 2.52 0.11 -1.19 -4.76 120.40 116.25 2nut s VAL 302 Ca -0.00 0.00 -0.21 0.00 -2.93 0.00 0.00 61.98 58.84 2nut s VAL 302 Cb 0.01 -1.00 0.31 0.00 -1.53 0.00 0.00 36.38 34.17 2nut s VAL 302 CO 0.05 0.00 0.97 0.61 -3.33 0.00 0.00 175.10 173.40 2nut n GLY 303 N 0.82 -3.10 1.00 6.54 0.00 -1.26 -4.28 105.19 104.91 2nut n GLY 303 Ca -0.14 -1.43 0.10 0.00 0.00 0.00 0.00 46.02 44.55 2nut n GLY 303 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2nut n ASP 304 N -5.04 2.94 -4.58 1.61 5.75 -1.26 -4.85 116.55 111.12 2nut n ASP 304 Ca 0.14 -1.95 -0.41 0.00 -0.01 0.00 0.00 54.79 52.55 2nut n ASP 304 Cb 0.56 -0.31 -0.07 0.00 -1.03 0.00 0.00 41.12 40.28 2nut n ASP 304 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 2nut s GLU 305 N -1.38 3.76 0.42 0.11 0.41 -1.26 -0.10 118.70 120.65 2nut s GLU 305 Ca 0.37 0.13 0.11 0.00 -0.41 0.00 0.00 54.97 55.17 2nut s GLU 305 Cb 0.20 -3.78 0.95 0.00 -1.78 0.00 0.00 34.13 29.73 2nut s GLU 305 CO 0.27 -0.67 2.01 -0.07 -0.49 0.00 0.00 175.26 176.31 2nut h LEU 306 N 9.29 0.42 -2.32 1.80 3.38 -1.13 -1.80 115.31 124.94 2nut h LEU 306 Ca -0.27 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.74 2nut h LEU 306 Cb 1.11 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.77 2nut h LEU 306 CO 0.82 0.27 0.19 0.07 0.09 0.00 0.00 178.44 179.88 2nut h LYS 307 N 0.48 0.00 -4.69 1.13 2.10 -1.93 -3.38 116.57 110.28 2nut h LYS 307 Ca 0.23 0.00 -0.68 0.00 -2.00 0.00 0.00 60.65 58.20 2nut h LYS 307 Cb 0.31 0.00 -0.20 0.00 -0.90 0.00 0.00 32.23 31.44 2nut h LYS 307 CO -0.06 0.00 -0.48 0.99 -2.00 0.00 0.00 179.45 177.89 2nut s THR 308 N -4.46 5.18 0.66 0.07 2.01 -0.68 -5.08 115.64 113.34 2nut s THR 308 Ca -0.04 -0.32 -0.16 0.00 0.31 0.00 0.00 61.69 61.48 2nut s THR 308 Cb 0.14 -3.69 0.00 0.00 0.01 0.00 0.00 72.50 68.96 2nut s THR 308 CO 0.48 -0.05 1.14 -2.16 -0.69 0.00 0.00 174.62 173.34 2nut s PRO 309 N 1.70 2.71 0.49 4.92 0.04 -1.26 -4.88 135.00 138.72 2nut s PRO 309 Ca 0.06 1.52 -0.22 0.00 0.04 0.00 0.00 61.00 62.40 2nut s PRO 309 Cb -0.18 -1.93 -0.07 0.00 0.04 0.00 0.00 34.50 32.37 2nut s PRO 309 CO 0.10 -1.34 1.14 0.42 0.04 0.00 0.00 177.00 177.35 2nut s ILE 310 N -2.16 3.22 0.45 0.56 1.09 -1.26 -4.93 121.20 118.17 2nut s ILE 310 Ca 0.70 0.85 -0.23 0.00 -1.10 0.00 0.00 60.65 60.87 2nut s ILE 310 Cb -0.23 -3.40 -0.10 0.00 -1.06 0.00 0.00 42.46 37.67 2nut s ILE 310 CO 0.40 -0.08 0.96 -2.11 -0.10 0.00 0.00 174.94 174.02 2nut n ARG 311 N -0.77 1.22 -4.20 2.79 0.00 -1.26 -5.03 116.66 109.41 2nut n ARG 311 Ca 0.09 0.44 -0.25 0.00 -0.00 0.00 0.00 57.85 58.13 2nut n ARG 311 Cb 0.49 -2.02 -0.08 0.00 -0.00 0.00 0.00 32.46 30.86 2nut n ARG 311 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 2nut s SER 312 N -0.83 4.35 0.30 2.89 1.04 -1.26 -4.73 113.70 115.46 2nut s SER 312 Ca 0.65 -1.13 0.01 0.00 0.48 0.00 0.00 55.95 55.96 2nut s SER 312 Cb -0.54 -0.44 0.48 0.00 0.10 0.00 0.00 66.02 65.62 2nut s SER 312 CO 0.56 -0.55 1.86 -0.50 0.98 0.00 0.00 173.24 175.59 2nut h TRP 313 N 1.46 0.77 -0.45 5.02 -0.00 -1.95 -1.31 115.95 119.49 2nut h TRP 313 Ca -0.43 -0.06 -0.02 0.00 -0.00 0.00 0.00 58.89 58.38 2nut h TRP 313 Cb 1.25 -0.23 -0.02 0.00 -0.00 0.00 0.00 29.16 30.16 2nut h TRP 313 CO 0.66 0.65 0.22 1.25 -0.00 0.00 0.00 178.44 181.21 2nut h HIS 314 N 0.73 0.66 -0.49 0.49 2.76 -1.95 -1.03 115.15 116.32 2nut h HIS 314 Ca 0.17 -0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.30 2nut h HIS 314 Cb 0.26 -0.20 -0.02 0.00 1.55 0.00 0.00 27.41 28.99 2nut h HIS 314 CO 0.01 0.53 0.28 -0.44 -1.30 0.00 0.00 177.93 177.01 2nut h ASP 315 N 0.59 0.59 -0.20 3.26 3.32 -1.69 -2.10 116.42 120.19 2nut h ASP 315 Ca 0.16 -0.03 -0.17 0.00 0.02 0.00 0.00 57.03 57.00 2nut h ASP 315 Cb 0.12 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 39.52 2nut h ASP 315 CO -0.02 0.47 -0.50 0.40 -1.72 0.00 0.00 179.24 177.87 2nut h ILE 316 N 0.68 1.29 -0.05 0.35 5.03 -0.66 0.35 117.51 124.50 2nut h ILE 316 Ca 0.18 -1.69 -0.15 0.00 -0.12 0.00 0.00 64.86 63.08 2nut h ILE 316 Cb 0.00 1.60 -0.01 0.00 -3.03 0.00 0.00 36.82 35.38 2nut h ILE 316 CO -0.03 0.55 -0.62 -0.78 -0.68 0.00 0.00 178.15 176.59 2nut h ASP 317 N 0.61 0.22 -0.59 1.72 1.82 -0.70 -2.98 116.42 116.51 2nut h ASP 317 Ca 0.03 -0.13 -0.18 0.00 -0.39 0.00 0.00 57.03 56.36 2nut h ASP 317 Cb 1.07 -0.06 -0.11 0.00 0.68 0.00 0.00 39.33 40.91 2nut h ASP 317 CO 0.11 0.78 0.23 0.29 -1.61 0.00 0.00 179.24 179.04 2nut n LYS 318 N -3.85 3.04 -4.01 0.28 5.02 -0.84 -4.91 118.16 112.90 2nut n LYS 318 Ca -0.02 -2.35 -0.29 0.00 -2.02 0.00 0.00 58.31 53.63 2nut n LYS 318 Cb 0.63 -2.00 -0.01 0.00 -0.02 0.00 0.00 35.03 33.63 2nut n LYS 318 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2nut n ASP 319 N -0.09 -1.99 -2.92 4.39 8.00 -1.13 -4.91 116.55 117.90 2nut n ASP 319 Ca 0.32 -0.96 -0.26 0.00 0.71 0.00 0.00 54.79 54.61 2nut n ASP 319 Cb 1.17 -3.19 -0.04 0.00 -0.02 0.00 0.00 41.12 39.05 2nut n ASP 319 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2nut n ASN 320 N -2.87 4.17 -2.79 -2.24 4.05 0.12 -4.82 115.26 110.88 2nut n ASN 320 Ca -0.14 -3.62 -0.08 0.00 0.45 0.00 0.00 54.58 51.19 2nut n ASN 320 Cb 0.60 -0.56 0.03 0.00 1.23 0.00 0.00 39.78 41.08 2nut n ASN 320 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2nut n ALA 321 N -0.22 -1.31 0.16 5.20 0.00 -1.25 -4.58 120.51 118.51 2nut n ALA 321 Ca 0.31 -1.39 0.02 0.00 0.00 0.00 0.00 53.44 52.38 2nut n ALA 321 Cb 0.44 -1.36 0.09 0.00 0.00 0.00 0.00 19.45 18.62 2nut n ALA 321 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2nut n LYS 322 N 2.17 0.03 -0.03 0.00 2.85 -1.26 -3.02 118.16 118.90 2nut n LYS 322 Ca 0.14 0.33 0.03 0.00 -1.05 0.00 0.00 58.31 57.76 2nut n LYS 322 Cb 0.59 -1.50 -0.13 0.00 -0.65 0.00 0.00 35.03 33.34 2nut n LYS 322 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2nut n TYR 323 N -1.38 0.00 -0.18 5.58 4.02 -1.26 -4.75 117.16 119.18 2nut n TYR 323 Ca 0.01 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.78 2nut n TYR 323 Cb 0.04 -0.53 -0.09 0.00 -0.02 0.00 0.00 39.34 38.74 2nut n TYR 323 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 2nut h VAL 324 N 0.00 0.02 -0.22 -0.72 2.07 -1.83 -1.67 116.25 113.89 2nut h VAL 324 Ca -0.14 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 2nut h VAL 324 Cb 1.19 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 2nut h VAL 324 CO 0.01 0.00 0.09 0.11 0.02 0.00 0.00 177.57 177.80 2nut h LYS 325 N -0.32 0.33 -0.11 1.57 1.57 -1.85 0.51 116.57 118.27 2nut h LYS 325 Ca 0.10 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.73 2nut h LYS 325 Cb 0.57 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 2nut h LYS 325 CO -0.65 0.39 -0.35 -0.22 -0.57 0.00 0.00 179.45 178.05 2nut h LYS 326 N 0.21 0.22 -0.25 3.15 3.64 -1.85 -1.16 116.57 120.53 2nut h LYS 326 Ca 0.07 -0.09 -0.19 0.00 -1.27 0.00 0.00 60.65 59.17 2nut h LYS 326 Cb 0.18 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 2nut h LYS 326 CO -0.01 0.55 -0.60 0.78 -2.27 0.00 0.00 179.45 177.90 2nut h GLY 327 N 1.12 0.89 1.50 5.01 0.00 -1.13 -2.52 103.07 107.95 2nut h GLY 327 Ca 0.02 -1.09 -0.09 0.00 0.00 0.00 0.00 47.33 46.18 2nut h GLY 327 CO 0.05 0.97 -0.16 -0.84 0.00 0.00 0.00 176.54 176.57 2nut h THR 328 N 0.61 1.25 -0.44 4.70 2.02 -0.63 -2.82 112.91 117.60 2nut h THR 328 Ca -0.00 -1.15 -0.05 0.00 0.77 0.00 0.00 66.41 65.98 2nut h THR 328 Cb 1.20 1.17 -0.02 0.00 -1.74 0.00 0.00 68.15 68.77 2nut h THR 328 CO 0.13 0.38 0.09 0.50 0.37 0.00 0.00 175.52 176.99 2nut h LYS 329 N 0.53 0.72 -0.39 6.66 3.64 -1.10 -1.66 116.57 124.97 2nut h LYS 329 Ca 0.09 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 2nut h LYS 329 Cb 0.58 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 2nut h LYS 329 CO 0.04 0.73 0.26 1.25 -2.27 0.00 0.00 179.45 179.46 2nut h HIS 330 N 0.59 0.49 -0.04 1.91 2.76 -1.25 -2.39 115.15 117.22 2nut h HIS 330 Ca 0.14 0.01 -0.16 0.00 -2.20 0.00 0.00 60.37 58.16 2nut h HIS 330 Cb 0.35 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 29.13 2nut h HIS 330 CO 0.02 0.31 -0.70 0.74 -1.30 0.00 0.00 177.93 177.00 2nut h PHE 331 N 0.53 0.26 -0.32 5.26 -1.00 -1.45 -2.67 116.94 117.55 2nut h PHE 331 Ca 0.14 -0.11 -0.05 0.00 2.81 0.00 0.00 57.97 60.75 2nut h PHE 331 Cb -0.06 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 39.44 2nut h PHE 331 CO -0.05 0.83 -0.04 0.93 -1.61 0.00 0.00 178.31 178.37 2nut h GLU 332 N 0.13 0.50 -0.27 1.51 5.08 -1.17 0.23 114.58 120.59 2nut h GLU 332 Ca -0.02 -0.12 -0.12 0.00 -1.00 0.00 0.00 59.36 58.11 2nut h GLU 332 Cb 1.25 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 2nut h GLU 332 CO 0.11 0.56 -0.29 0.00 -1.00 0.00 0.00 179.01 178.38 2nut h ALA 333 N 1.49 0.39 -0.48 3.43 0.00 -1.33 -2.15 119.26 120.61 2nut h ALA 333 Ca 0.10 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 2nut h ALA 333 Cb 0.37 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2nut h ALA 333 CO 0.02 0.41 0.21 -0.07 0.00 0.00 0.00 179.25 179.82 2nut h LEU 334 N 0.39 0.64 -0.22 0.00 3.38 -1.07 -0.99 115.31 117.44 2nut h LEU 334 Ca 0.04 -0.15 0.05 0.00 0.09 0.00 0.00 57.88 57.92 2nut h LEU 334 Cb 0.86 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.39 2nut h LEU 334 CO 0.07 0.61 -0.15 0.00 0.09 0.00 0.00 178.44 179.06 2nut h ALA 335 N 1.06 0.02 -0.04 1.53 0.00 -0.48 0.99 119.26 122.35 2nut h ALA 335 Ca 0.16 0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.08 2nut h ALA 335 Cb 0.15 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2nut h ALA 335 CO -0.02 -0.57 -0.36 -0.91 0.00 0.00 0.00 179.25 177.40 2nut h ASN 336 N -0.14 0.07 -0.12 0.00 -0.26 -1.23 0.26 115.58 114.16 2nut h ASN 336 Ca 0.13 -0.02 -0.02 0.00 -0.56 0.00 0.00 56.30 55.82 2nut h ASN 336 Cb 0.33 -0.02 -0.00 0.00 -1.06 0.00 0.00 38.32 37.57 2nut h ASN 336 CO -0.31 0.42 -0.00 0.03 -1.06 0.00 0.00 177.43 176.51 2nut h ARG 337 N 0.06 0.21 0.15 0.81 3.08 -0.25 -0.78 114.38 117.65 2nut h ARG 337 Ca 0.01 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 59.98 2nut h ARG 337 Cb 0.66 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.70 2nut h ARG 337 CO 0.05 0.46 -0.07 0.00 -1.07 0.00 0.00 179.97 179.34 2nut h ALA 338 N 0.74 -0.20 -0.46 0.04 0.00 -0.53 -1.87 119.26 116.98 2nut h ALA 338 Ca 0.03 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.89 2nut h ALA 338 Cb 0.37 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 2nut h ALA 338 CO 0.01 -0.51 0.31 0.00 0.00 0.00 0.00 179.25 179.06 2nut h ALA 339 N 0.42 2.02 -0.07 0.00 0.00 -0.52 -0.20 119.26 120.91 2nut h ALA 339 Ca -0.02 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 2nut h ALA 339 Cb 0.32 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2nut h ALA 339 CO 0.03 -0.11 -0.66 1.15 0.00 0.00 0.00 179.25 179.66 2nut h THR 340 N 0.32 1.39 -0.01 0.00 2.02 -0.94 -2.84 112.91 112.85 2nut h THR 340 Ca 0.21 -2.07 0.00 0.00 0.77 0.00 0.00 66.41 65.31 2nut h THR 340 Cb 0.40 2.06 0.00 0.00 -1.74 0.00 0.00 68.15 68.87 2nut h THR 340 CO -0.05 0.62 -0.07 0.41 0.37 0.00 0.00 175.52 176.80 2nut n THR 341 N -3.85 0.00 -1.93 3.16 -1.04 -0.37 -4.91 114.28 105.34 2nut n THR 341 Ca -0.03 -0.15 -0.03 0.00 -2.04 0.00 0.00 64.05 61.80 2nut n THR 341 Cb 0.66 0.22 -0.00 0.00 -1.82 0.00 0.00 70.33 69.38 2nut n THR 341 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2nut n GLY 342 N 1.20 0.30 3.63 3.41 0.00 -0.24 -0.84 105.19 112.65 2nut n GLY 342 Ca 0.18 -0.80 -0.31 0.00 0.00 0.00 0.00 46.02 45.08 2nut n GLY 342 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2nut s HIS 343 N -2.13 2.93 -0.06 1.61 4.02 -0.31 -4.45 115.29 116.90 2nut s HIS 343 Ca 0.00 -0.03 -0.08 0.00 1.02 0.00 0.00 55.06 55.97 2nut s HIS 343 Cb 0.00 -1.58 -0.05 0.00 -1.02 0.00 0.00 32.58 29.93 2nut s HIS 343 CO 0.00 0.42 0.23 0.08 1.02 0.00 0.00 174.74 176.49 2nut s VAL 344 N -1.11 5.35 -0.16 -0.90 1.01 -0.87 -4.01 120.40 119.71 2nut s VAL 344 Ca 0.20 0.32 0.02 0.00 0.00 0.00 0.00 61.98 62.51 2nut s VAL 344 Cb -0.11 -3.51 0.01 0.00 0.00 0.00 0.00 36.38 32.77 2nut s VAL 344 CO 0.11 0.54 -0.20 -0.63 0.00 0.00 0.00 175.10 174.92 2nut s ILE 345 N -1.12 2.15 0.01 2.22 1.09 -1.26 -0.87 121.20 123.42 2nut s ILE 345 Ca 0.20 -0.93 0.02 0.00 -1.10 0.00 0.00 60.65 58.84 2nut s ILE 345 Cb -0.13 -1.88 -0.04 0.00 -1.06 0.00 0.00 42.46 39.35 2nut s ILE 345 CO 0.10 0.54 0.01 -1.81 -0.10 0.00 0.00 174.94 173.68 2nut s ASP 346 N 1.01 5.18 -0.20 3.58 1.01 0.15 -3.89 116.67 123.51 2nut s ASP 346 Ca -0.02 -0.02 -0.00 0.00 0.71 0.00 0.00 52.55 53.22 2nut s ASP 346 Cb -0.15 -1.35 0.05 0.00 1.01 0.00 0.00 42.92 42.48 2nut s ASP 346 CO -0.06 0.26 -0.04 -0.63 0.21 0.00 0.00 175.17 174.91 2nut s ILE 347 N -1.14 1.24 -0.39 0.77 -1.09 -0.33 -0.84 121.20 119.42 2nut s ILE 347 Ca 0.21 -0.89 -0.08 0.00 -2.23 0.00 0.00 60.65 57.67 2nut s ILE 347 Cb -0.12 -1.49 0.07 0.00 -1.58 0.00 0.00 42.46 39.34 2nut s ILE 347 CO 0.12 -0.01 0.19 -0.31 -1.23 0.00 0.00 174.94 173.71 2nut s TYR 348 N 1.55 3.33 -0.29 3.97 1.51 0.23 -1.41 117.35 126.24 2nut s TYR 348 Ca -0.02 -1.56 -0.00 0.00 -1.01 0.00 0.00 57.07 54.48 2nut s TYR 348 Cb -0.17 -2.71 0.05 0.00 -0.11 0.00 0.00 41.96 39.02 2nut s TYR 348 CO -0.07 -0.81 -0.03 0.00 -1.11 0.00 0.00 175.55 173.53 2nut s ALA 349 N 1.39 2.74 -0.13 3.71 0.00 0.56 -0.85 121.76 129.18 2nut s ALA 349 Ca 0.02 -1.77 -0.00 0.00 0.00 0.00 0.00 51.96 50.20 2nut s ALA 349 Cb -0.22 -1.83 0.03 0.00 0.00 0.00 0.00 23.12 21.10 2nut s ALA 349 CO 0.02 -1.25 -0.09 0.00 0.00 0.00 0.00 175.76 174.44 2nut s ALA 351 N 1.64 -1.72 0.10 0.00 0.00 -1.17 -4.20 121.76 116.41 2nut s ALA 351 Ca 0.04 0.72 0.16 0.00 0.00 0.00 0.00 51.96 52.88 2nut s ALA 351 Cb -0.13 0.59 0.42 0.00 0.00 0.00 0.00 23.12 24.00 2nut s ALA 351 CO -0.09 -0.76 1.61 -0.07 0.00 0.00 0.00 175.76 176.45 2nut h LEU 352 N 2.00 0.00-10.39 0.00 3.38 -1.85 -3.38 115.31 105.07 2nut h LEU 352 Ca -0.26 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 57.12 2nut h LEU 352 Cb 1.26 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.96 2nut h LEU 352 CO 0.32 0.49 -0.28 -1.81 0.09 0.00 0.00 178.44 177.25 2nut s ASP 353 N -6.51 4.61 0.68 -0.43 1.01 -1.26 -5.07 116.67 109.71 2nut s ASP 353 Ca 0.01 -1.29 -0.16 0.00 0.71 0.00 0.00 52.55 51.82 2nut s ASP 353 Cb 0.10 0.54 0.01 0.00 1.01 0.00 0.00 42.92 44.59 2nut s ASP 353 CO 0.72 -1.17 1.19 -1.10 0.21 0.00 0.00 175.17 175.02 2nut s GLN 354 N -4.32 2.46 0.00 8.23 -0.21 -1.26 -4.96 119.66 119.60 2nut s GLN 354 Ca 0.33 1.72 0.04 0.00 0.02 0.00 0.00 55.36 57.47 2nut s GLN 354 Cb -0.03 -1.88 -0.02 0.00 1.00 0.00 0.00 33.01 32.09 2nut s GLN 354 CO 0.21 -1.58 0.31 -2.37 -2.12 0.00 0.00 175.29 169.73 2nut n THR 355 N -2.39 0.00 -0.37 -0.19 5.66 -1.26 -3.83 114.28 111.91 2nut n THR 355 Ca 0.13 -0.44 0.00 0.00 -3.05 0.00 0.00 64.05 60.69 2nut n THR 355 Cb 0.50 1.03 0.00 0.00 -1.55 0.00 0.00 70.33 70.31 2nut n THR 355 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2nut n GLY 356 N 0.84 1.48 0.22 1.09 0.00 -1.26 -4.09 105.19 103.47 2nut n GLY 356 Ca 0.01 -0.19 0.07 0.00 0.00 0.00 0.00 46.02 45.91 2nut n GLY 356 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2nut h LEU 357 N 0.00 0.00 -0.43 0.99 3.38 -1.93 -2.47 115.31 114.85 2nut h LEU 357 Ca 0.00 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.99 2nut h LEU 357 Cb 0.16 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 2nut h LEU 357 CO 0.00 0.25 0.26 0.25 0.09 0.00 0.00 178.44 179.29 2nut h LEU 358 N 0.00 0.43 -0.58 1.67 5.85 -1.87 0.17 115.31 120.97 2nut h LEU 358 Ca -0.00 -0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.60 2nut h LEU 358 Cb 0.54 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2nut h LEU 358 CO 0.03 0.31 -0.55 -0.33 -0.34 0.00 0.00 178.44 177.56 2nut h GLU 359 N 0.53 0.00 -0.00 1.25 3.07 -1.85 -3.30 114.58 114.28 2nut h GLU 359 Ca 0.17 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.03 2nut h GLU 359 Cb -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.90 2nut h GLU 359 CO -0.07 0.55 -0.83 -1.33 -1.40 0.00 0.00 179.01 175.93 2nut n MET 360 N -3.51 0.26 -0.32 2.33 2.81 -0.96 -4.36 117.12 113.36 2nut n MET 360 Ca 0.00 -0.21 0.21 0.00 -1.81 0.00 0.00 57.70 55.90 2nut n MET 360 Cb 0.64 -1.50 0.42 0.00 -0.71 0.00 0.00 33.22 32.08 2nut n MET 360 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 2nut h LYS 361 N 0.50 0.15 -0.45 0.03 2.10 -0.75 -1.74 116.57 116.41 2nut h LYS 361 Ca 0.00 -0.01 0.06 0.00 -2.00 0.00 0.00 60.65 58.70 2nut h LYS 361 Cb 0.55 -0.03 -0.03 0.00 -0.90 0.00 0.00 32.23 31.82 2nut h LYS 361 CO 0.00 0.10 0.30 0.00 -2.00 0.00 0.00 179.45 177.85 2nut h PRO 364 N -1.03 0.00 -0.17 0.00 0.13 -1.63 -2.46 132.00 126.83 2nut h PRO 364 Ca -0.08 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.95 2nut h PRO 364 Cb 0.85 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.98 2nut h PRO 364 CO 0.04 0.43 -0.26 -0.91 -0.23 0.00 0.00 178.00 177.06 2nut h ASN 365 N 0.00 0.53 -0.10 1.44 2.35 -0.69 -2.68 115.58 116.43 2nut h ASN 365 Ca -0.00 -0.52 -0.13 0.00 -0.55 0.00 0.00 56.30 55.09 2nut h ASN 365 Cb 0.82 -0.15 0.01 0.00 0.05 0.00 0.00 38.32 39.05 2nut h ASN 365 CO 0.06 0.95 -0.44 -0.07 -1.65 0.00 0.00 177.43 176.28 2nut h LEU 366 N 0.13 0.57-10.42 1.61 3.38 0.15 -3.35 115.31 107.38 2nut h LEU 366 Ca 0.02 -0.63 -0.47 0.00 0.09 0.00 0.00 57.88 56.88 2nut h LEU 366 Cb 0.84 -0.17 0.05 0.00 0.09 0.00 0.00 40.66 41.47 2nut h LEU 366 CO 0.06 1.11 0.12 0.42 0.09 0.00 0.00 178.44 180.24 2nut s THR 367 N -3.72 3.72 -0.20 0.22 -4.23 -0.93 -3.30 115.64 107.20 2nut s THR 367 Ca -0.13 -0.10 0.01 0.00 -1.18 0.00 0.00 61.69 60.29 2nut s THR 367 Cb 0.05 -3.46 0.20 0.00 1.34 0.00 0.00 72.50 70.63 2nut s THR 367 CO 0.81 -0.44 1.22 0.61 -0.54 0.00 0.00 174.62 176.28 2nut n GLY 368 N -2.47 2.63 3.68 3.99 0.00 -1.24 -4.63 105.19 107.15 2nut n GLY 368 Ca 0.04 -0.31 -0.30 0.00 0.00 0.00 0.00 46.02 45.45 2nut n GLY 368 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2nut s GLY 369 N 0.28 1.63 0.31 -0.02 0.00 -1.01 -4.63 107.32 103.87 2nut s GLY 369 Ca 0.16 0.11 -0.04 0.00 0.00 0.00 0.00 44.72 44.96 2nut s GLY 369 CO 0.03 0.60 0.56 -0.19 0.00 0.00 0.00 173.10 174.10 2nut s TYR 370 N -2.80 3.49 -0.20 1.90 4.12 -1.25 -4.59 117.35 118.01 2nut s TYR 370 Ca 0.64 0.59 -0.01 0.00 0.02 0.00 0.00 57.07 58.31 2nut s TYR 370 Cb -0.20 -2.07 0.05 0.00 -1.52 0.00 0.00 41.96 38.23 2nut s TYR 370 CO 0.58 0.15 -0.02 1.41 0.02 0.00 0.00 175.55 177.68 2nut s MET 371 N -3.74 1.25 -0.13 -0.62 1.75 -1.26 -1.19 119.30 115.36 2nut s MET 371 Ca 0.43 -0.65 0.01 0.00 -1.25 0.00 0.00 55.69 54.23 2nut s MET 371 Cb -0.10 -2.24 -0.01 0.00 2.84 0.00 0.00 34.83 35.32 2nut s MET 371 CO 0.32 -0.56 -0.16 0.08 -0.65 0.00 0.00 175.02 174.05 2nut s VAL 372 N 1.62 2.68 -0.02 10.11 1.01 -0.50 -5.03 120.40 130.28 2nut s VAL 372 Ca -0.02 -0.78 0.05 0.00 0.00 0.00 0.00 61.98 61.23 2nut s VAL 372 Cb -0.17 -2.11 -0.01 0.00 0.00 0.00 0.00 36.38 34.09 2nut s VAL 372 CO -0.07 0.53 -0.18 -0.32 0.00 0.00 0.00 175.10 175.06 2nut s MET 373 N 0.49 1.51 0.01 2.72 -2.45 -1.26 -0.32 119.30 119.99 2nut s MET 373 Ca -0.11 -0.65 -0.00 0.00 -1.25 0.00 0.00 55.69 53.68 2nut s MET 373 Cb -0.16 -1.44 0.00 0.00 1.25 0.00 0.00 34.83 34.48 2nut s MET 373 CO 0.05 0.37 0.01 0.41 1.05 0.00 0.00 175.02 176.91 2nut n GLY 374 N 2.69 2.34 0.08 2.11 0.00 -0.74 -5.00 105.19 106.67 2nut n GLY 374 Ca -0.15 -1.13 -0.05 0.00 0.00 0.00 0.00 46.02 44.69 2nut n GLY 374 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2nut n ASP 375 N -1.36 0.01 -3.57 1.61 8.00 -1.26 -3.08 116.55 116.89 2nut n ASP 375 Ca -0.00 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.36 2nut n ASP 375 Cb 0.01 1.25 -0.06 0.00 -0.02 0.00 0.00 41.12 42.30 2nut n ASP 375 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2nut s SER 376 N -5.25 -0.60 0.44 -2.24 0.15 -1.26 -3.04 113.70 101.91 2nut s SER 376 Ca -0.09 0.85 0.29 0.00 0.70 0.00 0.00 55.95 57.70 2nut s SER 376 Cb 0.08 0.76 1.09 0.00 -1.71 0.00 0.00 66.02 66.24 2nut s SER 376 CO 0.85 -0.41 1.85 -0.26 1.20 0.00 0.00 173.24 176.47 2nut h PHE 377 N 3.54 0.00 -1.00 3.44 -1.00 -1.83 -3.29 116.94 116.79 2nut h PHE 377 Ca -0.26 0.00 -0.53 0.00 2.81 0.00 0.00 57.97 59.99 2nut h PHE 377 Cb 1.15 0.00 -0.16 0.00 3.61 0.00 0.00 35.95 40.56 2nut h PHE 377 CO 0.36 0.00 0.76 -1.71 -1.61 0.00 0.00 178.31 176.11 2nut n ASN 378 N -2.82 6.71 -4.13 2.17 5.15 -1.26 -4.48 115.26 116.60 2nut n ASN 378 Ca 0.02 -3.14 -0.09 0.00 -0.60 0.00 0.00 54.58 50.77 2nut n ASN 378 Cb 0.33 -1.27 -0.10 0.00 -0.53 0.00 0.00 39.78 38.20 2nut n ASN 378 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2nut s THR 379 N -1.79 0.48 0.25 -0.44 -4.23 -1.24 -5.04 115.64 103.64 2nut s THR 379 Ca 0.59 -1.88 -0.02 0.00 -1.18 0.00 0.00 61.69 59.20 2nut s THR 379 Cb 0.34 -1.60 0.09 0.00 1.34 0.00 0.00 72.50 72.66 2nut s THR 379 CO -0.18 -0.93 1.72 0.28 -0.54 0.00 0.00 174.62 174.97 2nut h SER 380 N 3.06 0.73 0.09 3.99 0.02 -1.92 -2.62 113.55 116.90 2nut h SER 380 Ca -0.35 -0.20 0.02 0.00 -0.84 0.00 0.00 61.79 60.42 2nut h SER 380 Cb 1.15 -0.20 -0.05 0.00 0.14 0.00 0.00 62.40 63.45 2nut h SER 380 CO 0.65 0.85 -0.41 0.25 -1.14 0.00 0.00 176.83 177.03 2nut h LEU 381 N 0.68 -1.23 -0.23 5.07 5.85 -1.95 0.90 115.31 124.40 2nut h LEU 381 Ca 0.12 0.14 -0.05 0.00 0.84 0.00 0.00 57.88 58.93 2nut h LEU 381 Cb 0.55 0.47 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 2nut h LEU 381 CO 0.03 -0.48 -0.06 0.15 -0.34 0.00 0.00 178.44 177.74 2nut h PHE 382 N -0.63 0.51 -0.56 1.25 3.57 -1.83 -1.24 116.94 118.03 2nut h PHE 382 Ca 0.03 -0.11 0.05 0.00 3.53 0.00 0.00 57.97 61.47 2nut h PHE 382 Cb 0.67 -0.12 -0.05 0.00 2.79 0.00 0.00 35.95 39.24 2nut h PHE 382 CO -0.38 0.69 0.28 0.87 -2.23 0.00 0.00 178.31 177.55 2nut h LYS 383 N 0.19 0.52 -0.30 1.11 1.57 -1.30 0.33 116.57 118.69 2nut h LYS 383 Ca 0.06 -0.03 -0.16 0.00 -1.87 0.00 0.00 60.65 58.64 2nut h LYS 383 Cb 0.53 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.72 2nut h LYS 383 CO 0.02 0.34 -0.44 1.96 -0.57 0.00 0.00 179.45 180.76 2nut h GLN 384 N 0.54 0.84 -0.80 3.15 4.20 -0.81 -1.70 115.11 120.51 2nut h GLN 384 Ca 0.25 -0.49 -0.04 0.00 0.06 0.00 0.00 58.65 58.43 2nut h GLN 384 Cb 0.17 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.96 2nut h GLN 384 CO -0.18 1.13 0.36 1.15 -0.67 0.00 0.00 178.83 180.62 2nut h THR 385 N 0.61 1.26 -0.56 -0.54 2.02 -0.85 -1.62 112.91 113.23 2nut h THR 385 Ca 0.03 -0.75 -0.06 0.00 0.77 0.00 0.00 66.41 66.40 2nut h THR 385 Cb 1.04 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 67.69 2nut h THR 385 CO 0.10 0.32 0.12 0.15 0.37 0.00 0.00 175.52 176.58 2nut h PHE 386 N 1.15 0.95 0.00 3.16 3.57 -0.19 -2.43 116.94 123.16 2nut h PHE 386 Ca 0.27 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.65 2nut h PHE 386 Cb 0.16 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.63 2nut h PHE 386 CO 0.02 0.83 0.00 -0.56 -2.23 0.00 0.00 178.31 176.36 2nut h GLN 387 N 0.80 0.00 -0.28 1.11 3.07 -1.04 -2.76 115.11 116.02 2nut h GLN 387 Ca 0.17 0.00 -0.08 0.00 0.09 0.00 0.00 58.65 58.83 2nut h GLN 387 Cb 0.36 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.91 2nut h GLN 387 CO 0.00 0.00 -0.19 0.00 0.09 0.00 0.00 178.83 178.74 2nut h ARG 388 N 0.00 0.50 -1.11 0.06 2.47 -0.80 -2.65 114.38 112.85 2nut h ARG 388 Ca 0.00 -0.17 0.31 0.00 -1.26 0.00 0.00 59.98 58.87 2nut h ARG 388 Cb 0.62 -0.04 -0.11 0.00 -1.65 0.00 0.00 29.97 28.79 2nut h ARG 388 CO 0.00 0.67 0.70 0.28 0.56 0.00 0.00 179.97 182.18 2nut h VAL 389 N 0.46 0.40 -0.72 2.04 2.07 -1.34 -0.38 116.25 118.79 2nut h VAL 389 Ca 0.08 -0.11 -0.27 0.00 0.82 0.00 0.00 66.70 67.22 2nut h VAL 389 Cb 0.58 0.06 -0.16 0.00 -1.52 0.00 0.00 31.29 30.26 2nut h VAL 389 CO 0.04 0.06 0.30 0.49 0.02 0.00 0.00 177.57 178.48 2nut n PHE 390 N -4.68 2.33 -1.75 1.57 3.01 -1.00 -4.85 117.46 112.09 2nut n PHE 390 Ca 0.29 -1.38 -0.42 0.00 1.01 0.00 0.00 57.45 56.95 2nut n PHE 390 Cb 1.02 -0.70 -0.01 0.00 -0.01 0.00 0.00 39.48 39.78 2nut n PHE 390 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 2nut n THR 391 N -0.54 1.19 -4.12 4.37 -1.04 -0.15 -4.88 114.28 109.11 2nut n THR 391 Ca 0.43 -0.30 -0.22 0.00 -2.04 0.00 0.00 64.05 61.92 2nut n THR 391 Cb 1.38 -1.96 -0.05 0.00 -1.82 0.00 0.00 70.33 67.88 2nut n THR 391 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2nut s LYS 392 N -0.79 2.63 0.00 -2.82 1.02 -1.26 -2.83 119.74 115.69 2nut s LYS 392 Ca 0.62 -1.27 0.00 0.00 0.02 0.00 0.00 55.97 55.34 2nut s LYS 392 Cb -0.49 -2.38 0.00 0.00 -0.52 0.00 0.00 37.83 34.44 2nut s LYS 392 CO 0.51 0.30 0.00 -0.40 -0.92 0.00 0.00 175.35 174.85 2nut n ASP 393 N -1.12 0.00 -0.24 2.83 5.68 -0.20 -4.88 116.55 118.62 2nut n ASP 393 Ca -0.06 -0.53 0.00 0.00 -0.50 0.00 0.00 54.79 53.70 2nut n ASP 393 Cb 0.59 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.57 2nut n ASP 393 CO 0.00 0.00 0.00 0.23 -1.33 0.00 0.00 177.20 176.10 2nut n MET 394 N -0.53 0.56 0.00 0.11 2.81 -1.26 -2.05 117.12 116.77 2nut n MET 394 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 2nut n MET 394 Cb 0.00 -1.13 0.00 0.00 -0.71 0.00 0.00 33.22 31.38 2nut n MET 394 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 2nut n HIS 395 N -0.16 0.00 -1.17 2.03 8.25 -1.26 -5.00 115.22 117.91 2nut n HIS 395 Ca 0.00 -0.08 -0.02 0.00 -0.26 0.00 0.00 57.72 57.36 2nut n HIS 395 Cb 0.07 -0.01 -0.01 0.00 1.12 0.00 0.00 29.99 31.16 2nut n HIS 395 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2nut n GLY 396 N -0.08 0.51 3.45 -1.41 0.00 -0.87 -5.04 105.19 101.75 2nut n GLY 396 Ca 0.00 -0.97 -0.32 0.00 0.00 0.00 0.00 46.02 44.73 2nut n GLY 396 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2nut s GLN 397 N -2.40 2.28 0.53 1.61 -0.21 -1.26 -4.84 119.66 115.37 2nut s GLN 397 Ca 0.00 -0.84 -0.20 0.00 0.02 0.00 0.00 55.36 54.34 2nut s GLN 397 Cb 0.00 -2.26 -0.08 0.00 1.00 0.00 0.00 33.01 31.67 2nut s GLN 397 CO 0.00 0.58 0.79 1.19 -2.12 0.00 0.00 175.29 175.73 2nut n PHE 398 N 2.01 0.28 -1.34 0.91 0.99 -1.26 -1.03 117.46 118.02 2nut n PHE 398 Ca -0.17 0.48 -0.26 0.00 -0.00 0.00 0.00 57.45 57.50 2nut n PHE 398 Cb 0.52 -2.08 -0.00 0.00 -1.00 0.00 0.00 39.48 36.91 2nut n PHE 398 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 2nut n LYS 399 N -0.26 2.30 -4.20 -1.08 5.02 -1.13 -4.68 118.16 114.12 2nut n LYS 399 Ca 0.12 -2.36 -0.18 0.00 -2.02 0.00 0.00 58.31 53.87 2nut n LYS 399 Cb 0.45 -2.02 -0.12 0.00 -0.02 0.00 0.00 35.03 33.32 2nut n LYS 399 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2nut s MET 400 N -2.27 0.90 0.10 1.97 0.23 -1.26 -4.32 119.30 114.65 2nut s MET 400 Ca 0.51 -1.08 0.06 0.00 -1.03 0.00 0.00 55.69 54.14 2nut s MET 400 Cb 0.36 -0.83 -0.03 0.00 -1.53 0.00 0.00 34.83 32.79 2nut s MET 400 CO -0.16 0.17 -0.15 0.20 -2.03 0.00 0.00 175.02 173.05 2nut s GLY 401 N -2.08 1.03 0.15 3.16 0.00 0.30 -3.23 107.32 106.65 2nut s GLY 401 Ca 0.03 -1.17 0.07 0.00 0.00 0.00 0.00 44.72 43.65 2nut s GLY 401 CO 0.02 -1.21 -0.16 -1.36 0.00 0.00 0.00 173.10 170.40 2nut s PHE 402 N -1.61 1.61 -1.31 1.90 0.40 0.80 -2.07 117.98 117.70 2nut s PHE 402 Ca 0.04 -0.53 -0.11 0.00 -0.60 0.00 0.00 56.93 55.73 2nut s PHE 402 Cb -0.08 -0.81 0.00 0.00 0.51 0.00 0.00 43.02 42.65 2nut s PHE 402 CO 0.03 0.25 0.53 0.41 0.70 0.00 0.00 175.22 177.14 2nut n GLY 403 N 0.26 -0.53 3.71 4.36 0.00 -0.06 0.11 105.19 113.03 2nut n GLY 403 Ca -0.13 0.27 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2nut n GLY 403 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2nut s GLY 404 N -3.98 2.85 -0.23 -0.02 0.00 0.97 -4.39 107.32 102.52 2nut s GLY 404 Ca 0.21 0.44 -0.04 0.00 0.00 0.00 0.00 44.72 45.34 2nut s GLY 404 CO 0.90 1.53 -0.02 -1.59 0.00 0.00 0.00 173.10 173.92 2nut s THR 405 N 0.82 3.46 -0.26 0.90 2.01 0.11 0.97 115.64 123.65 2nut s THR 405 Ca 0.48 -0.54 -0.07 0.00 0.31 0.00 0.00 61.69 61.86 2nut s THR 405 Cb -0.20 -2.62 -0.02 0.00 0.01 0.00 0.00 72.50 69.66 2nut s THR 405 CO 0.26 0.36 0.07 -0.22 -0.69 0.00 0.00 174.62 174.40 2nut s LEU 406 N 1.48 3.51 -0.07 4.42 2.96 0.72 -1.13 118.68 130.57 2nut s LEU 406 Ca 0.05 -0.29 0.05 0.00 -0.22 0.00 0.00 54.13 53.72 2nut s LEU 406 Cb -0.15 -1.92 -0.01 0.00 0.50 0.00 0.00 46.19 44.62 2nut s LEU 406 CO -0.02 -0.06 -0.24 -0.70 -1.32 0.00 0.00 176.35 174.01 2nut s GLU 407 N 1.60 2.63 -0.09 1.98 2.12 0.01 -0.16 118.70 126.79 2nut s GLU 407 Ca 0.06 -0.86 0.03 0.00 0.36 0.00 0.00 54.97 54.56 2nut s GLU 407 Cb -0.15 -2.14 -0.01 0.00 0.26 0.00 0.00 34.13 32.08 2nut s GLU 407 CO 0.03 0.29 -0.18 0.42 -0.54 0.00 0.00 175.26 175.29 2nut s ILE 408 N 0.04 2.65 -0.09 -3.70 1.01 -0.59 -0.80 121.20 119.71 2nut s ILE 408 Ca -0.09 -0.83 0.04 0.00 0.00 0.00 0.00 60.65 59.77 2nut s ILE 408 Cb -0.15 -2.05 -0.00 0.00 0.01 0.00 0.00 42.46 40.27 2nut s ILE 408 CO 0.05 0.56 -0.24 -0.54 0.00 0.00 0.00 174.94 174.77 2nut s LYS 409 N -0.01 2.96 0.37 2.79 1.02 -0.43 -4.91 119.74 121.53 2nut s LYS 409 Ca -0.06 -0.88 0.05 0.00 0.02 0.00 0.00 55.97 55.10 2nut s LYS 409 Cb -0.15 -2.28 -0.07 0.00 -0.52 0.00 0.00 37.83 34.82 2nut s LYS 409 CO 0.05 0.22 0.04 0.95 -0.92 0.00 0.00 175.35 175.68 2nut s THR 410 N 0.24 1.54 0.69 2.17 -4.23 -1.26 -0.37 115.64 114.42 2nut s THR 410 Ca -0.16 -2.00 -0.15 0.00 -1.18 0.00 0.00 61.69 58.21 2nut s THR 410 Cb -0.17 -2.85 0.02 0.00 1.34 0.00 0.00 72.50 70.83 2nut s THR 410 CO 0.08 0.00 1.13 -0.44 -0.54 0.00 0.00 174.62 174.85 2nut s SER 411 N -3.61 4.79 0.62 3.99 0.01 -1.00 -4.87 113.70 113.64 2nut s SER 411 Ca 0.34 2.08 0.30 0.00 1.31 0.00 0.00 55.95 59.99 2nut s SER 411 Cb 0.09 -2.56 1.66 0.00 0.21 0.00 0.00 66.02 65.42 2nut s SER 411 CO 0.16 -1.85 2.00 0.08 0.41 0.00 0.00 173.24 174.04 2nut h ARG 412 N -0.17 0.00 0.00 12.44 0.11 -1.94 0.43 114.38 125.24 2nut h ARG 412 Ca -0.47 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.61 2nut h ARG 412 Cb 1.26 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.34 2nut h ARG 412 CO 0.52 0.00 -0.13 0.39 0.10 0.00 0.00 179.97 180.85 2nut n GLU 413 N -3.39 0.12 -4.66 0.08 4.71 -1.26 -4.85 120.64 111.38 2nut n GLU 413 Ca 0.02 0.08 -0.33 0.00 -0.01 0.00 0.00 57.16 56.91 2nut n GLU 413 Cb 0.42 -1.62 -0.12 0.00 -1.01 0.00 0.00 31.44 29.10 2nut n GLU 413 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2nut s ILE 414 N -3.05 3.48 0.22 -3.67 -1.09 0.14 -1.15 121.20 116.08 2nut s ILE 414 Ca 0.12 -0.54 0.09 0.00 -2.23 0.00 0.00 60.65 58.09 2nut s ILE 414 Cb 0.16 -2.45 -0.05 0.00 -1.58 0.00 0.00 42.46 38.55 2nut s ILE 414 CO 0.59 0.56 -0.16 -0.54 -1.23 0.00 0.00 174.94 174.16 2nut s LYS 415 N -0.25 1.43 -0.24 2.79 1.02 0.10 -4.57 119.74 120.03 2nut s LYS 415 Ca 0.03 -1.63 -0.05 0.00 0.02 0.00 0.00 55.97 54.33 2nut s LYS 415 Cb -0.13 -1.32 -0.01 0.00 -0.52 0.00 0.00 37.83 35.85 2nut s LYS 415 CO 0.03 0.23 -0.00 0.42 -0.92 0.00 0.00 175.35 175.11 2nut s ILE 416 N -2.80 3.67 0.15 2.17 1.01 0.20 -0.01 121.20 125.60 2nut s ILE 416 Ca 0.24 -0.43 0.06 0.00 0.00 0.00 0.00 60.65 60.52 2nut s ILE 416 Cb -0.02 -2.71 -0.17 0.00 0.01 0.00 0.00 42.46 39.57 2nut s ILE 416 CO 0.09 0.37 1.35 0.28 0.00 0.00 0.00 174.94 177.03 2nut h SER 417 N 8.15 0.07 -1.40 3.58 0.02 -0.88 -2.34 113.55 120.75 2nut h SER 417 Ca -0.40 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 2nut h SER 417 Cb 1.16 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.68 2nut h SER 417 CO 0.60 0.95 0.00 0.61 -1.14 0.00 0.00 176.83 177.84 2nut n GLY 418 N 1.07 -1.03 3.12 -3.77 0.00 -1.21 -0.27 105.19 103.11 2nut n GLY 418 Ca -0.01 -1.51 -0.15 0.00 0.00 0.00 0.00 46.02 44.35 2nut n GLY 418 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nut s ALA 419 N -1.31 0.88 -0.15 4.61 0.00 -0.87 -0.70 121.76 124.23 2nut s ALA 419 Ca 0.00 -0.94 -0.00 0.00 0.00 0.00 0.00 51.96 51.02 2nut s ALA 419 Cb 0.00 -0.00 0.04 0.00 0.00 0.00 0.00 23.12 23.15 2nut s ALA 419 CO 0.00 0.03 -0.06 0.42 0.00 0.00 0.00 175.76 176.15 2nut s ILE 420 N -1.61 1.12 -5.00 0.00 1.01 0.60 -1.50 121.20 115.82 2nut s ILE 420 Ca -0.04 -0.55 0.00 0.00 0.00 0.00 0.00 60.65 60.06 2nut s ILE 420 Cb -0.08 -1.24 0.00 0.00 0.01 0.00 0.00 42.46 41.14 2nut s ILE 420 CO 0.01 0.21 0.00 0.61 0.00 0.00 0.00 174.94 175.77 2nut n GLY 421 N 4.88 -0.96 3.55 6.18 0.00 -1.26 -1.45 105.19 116.13 2nut n GLY 421 Ca -0.12 -1.36 -0.34 0.00 0.00 0.00 0.00 46.02 44.19 2nut n GLY 421 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2nut s PRO 422 N -2.00 2.59 -0.04 1.61 0.04 -1.26 -4.87 135.00 131.07 2nut s PRO 422 Ca 0.00 0.32 -0.31 0.00 0.04 0.00 0.00 61.00 61.05 2nut s PRO 422 Cb 0.00 -4.61 0.11 0.00 0.04 0.00 0.00 34.50 30.04 2nut s PRO 422 CO 0.00 -2.96 1.16 0.00 0.04 0.00 0.00 177.00 175.24 2nut s VAL 424 N -2.64 1.02 0.19 0.00 1.01 -0.22 -4.82 120.40 114.93 2nut s VAL 424 Ca 0.11 -1.20 -0.28 0.00 0.00 0.00 0.00 61.98 60.61 2nut s VAL 424 Cb 0.01 -0.99 -0.08 0.00 0.00 0.00 0.00 36.38 35.33 2nut s VAL 424 CO -0.04 -0.20 0.87 -0.55 0.00 0.00 0.00 175.10 175.19 2nut s SER 425 N -1.58 7.52 0.00 3.32 0.15 -1.26 0.17 113.70 122.01 2nut s SER 425 Ca -0.02 1.79 0.21 0.00 0.70 0.00 0.00 55.95 58.64 2nut s SER 425 Cb -0.09 -2.56 0.61 0.00 -1.71 0.00 0.00 66.02 62.26 2nut s SER 425 CO 0.02 0.15 1.48 0.18 1.20 0.00 0.00 173.24 176.27 2nut n LEU 426 N 1.73 2.33 -4.32 3.45 4.77 -0.76 -4.84 117.00 119.36 2nut n LEU 426 Ca -0.03 -0.99 -0.32 0.00 -0.03 0.00 0.00 56.01 54.65 2nut n LEU 426 Cb 0.48 -0.16 -0.10 0.00 -2.33 0.00 0.00 43.42 41.32 2nut n LEU 426 CO 0.49 0.49 -0.44 -3.20 -1.33 0.00 0.00 177.39 173.40 2nut n ASN 427 N 0.76 0.64 -4.74 -1.43 5.15 -1.26 -4.91 115.26 109.47 2nut n ASN 427 Ca 0.17 -1.26 -0.36 0.00 -0.60 0.00 0.00 54.58 52.53 2nut n ASN 427 Cb 0.43 -1.57 -0.07 0.00 -0.53 0.00 0.00 39.78 38.04 2nut n ASN 427 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 2nut s SER 428 N -4.24 6.37 0.35 1.20 1.04 -1.26 -4.99 113.70 112.17 2nut s SER 428 Ca 0.09 0.42 0.03 0.00 0.48 0.00 0.00 55.95 56.98 2nut s SER 428 Cb -0.05 -2.15 -0.02 0.00 0.10 0.00 0.00 66.02 63.90 2nut s SER 428 CO 0.99 0.14 0.53 -0.54 0.98 0.00 0.00 173.24 175.34 2nut s LYS 429 N 0.34 3.24 0.00 4.02 -0.14 -1.26 -2.97 119.74 122.97 2nut s LYS 429 Ca 0.14 -0.66 0.00 0.00 -1.36 0.00 0.00 55.97 54.08 2nut s LYS 429 Cb -0.12 -2.72 0.00 0.00 -1.68 0.00 0.00 37.83 33.31 2nut s LYS 429 CO 0.02 0.05 0.00 0.41 -0.76 0.00 0.00 175.35 175.07 2nut n GLY 430 N -1.76 -1.42 0.12 -3.33 0.00 -1.26 -4.97 105.19 92.57 2nut n GLY 430 Ca -0.02 -1.05 0.12 0.00 0.00 0.00 0.00 46.02 45.07 2nut n GLY 430 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2nut n PRO 431 N -0.17 0.20 0.13 1.61 -0.04 -1.26 -2.86 135.00 132.61 2nut n PRO 431 Ca 0.00 0.36 0.13 0.00 -0.04 0.00 0.00 63.50 63.94 2nut n PRO 431 Cb 0.00 -1.83 0.30 0.00 -0.04 0.00 0.00 33.50 31.93 2nut n PRO 431 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2nut s VAL 433 N -3.15 4.13 0.35 0.00 1.01 -1.14 0.61 120.40 122.21 2nut s VAL 433 Ca 0.09 1.62 -0.03 0.00 0.00 0.00 0.00 61.98 63.66 2nut s VAL 433 Cb 0.10 -4.04 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 2nut s VAL 433 CO 0.64 0.18 0.60 -0.55 0.00 0.00 0.00 175.10 175.97 2nut s SER 434 N 0.64 6.35 0.09 3.32 0.15 -0.88 -4.80 113.70 118.56 2nut s SER 434 Ca 0.54 0.65 0.07 0.00 0.70 0.00 0.00 55.95 57.91 2nut s SER 434 Cb -0.28 -2.12 -0.22 0.00 -1.71 0.00 0.00 66.02 61.69 2nut s SER 434 CO 0.31 -0.32 1.16 -0.33 1.20 0.00 0.00 173.24 175.26 2nut h GLU 435 N 0.99 0.03 -5.56 5.44 4.39 -1.95 -3.40 114.58 114.51 2nut h GLU 435 Ca -0.48 -0.05 -0.63 0.00 0.34 0.00 0.00 59.36 58.53 2nut h GLU 435 Cb 1.20 0.02 -0.14 0.00 -0.10 0.00 0.00 28.75 29.74 2nut h GLU 435 CO 0.63 0.95 0.95 1.21 -1.16 0.00 0.00 179.01 181.59 2nut s ASN 436 N -6.66 6.42 0.02 1.42 3.04 -1.26 -5.00 114.94 112.92 2nut s ASN 436 Ca -0.01 -1.43 -0.14 0.00 0.04 0.00 0.00 52.86 51.32 2nut s ASN 436 Cb 0.09 -2.47 -0.06 0.00 -1.54 0.00 0.00 41.25 37.28 2nut s ASN 436 CO 0.83 -1.37 0.42 -1.83 -3.04 0.00 0.00 177.10 172.11 2nut s GLU 437 N 3.98 3.92 -0.02 0.43 -1.05 -1.26 -4.41 118.70 120.29 2nut s GLU 437 Ca 0.33 0.41 0.05 0.00 -0.15 0.00 0.00 54.97 55.62 2nut s GLU 437 Cb -0.07 -3.19 -0.01 0.00 -0.44 0.00 0.00 34.13 30.42 2nut s GLU 437 CO -0.02 0.67 -0.18 0.42 0.95 0.00 0.00 175.26 177.10 2nut s ILE 438 N -1.12 1.46 0.00 1.83 -1.09 0.63 -4.95 121.20 117.95 2nut s ILE 438 Ca 0.25 -0.78 0.00 0.00 -2.23 0.00 0.00 60.65 57.90 2nut s ILE 438 Cb -0.17 -1.22 0.00 0.00 -1.58 0.00 0.00 42.46 39.50 2nut s ILE 438 CO 0.14 0.41 0.00 0.61 -1.23 0.00 0.00 174.94 174.88 2nut n GLY 439 N 2.74 2.64 3.53 6.18 0.00 -1.26 -3.28 105.19 115.74 2nut n GLY 439 Ca -0.16 -0.34 -0.41 0.00 0.00 0.00 0.00 46.02 45.11 2nut n GLY 439 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nut s THR 440 N 0.00 3.85 0.00 2.61 2.01 -0.57 -4.83 115.64 118.71 2nut s THR 440 Ca 0.00 0.25 0.00 0.00 0.31 0.00 0.00 61.69 62.25 2nut s THR 440 Cb 0.00 -4.87 0.00 0.00 0.01 0.00 0.00 72.50 67.64 2nut s THR 440 CO 0.00 -1.78 0.00 0.61 -0.69 0.00 0.00 174.62 172.76 2nut n GLY 441 N 5.37 6.33 2.32 4.40 0.00 -1.24 -2.05 105.19 120.32 2nut n GLY 441 Ca 0.02 -2.06 -0.12 0.00 0.00 0.00 0.00 46.02 43.85 2nut n GLY 441 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nut n GLY 442 N 5.00 -0.05 3.63 -0.02 0.00 -1.26 -4.93 105.19 107.55 2nut n GLY 442 Ca 0.00 -0.35 -0.08 0.00 0.00 0.00 0.00 46.02 45.60 2nut n GLY 442 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2nut s THR 443 N -2.72 0.00 -0.02 2.61 -1.32 -1.26 -4.40 115.64 108.53 2nut s THR 443 Ca 0.08 -0.39 0.03 0.00 -1.21 0.00 0.00 61.69 60.20 2nut s THR 443 Cb -0.03 -1.48 0.05 0.00 -1.51 0.00 0.00 72.50 69.53 2nut s THR 443 CO 0.09 0.00 0.94 0.00 -2.21 0.00 0.00 174.62 173.44 2nut s GLN 445 N -1.12 0.02 0.14 0.00 -0.21 -1.26 -1.55 119.66 115.69 2nut s GLN 445 Ca 0.06 0.15 0.07 0.00 0.02 0.00 0.00 55.36 55.66 2nut s GLN 445 Cb 0.05 -0.26 -0.04 0.00 1.00 0.00 0.00 33.01 33.76 2nut s GLN 445 CO 0.01 -0.14 -0.16 -1.58 -2.12 0.00 0.00 175.29 171.29 2nut s TRP 446 N 0.95 1.61 -0.11 0.91 0.51 0.77 -1.84 118.94 121.75 2nut s TRP 446 Ca -0.08 -0.50 0.01 0.00 -2.12 0.00 0.00 56.10 53.40 2nut s TRP 446 Cb -0.12 -0.83 -0.02 0.00 -0.81 0.00 0.00 33.47 31.70 2nut s TRP 446 CO -0.02 0.23 -0.13 0.21 -0.51 0.00 0.00 176.95 176.73 2nut s LYS 447 N -2.64 3.14 -0.40 4.98 2.20 0.13 -0.20 119.74 126.94 2nut s LYS 447 Ca 0.11 -0.67 0.02 0.00 -0.36 0.00 0.00 55.97 55.07 2nut s LYS 447 Cb -0.06 -2.58 0.12 0.00 -1.51 0.00 0.00 37.83 33.80 2nut s LYS 447 CO 0.05 0.35 0.18 0.42 -0.36 0.00 0.00 175.35 175.98 2nut s ILE 448 N 0.01 1.51 0.49 5.43 1.01 0.27 -1.06 121.20 128.86 2nut s ILE 448 Ca -0.04 -2.32 0.16 0.00 0.00 0.00 0.00 60.65 58.46 2nut s ILE 448 Cb -0.14 -2.08 0.31 0.00 0.01 0.00 0.00 42.46 40.56 2nut s ILE 448 CO 0.04 -0.79 2.07 0.00 0.00 0.00 0.00 174.94 176.26 2nut s GLY 450 N -3.95 0.06 0.15 0.00 0.00 -1.26 -0.88 107.32 101.44 2nut s GLY 450 Ca -0.06 0.42 -0.10 0.00 0.00 0.00 0.00 44.72 44.98 2nut s GLY 450 CO 0.71 0.79 0.29 0.48 0.00 0.00 0.00 173.10 175.37 2nut s LEU 451 N 1.12 0.97 0.00 0.66 0.05 -0.88 -3.62 118.68 116.97 2nut s LEU 451 Ca -0.09 -0.77 0.06 0.00 0.05 0.00 0.00 54.13 53.38 2nut s LEU 451 Cb -0.13 1.26 -0.02 0.00 -2.05 0.00 0.00 46.19 45.25 2nut s LEU 451 CO -0.04 -0.87 0.33 -1.54 -0.55 0.00 0.00 176.35 173.68 2nut n SER 452 N -0.19 -0.85 0.00 1.48 3.41 -1.26 -0.54 113.62 115.67 2nut n SER 452 Ca -0.10 -3.12 0.04 0.00 -0.26 0.00 0.00 58.87 55.43 2nut n SER 452 Cb 0.63 1.85 0.16 0.00 -0.26 0.00 0.00 64.21 66.60 2nut n SER 452 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 2nut n PRO 453 N -0.62 0.02 -0.00 4.33 -0.02 -1.26 -2.25 135.00 135.20 2nut n PRO 453 Ca 0.06 0.34 0.06 0.00 -2.02 0.00 0.00 63.50 61.94 2nut n PRO 453 Cb 0.60 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 32.51 2nut n PRO 453 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2nut n THR 454 N -1.46 0.00 -1.68 3.45 -2.24 -1.26 -3.77 114.28 107.32 2nut n THR 454 Ca 0.02 -0.22 -0.47 0.00 -2.27 0.00 0.00 64.05 61.11 2nut n THR 454 Cb 0.08 1.00 -0.04 0.00 -2.10 0.00 0.00 70.33 69.27 2nut n THR 454 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2nut n THR 455 N -1.28 0.40 -4.25 4.28 -1.04 -0.95 -4.15 114.28 107.29 2nut n THR 455 Ca 0.02 -0.07 -0.26 0.00 -2.04 0.00 0.00 64.05 61.70 2nut n THR 455 Cb 0.18 -1.80 -0.17 0.00 -1.82 0.00 0.00 70.33 66.72 2nut n THR 455 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 2nut s THR 456 N 3.06 1.10 0.11 12.58 2.01 0.68 -4.04 115.64 131.14 2nut s THR 456 Ca 0.88 -0.40 0.03 0.00 0.31 0.00 0.00 61.69 62.51 2nut s THR 456 Cb -0.67 -1.05 -0.04 0.00 0.01 0.00 0.00 72.50 70.75 2nut s THR 456 CO 0.46 0.36 0.14 -0.76 -0.69 0.00 0.00 174.62 174.13 2nut s LEU 457 N 1.16 3.94 -0.22 4.42 2.01 0.25 -4.40 118.68 125.83 2nut s LEU 457 Ca -0.05 0.01 -0.05 0.00 0.01 0.00 0.00 54.13 54.05 2nut s LEU 457 Cb -0.14 -2.57 -0.01 0.00 0.01 0.00 0.00 46.19 43.47 2nut s LEU 457 CO -0.02 0.13 -0.02 0.00 1.01 0.00 0.00 176.35 177.45 2nut s ALA 458 N -1.56 2.90 -0.24 4.21 0.00 -0.53 -0.05 121.76 126.49 2nut s ALA 458 Ca 0.31 -1.14 -0.04 0.00 0.00 0.00 0.00 51.96 51.09 2nut s ALA 458 Cb -0.11 -1.78 0.00 0.00 0.00 0.00 0.00 23.12 21.23 2nut s ALA 458 CO 0.24 -0.41 -0.01 0.42 0.00 0.00 0.00 175.76 176.00 2nut s ILE 459 N 1.46 3.47 -0.25 0.00 1.01 -0.06 -0.29 121.20 126.54 2nut s ILE 459 Ca 0.05 -0.61 -0.13 0.00 0.00 0.00 0.00 60.65 59.96 2nut s ILE 459 Cb -0.14 -2.66 -0.04 0.00 0.01 0.00 0.00 42.46 39.62 2nut s ILE 459 CO -0.01 0.30 0.28 -0.31 0.00 0.00 0.00 174.94 175.20 2nut s TYR 460 N 1.46 3.30 0.47 3.97 1.51 0.12 -1.36 117.35 126.82 2nut s TYR 460 Ca 0.04 0.35 0.08 0.00 -1.01 0.00 0.00 57.07 56.53 2nut s TYR 460 Cb -0.15 -2.43 0.01 0.00 -0.11 0.00 0.00 41.96 39.28 2nut s TYR 460 CO -0.02 -0.07 0.47 -0.06 -1.11 0.00 0.00 175.55 174.76 2nut s PHE 461 N 1.50 2.30 -0.10 2.71 0.40 0.07 -0.31 117.98 124.55 2nut s PHE 461 Ca 0.12 -0.59 -0.14 0.00 -0.60 0.00 0.00 56.93 55.72 2nut s PHE 461 Cb -0.15 -2.15 0.03 0.00 0.51 0.00 0.00 43.02 41.27 2nut s PHE 461 CO 0.08 -0.39 0.36 -2.00 0.70 0.00 0.00 175.22 173.97 2nut s GLU 462 N -4.27 0.52 -0.29 0.44 2.12 0.98 -4.24 118.70 113.96 2nut s GLU 462 Ca 0.48 0.28 -0.10 0.00 0.36 0.00 0.00 54.97 55.99 2nut s GLU 462 Cb -0.04 0.24 -0.02 0.00 0.26 0.00 0.00 34.13 34.57 2nut s GLU 462 CO 0.29 -0.10 0.15 0.08 -0.54 0.00 0.00 175.26 175.14 2nut s VAL 463 N -0.32 4.81 -0.06 3.70 1.01 -1.26 0.03 120.40 128.30 2nut s VAL 463 Ca -0.05 -0.18 0.09 0.00 0.00 0.00 0.00 61.98 61.85 2nut s VAL 463 Cb -0.03 -3.37 0.14 0.00 0.00 0.00 0.00 36.38 33.12 2nut s VAL 463 CO 0.02 0.17 1.03 0.52 0.00 0.00 0.00 175.10 176.84 2nut n VAL 464 N 5.01 1.08 -1.54 2.92 0.31 -0.30 -4.82 118.33 120.98 2nut n VAL 464 Ca -0.14 -1.26 0.00 0.00 -0.01 0.00 0.00 64.34 62.92 2nut n VAL 464 Cb 0.50 0.18 0.00 0.00 -0.91 0.00 0.00 33.84 33.62 2nut n VAL 464 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2nut n GLY 475 N -0.78 2.95 1.22 2.92 0.00 -1.26 -4.81 105.19 105.43 2nut n GLY 475 Ca 0.08 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.18 2nut n GLY 475 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nut n ARG 476 N 0.00 0.00 -3.46 1.61 5.12 -1.21 -4.78 116.66 113.93 2nut n ARG 476 Ca 0.00 0.41 -0.34 0.00 -1.93 0.00 0.00 57.85 55.99 2nut n ARG 476 Cb 0.00 -0.82 -0.05 0.00 -1.16 0.00 0.00 32.46 30.43 2nut n ARG 476 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 2nut s GLY 477 N 0.00 2.36 0.16 -0.13 0.00 0.21 -4.83 107.32 105.08 2nut s GLY 477 Ca 0.00 -0.28 0.10 0.00 0.00 0.00 0.00 44.72 44.54 2nut s GLY 477 CO 0.00 -0.07 -0.22 0.00 0.00 0.00 0.00 173.10 172.81 2nut s ALA 478 N -1.56 2.24 -0.08 3.20 0.00 -1.26 -1.51 121.76 122.79 2nut s ALA 478 Ca 0.39 -1.50 -0.04 0.00 0.00 0.00 0.00 51.96 50.81 2nut s ALA 478 Cb -0.13 -0.29 0.04 0.00 0.00 0.00 0.00 23.12 22.74 2nut s ALA 478 CO 0.20 0.39 0.18 0.42 0.00 0.00 0.00 175.76 176.95 2nut s ILE 479 N -1.57 -0.04 -0.16 0.00 1.01 -0.79 -2.37 121.20 117.28 2nut s ILE 479 Ca 0.16 0.15 0.01 0.00 0.00 0.00 0.00 60.65 60.97 2nut s ILE 479 Cb -0.08 -0.29 0.01 0.00 0.01 0.00 0.00 42.46 42.11 2nut s ILE 479 CO 0.07 0.06 -0.18 -1.58 0.00 0.00 0.00 174.94 173.31 2nut s GLN 480 N 1.10 3.09 -0.22 2.79 0.74 0.50 -1.38 119.66 126.28 2nut s GLN 480 Ca -0.08 -0.80 -0.09 0.00 0.05 0.00 0.00 55.36 54.44 2nut s GLN 480 Cb -0.10 -2.56 -0.04 0.00 1.10 0.00 0.00 33.01 31.40 2nut s GLN 480 CO -0.06 -0.07 0.11 -0.06 -0.55 0.00 0.00 175.29 174.66 2nut s PHE 481 N 0.99 3.25 -0.18 1.67 0.40 0.66 -1.32 117.98 123.45 2nut s PHE 481 Ca -0.02 0.05 0.01 0.00 -0.60 0.00 0.00 56.93 56.37 2nut s PHE 481 Cb -0.15 -2.20 0.02 0.00 0.51 0.00 0.00 43.02 41.20 2nut s PHE 481 CO -0.05 0.01 -0.19 0.08 0.70 0.00 0.00 175.22 175.77 2nut s VAL 482 N 0.96 1.98 -0.25 -0.44 1.01 0.02 -1.33 120.40 122.35 2nut s VAL 482 Ca 0.06 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.15 2nut s VAL 482 Cb -0.14 -1.81 0.05 0.00 0.00 0.00 0.00 36.38 34.49 2nut s VAL 482 CO 0.03 0.52 -0.11 -0.89 0.00 0.00 0.00 175.10 174.65 2nut s THR 483 N 1.32 2.30 -0.22 3.92 2.01 0.47 -0.81 115.64 124.62 2nut s THR 483 Ca 0.05 -1.40 -0.09 0.00 0.31 0.00 0.00 61.69 60.56 2nut s THR 483 Cb -0.13 -2.25 -0.04 0.00 0.01 0.00 0.00 72.50 70.09 2nut s THR 483 CO -0.13 0.11 0.12 -1.10 -0.69 0.00 0.00 174.62 172.93 2nut s GLN 484 N 1.18 4.00 0.23 4.92 -0.21 -0.28 0.23 119.66 129.72 2nut s GLN 484 Ca -0.05 -0.31 -0.11 0.00 0.02 0.00 0.00 55.36 54.91 2nut s GLN 484 Cb -0.18 -3.40 -0.01 0.00 1.00 0.00 0.00 33.01 30.42 2nut s GLN 484 CO -0.06 0.12 0.41 1.52 -2.12 0.00 0.00 175.29 175.16 2nut s TYR 485 N 0.85 0.43 -0.27 0.91 -0.85 -0.41 0.09 117.35 118.09 2nut s TYR 485 Ca 0.06 -0.78 -0.14 0.00 -0.52 0.00 0.00 57.07 55.69 2nut s TYR 485 Cb -0.13 0.08 -0.04 0.00 0.38 0.00 0.00 41.96 42.25 2nut s TYR 485 CO 0.03 -0.91 0.33 -1.14 -1.52 0.00 0.00 175.55 172.34 2nut s GLN 486 N -4.02 3.98 0.56 -3.49 0.74 0.12 -0.87 119.66 116.68 2nut s GLN 486 Ca 0.23 -0.06 -0.16 0.00 0.05 0.00 0.00 55.36 55.41 2nut s GLN 486 Cb 0.01 -3.66 -0.05 0.00 1.10 0.00 0.00 33.01 30.40 2nut s GLN 486 CO 0.07 -0.26 1.04 -1.58 -0.55 0.00 0.00 175.29 174.01 2nut s HIS 487 N 1.99 3.12 0.62 1.67 5.65 0.07 -0.14 115.29 128.27 2nut s HIS 487 Ca 0.13 1.51 0.34 0.00 0.25 0.00 0.00 55.06 57.29 2nut s HIS 487 Cb -0.16 -2.95 1.93 0.00 -1.18 0.00 0.00 32.58 30.21 2nut s HIS 487 CO 0.10 -0.88 2.19 0.66 -0.65 0.00 0.00 174.74 176.16 2nut h SER 488 N 0.68 0.00 1.66 9.88 4.64 -1.82 0.26 113.55 128.85 2nut h SER 488 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2nut h SER 488 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2nut h SER 488 CO 0.59 0.00 0.00 0.77 -0.87 0.00 0.00 176.83 177.32 2nut h SER 489 N 0.00 0.00 0.00 4.97 4.64 -1.91 -3.47 113.55 117.78 2nut h SER 489 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2nut h SER 489 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 2nut h SER 489 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 2nut n GLY 490 N 0.97 2.56 3.76 -0.77 0.00 0.93 -5.05 105.19 107.60 2nut n GLY 490 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.67 2nut n GLY 490 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2nut s GLN 491 N -0.37 3.74 -0.02 1.61 -0.21 -1.26 -4.53 119.66 118.63 2nut s GLN 491 Ca 0.00 2.18 -0.21 0.00 0.02 0.00 0.00 55.36 57.35 2nut s GLN 491 Cb 0.00 -2.61 -0.05 0.00 1.00 0.00 0.00 33.01 31.35 2nut s GLN 491 CO 0.00 -0.69 0.61 0.50 -2.12 0.00 0.00 175.29 173.60 2nut s ARG 492 N -2.45 4.35 0.13 2.91 6.06 -1.26 -0.75 118.95 127.94 2nut s ARG 492 Ca 0.61 0.76 0.06 0.00 -2.50 0.00 0.00 55.73 54.66 2nut s ARG 492 Cb -0.39 -3.36 -0.04 0.00 0.06 0.00 0.00 34.95 31.22 2nut s ARG 492 CO 0.49 0.31 -0.15 1.03 -2.50 0.00 0.00 175.30 174.48 2nut s ARG 493 N 0.00 1.06 -0.14 5.12 0.52 -0.05 -1.63 118.95 123.83 2nut s ARG 493 Ca 0.32 -1.26 -0.00 0.00 -0.52 0.00 0.00 55.73 54.27 2nut s ARG 493 Cb -0.18 -0.98 0.03 0.00 0.52 0.00 0.00 34.95 34.34 2nut s ARG 493 CO 0.17 0.19 -0.08 0.42 0.02 0.00 0.00 175.30 176.02 2nut s ILE 494 N -2.09 1.19 -0.20 1.52 1.09 -0.13 -1.28 121.20 121.30 2nut s ILE 494 Ca 0.10 -0.51 -0.10 0.00 -1.10 0.00 0.00 60.65 59.03 2nut s ILE 494 Cb -0.05 -1.24 -0.05 0.00 -1.06 0.00 0.00 42.46 40.05 2nut s ILE 494 CO 0.04 0.29 0.15 -0.60 -0.10 0.00 0.00 174.94 174.72 2nut s ARG 495 N 1.62 4.20 -0.13 2.79 6.06 0.13 0.07 118.95 133.69 2nut s ARG 495 Ca 0.03 -0.18 -0.00 0.00 -2.50 0.00 0.00 55.73 53.08 2nut s ARG 495 Cb -0.14 -3.42 0.02 0.00 0.06 0.00 0.00 34.95 31.47 2nut s ARG 495 CO -0.08 0.29 -0.11 0.08 -2.50 0.00 0.00 175.30 172.97 2nut s VAL 496 N 0.39 1.29 -0.17 7.11 1.01 0.11 -0.40 120.40 129.74 2nut s VAL 496 Ca 0.09 -0.46 0.01 0.00 0.00 0.00 0.00 61.98 61.62 2nut s VAL 496 Cb -0.11 -1.25 0.03 0.00 0.00 0.00 0.00 36.38 35.04 2nut s VAL 496 CO -0.01 0.41 -0.14 -0.89 0.00 0.00 0.00 175.10 174.46 2nut s THR 497 N 1.60 1.73 -0.14 3.92 2.01 -0.44 0.12 115.64 124.43 2nut s THR 497 Ca 0.05 -0.85 -0.00 0.00 0.31 0.00 0.00 61.69 61.20 2nut s THR 497 Cb -0.13 -1.67 -0.01 0.00 0.01 0.00 0.00 72.50 70.71 2nut s THR 497 CO -0.09 0.38 -0.14 -0.89 -0.69 0.00 0.00 174.62 173.18 2nut s THR 498 N 1.40 2.88 0.19 -0.82 2.01 -1.26 -0.24 115.64 119.80 2nut s THR 498 Ca 0.03 -0.71 0.08 0.00 0.31 0.00 0.00 61.69 61.39 2nut s THR 498 Cb -0.14 -2.22 -0.05 0.00 0.01 0.00 0.00 72.50 70.11 2nut s THR 498 CO -0.10 0.52 -0.15 0.27 -0.69 0.00 0.00 174.62 174.47 2nut s ILE 499 N 0.59 1.69 -0.04 1.82 -4.36 -0.48 -4.52 121.20 115.90 2nut s ILE 499 Ca -0.08 -2.14 -0.04 0.00 -0.26 0.00 0.00 60.65 58.13 2nut s ILE 499 Cb -0.16 -1.98 0.01 0.00 1.25 0.00 0.00 42.46 41.59 2nut s ILE 499 CO 0.03 -0.56 0.11 0.00 0.24 0.00 0.00 174.94 174.77 2nut s ALA 500 N -2.82 -0.28 0.02 2.27 0.00 -1.26 -1.88 121.76 117.81 2nut s ALA 500 Ca 0.20 0.29 0.03 0.00 0.00 0.00 0.00 51.96 52.48 2nut s ALA 500 Cb -0.01 -0.17 -0.02 0.00 0.00 0.00 0.00 23.12 22.92 2nut s ALA 500 CO 0.06 -0.06 -0.10 1.03 0.00 0.00 0.00 175.76 176.69 2nut s ARG 501 N -0.02 0.70 0.46 0.00 1.81 -0.57 -4.92 118.95 116.41 2nut s ARG 501 Ca -0.01 -0.55 -0.24 0.00 -1.72 0.00 0.00 55.73 53.22 2nut s ARG 501 Cb -0.01 -0.64 -0.07 0.00 -0.45 0.00 0.00 34.95 33.77 2nut s ARG 501 CO 0.00 0.16 1.26 -0.80 -0.68 0.00 0.00 175.30 175.24 2nut s ASN 502 N -0.83 5.99 0.22 0.23 0.01 -1.26 0.64 114.94 119.96 2nut s ASN 502 Ca -0.00 2.54 -0.26 0.00 -0.71 0.00 0.00 52.86 54.43 2nut s ASN 502 Cb -0.06 -2.62 -0.09 0.00 0.41 0.00 0.00 41.25 38.89 2nut s ASN 502 CO 0.00 -1.06 0.85 0.26 -1.51 0.00 0.00 177.10 175.64 2nut s TRP 503 N -1.38 3.85 0.27 2.20 0.52 -1.26 -2.16 118.94 120.97 2nut s TRP 503 Ca 0.63 1.71 -0.31 0.00 0.02 0.00 0.00 56.10 58.15 2nut s TRP 503 Cb -0.35 -2.83 -0.12 0.00 -1.15 0.00 0.00 33.47 29.02 2nut s TRP 503 CO 0.43 0.42 1.60 0.00 0.02 0.00 0.00 176.95 179.42 2nut n ALA 504 N 1.24 2.41 -2.13 0.98 0.00 0.21 -4.77 120.51 118.45 2nut n ALA 504 Ca -0.03 0.38 -0.42 0.00 0.00 0.00 0.00 53.44 53.38 2nut n ALA 504 Cb 0.49 -2.45 -0.03 0.00 0.00 0.00 0.00 19.45 17.46 2nut n ALA 504 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2nut s ASP 505 N 0.62 6.87 0.36 0.00 1.01 -1.26 -4.36 116.67 119.90 2nut s ASP 505 Ca 0.67 2.33 0.09 0.00 0.71 0.00 0.00 52.55 56.35 2nut s ASP 505 Cb -0.52 -2.59 0.81 0.00 1.01 0.00 0.00 42.92 41.62 2nut s ASP 505 CO 0.45 -0.59 1.88 0.00 0.21 0.00 0.00 175.17 177.12 2nut h ALA 506 N 6.25 1.82 -0.55 5.23 0.00 -1.97 -1.11 119.26 128.93 2nut h ALA 506 Ca -0.43 0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.21 2nut h ALA 506 Cb 1.21 -0.13 -0.17 0.00 0.00 0.00 0.00 17.79 18.70 2nut h ALA 506 CO 0.82 -0.05 0.36 1.04 0.00 0.00 0.00 179.25 181.43 2nut n GLN 507 N -4.55 1.71 -0.74 0.00 6.02 -1.26 -3.86 117.38 114.69 2nut n GLN 507 Ca 0.17 -1.67 -0.01 0.00 -0.01 0.00 0.00 57.00 55.48 2nut n GLN 507 Cb 0.44 -1.66 -0.01 0.00 1.02 0.00 0.00 30.24 30.04 2nut n GLN 507 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2nut n THR 508 N -0.40 0.00 0.00 5.09 -2.24 -0.88 -5.09 114.28 110.76 2nut n THR 508 Ca 0.33 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 62.09 2nut n THR 508 Cb 1.15 0.15 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 2nut n THR 508 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2nut n GLN 509 N -0.03 0.00 0.18 -0.78 6.02 -0.47 -1.40 117.38 120.89 2nut n GLN 509 Ca -0.03 0.18 0.18 0.00 -0.01 0.00 0.00 57.00 57.32 2nut n GLN 509 Cb 0.35 -0.76 0.72 0.00 1.02 0.00 0.00 30.24 31.57 2nut n GLN 509 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 2nut h ILE 510 N 0.00 0.19 -0.12 5.09 2.04 -1.94 -1.16 117.51 121.62 2nut h ILE 510 Ca 0.00 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.74 2nut h ILE 510 Cb 0.00 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 36.67 2nut h ILE 510 CO 0.00 0.00 -0.39 1.56 0.00 0.00 0.00 178.15 179.32 2nut h GLN 511 N 0.00 0.48 -0.01 2.37 4.20 -1.90 -1.26 115.11 118.99 2nut h GLN 511 Ca 0.13 -0.35 -0.23 0.00 0.06 0.00 0.00 58.65 58.26 2nut h GLN 511 Cb 1.08 0.06 0.01 0.00 0.30 0.00 0.00 27.48 28.93 2nut h GLN 511 CO -0.00 0.97 -0.93 -0.91 -0.67 0.00 0.00 178.83 177.29 2nut h ASN 512 N 0.07 0.61 0.07 1.46 2.35 -0.10 -3.09 115.58 116.96 2nut h ASN 512 Ca -0.01 -0.47 -0.00 0.00 -0.55 0.00 0.00 56.30 55.26 2nut h ASN 512 Cb 1.02 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 39.20 2nut h ASN 512 CO 0.08 1.27 -0.04 0.40 -1.65 0.00 0.00 177.43 177.50 2nut h ILE 513 N 0.27 0.95 -0.96 2.81 2.04 -1.30 -2.88 117.51 118.44 2nut h ILE 513 Ca -0.08 -0.07 0.05 0.00 1.00 0.00 0.00 64.86 65.77 2nut h ILE 513 Cb 1.57 0.99 -0.06 0.00 -0.74 0.00 0.00 36.82 38.57 2nut h ILE 513 CO 0.17 0.02 0.62 0.00 0.00 0.00 0.00 178.15 178.95 2nut h ALA 514 N 0.80 1.31 0.00 1.87 0.00 -1.29 -1.71 119.26 120.23 2nut h ALA 514 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2nut h ALA 514 Cb 0.10 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.59 2nut h ALA 514 CO 0.02 0.43 0.00 0.00 0.00 0.00 0.00 179.25 179.70 2nut h ALA 515 N 1.42 1.00 -0.55 0.00 0.00 -1.42 -2.58 119.26 117.14 2nut h ALA 515 Ca 0.40 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2nut h ALA 515 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2nut h ALA 515 CO -0.15 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 177.97 2nut n SER 516 N -2.70 3.38 -4.77 0.00 3.41 -0.65 -4.97 113.62 107.33 2nut n SER 516 Ca 0.00 -1.98 -0.41 0.00 -0.26 0.00 0.00 58.87 56.22 2nut n SER 516 Cb 0.20 -0.36 -0.02 0.00 -0.26 0.00 0.00 64.21 63.77 2nut n SER 516 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 2nut s PHE 517 N -1.28 3.05 -0.70 7.33 5.36 -0.97 -1.53 117.98 129.24 2nut s PHE 517 Ca 0.42 1.37 0.03 0.00 -0.96 0.00 0.00 56.93 57.79 2nut s PHE 517 Cb 0.23 -3.69 0.17 0.00 -0.34 0.00 0.00 43.02 39.38 2nut s PHE 517 CO 0.30 -1.94 0.50 0.34 -1.46 0.00 0.00 175.22 172.96 2nut s ASP 518 N -0.37 4.96 0.32 6.13 -1.08 -0.42 -4.96 116.67 121.25 2nut s ASP 518 Ca 0.50 -3.64 0.09 0.00 -0.52 0.00 0.00 52.55 48.98 2nut s ASP 518 Cb -0.40 -1.70 0.85 0.00 -1.46 0.00 0.00 42.92 40.21 2nut s ASP 518 CO 0.52 -0.14 1.76 0.06 0.52 0.00 0.00 175.17 177.89 2nut h GLN 519 N 5.77 0.63 0.17 4.34 3.07 -1.84 0.30 115.11 127.55 2nut h GLN 519 Ca 0.10 -0.04 -0.01 0.00 0.09 0.00 0.00 58.65 58.79 2nut h GLN 519 Cb 0.80 -0.14 0.00 0.00 0.08 0.00 0.00 27.48 28.22 2nut h GLN 519 CO 0.74 0.41 -0.08 0.93 0.09 0.00 0.00 178.83 180.92 2nut h GLU 520 N 0.65 -0.22 -0.80 0.06 5.08 -1.93 0.14 114.58 117.56 2nut h GLU 520 Ca 0.60 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.96 2nut h GLU 520 Cb 1.09 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.35 2nut h GLU 520 CO -0.39 0.09 0.45 0.00 -1.00 0.00 0.00 179.01 178.16 2nut h ALA 521 N 0.21 1.02 -0.45 3.43 0.00 -1.66 -2.26 119.26 119.56 2nut h ALA 521 Ca -0.02 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 2nut h ALA 521 Cb 0.41 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2nut h ALA 521 CO 0.04 0.52 -0.10 0.00 0.00 0.00 0.00 179.25 179.71 2nut h ALA 522 N 1.24 0.98 -0.51 0.00 0.00 -0.41 -0.74 119.26 119.82 2nut h ALA 522 Ca 0.28 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2nut h ALA 522 Cb 0.02 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2nut h ALA 522 CO -0.05 0.61 0.18 0.00 0.00 0.00 0.00 179.25 179.99 2nut h ALA 523 N 1.16 1.35 -0.01 0.00 0.00 -0.41 0.04 119.26 121.39 2nut h ALA 523 Ca 0.12 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 2nut h ALA 523 Cb 0.59 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.18 2nut h ALA 523 CO 0.04 0.48 -0.54 0.82 0.00 0.00 0.00 179.25 180.05 2nut h ILE 524 N 0.74 1.44 -0.89 0.00 1.08 -1.19 -1.93 117.51 116.75 2nut h ILE 524 Ca 0.17 -2.02 0.00 0.00 -0.39 0.00 0.00 64.86 62.62 2nut h ILE 524 Cb 0.19 2.57 -0.04 0.00 -3.07 0.00 0.00 36.82 36.46 2nut h ILE 524 CO -0.01 0.59 0.57 -0.07 -0.69 0.00 0.00 178.15 178.53 2nut h LEU 525 N -0.14 1.05 -0.63 1.44 3.38 -0.88 0.12 115.31 119.65 2nut h LEU 525 Ca -0.06 -0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.72 2nut h LEU 525 Cb 1.25 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 2nut h LEU 525 CO 0.11 0.78 -0.50 0.24 0.09 0.00 0.00 178.44 179.16 2nut h MET 526 N 1.22 0.48 -0.22 1.13 2.86 -1.02 -2.78 114.93 116.60 2nut h MET 526 Ca 0.32 -0.28 -0.09 0.00 -2.06 0.00 0.00 59.70 57.59 2nut h MET 526 Cb -0.10 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 2nut h MET 526 CO -0.07 0.87 -0.27 0.00 1.06 0.00 0.00 176.91 178.51 2nut h ALA 527 N 1.08 1.13 0.10 6.32 0.00 -0.49 -2.02 119.26 125.39 2nut h ALA 527 Ca 0.02 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 2nut h ALA 527 Cb 1.01 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2nut h ALA 527 CO 0.09 0.55 -0.05 -0.09 0.00 0.00 0.00 179.25 179.75 2nut h ARG 528 N 0.37 -0.13 -0.32 0.00 9.65 -0.56 -0.58 114.38 122.81 2nut h ARG 528 Ca 0.05 0.01 0.04 0.00 -1.10 0.00 0.00 59.98 58.98 2nut h ARG 528 Cb 0.67 0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 29.24 2nut h ARG 528 CO 0.05 -0.04 0.08 -0.07 2.80 0.00 0.00 179.97 182.79 2nut h LEU 529 N -0.19 0.06 -0.30 3.80 3.38 -1.32 0.37 115.31 121.11 2nut h LEU 529 Ca -0.01 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2nut h LEU 529 Cb 0.15 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2nut h LEU 529 CO 0.02 0.07 0.17 0.00 0.09 0.00 0.00 178.44 178.79 2nut h ALA 530 N 1.22 0.38 -0.31 1.53 0.00 -1.22 -1.14 119.26 119.72 2nut h ALA 530 Ca 0.15 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2nut h ALA 530 Cb 0.14 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2nut h ALA 530 CO -0.18 -0.09 -0.22 0.82 0.00 0.00 0.00 179.25 179.58 2nut h ILE 531 N 0.37 1.26 -0.49 0.00 1.08 -0.92 -1.70 117.51 117.12 2nut h ILE 531 Ca 0.11 -1.26 -0.07 0.00 -0.39 0.00 0.00 64.86 63.24 2nut h ILE 531 Cb 0.05 1.27 -0.02 0.00 -3.07 0.00 0.00 36.82 35.05 2nut h ILE 531 CO -0.02 0.41 -0.00 0.22 -0.69 0.00 0.00 178.15 178.07 2nut h TYR 532 N 0.51 0.86 -0.02 1.37 3.20 -0.64 -0.63 116.97 121.64 2nut h TYR 532 Ca 0.08 -0.12 -0.16 0.00 3.14 0.00 0.00 58.73 61.67 2nut h TYR 532 Cb 0.66 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.68 2nut h TYR 532 CO 0.03 0.80 -0.71 0.00 -1.64 0.00 0.00 178.16 176.64 2nut h ARG 533 N 0.76 0.09 -0.12 1.82 3.08 -0.87 -3.02 114.38 116.11 2nut h ARG 533 Ca 0.15 -0.08 -0.22 0.00 0.07 0.00 0.00 59.98 59.89 2nut h ARG 533 Cb 0.46 0.02 0.01 0.00 0.08 0.00 0.00 29.97 30.54 2nut h ARG 533 CO 0.02 0.76 -0.81 0.00 -1.07 0.00 0.00 179.97 178.87 2nut h ALA 534 N 1.22 0.32 -0.02 0.04 0.00 -0.99 -1.70 119.26 118.13 2nut h ALA 534 Ca -0.01 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.28 2nut h ALA 534 Cb 1.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 2nut h ALA 534 CO 0.10 0.70 0.00 -1.91 0.00 0.00 0.00 179.25 178.14 2nut n GLU 535 N -3.91 1.09 -2.68 0.00 2.13 -0.27 -3.12 120.64 113.88 2nut n GLU 535 Ca -0.07 -0.10 -0.03 0.00 0.66 0.00 0.00 57.16 57.62 2nut n GLU 535 Cb 0.76 -1.23 0.13 0.00 0.27 0.00 0.00 31.44 31.37 2nut n GLU 535 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 2nut n THR 536 N -0.24 0.04 -0.75 6.31 -1.04 -1.14 -5.04 114.28 112.42 2nut n THR 536 Ca 0.01 -1.16 -0.26 0.00 -2.04 0.00 0.00 64.05 60.60 2nut n THR 536 Cb 0.13 1.01 0.02 0.00 -1.82 0.00 0.00 70.33 69.67 2nut n THR 536 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 2nut n GLU 537 N -1.33 0.00 -2.72 -2.82 0.28 -0.65 -4.88 120.64 108.52 2nut n GLU 537 Ca -0.14 0.00 -0.42 0.00 -0.16 0.00 0.00 57.16 56.44 2nut n GLU 537 Cb 0.87 -0.69 -0.03 0.00 1.43 0.00 0.00 31.44 33.02 2nut n GLU 537 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2nut s ASP 541 N -0.69 7.27 0.35 -1.84 -1.08 -1.26 -5.04 116.67 114.38 2nut s ASP 541 Ca 0.31 1.55 0.16 0.00 -0.52 0.00 0.00 52.55 54.06 2nut s ASP 541 Cb -0.19 -2.55 0.63 0.00 -1.46 0.00 0.00 42.92 39.34 2nut s ASP 541 CO 0.54 -0.36 1.72 0.58 0.52 0.00 0.00 175.17 178.17 2nut h VAL 542 N 4.98 1.04 -0.62 1.11 2.07 -1.97 -2.97 116.25 119.88 2nut h VAL 542 Ca -0.35 -1.61 -0.08 0.00 0.82 0.00 0.00 66.70 65.48 2nut h VAL 542 Cb 1.17 1.94 -0.02 0.00 -1.52 0.00 0.00 31.29 32.86 2nut h VAL 542 CO 0.81 0.42 0.08 -0.07 0.02 0.00 0.00 177.57 178.82 2nut h LEU 543 N 0.00 0.99 -0.80 2.57 3.38 -1.98 -1.76 115.31 117.70 2nut h LEU 543 Ca -0.00 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.73 2nut h LEU 543 Cb 0.91 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.36 2nut h LEU 543 CO 0.06 1.00 0.49 0.03 0.09 0.00 0.00 178.44 180.10 2nut h ARG 544 N 0.96 1.08 -0.70 1.13 -0.00 -1.96 0.19 114.38 115.08 2nut h ARG 544 Ca 0.19 -0.09 -0.06 0.00 -0.50 0.00 0.00 59.98 59.51 2nut h ARG 544 Cb 0.45 -0.23 -0.03 0.00 0.00 0.00 0.00 29.97 30.16 2nut h ARG 544 CO 0.02 0.75 0.20 2.35 0.00 0.00 0.00 179.97 183.28 2nut h TRP 545 N 1.09 1.14 -0.60 3.04 7.01 -1.49 -0.77 115.95 125.37 2nut h TRP 545 Ca 0.29 -0.12 -0.09 0.00 2.11 0.00 0.00 58.89 61.08 2nut h TRP 545 Cb -0.06 -0.33 -0.02 0.00 -2.10 0.00 0.00 29.16 26.65 2nut h TRP 545 CO -0.01 0.91 0.04 1.25 -2.79 0.00 0.00 178.44 177.84 2nut h LEU 546 N 1.05 0.99 -0.11 0.65 5.85 -0.49 -2.50 115.31 120.75 2nut h LEU 546 Ca 0.22 -0.26 -0.08 0.00 0.84 0.00 0.00 57.88 58.61 2nut h LEU 546 Cb 0.33 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.09 2nut h LEU 546 CO -0.00 1.02 -0.23 0.44 -0.34 0.00 0.00 178.44 179.33 2nut h ASP 547 N 0.94 0.39 -0.85 1.25 3.32 -0.30 -1.44 116.42 119.73 2nut h ASP 547 Ca 0.18 -0.57 0.07 0.00 0.02 0.00 0.00 57.03 56.73 2nut h ASP 547 Cb 0.49 -0.11 -0.06 0.00 0.22 0.00 0.00 39.33 39.88 2nut h ASP 547 CO 0.02 0.88 0.55 0.03 -1.72 0.00 0.00 179.24 179.01 2nut h ARG 548 N -0.09 0.89 -0.01 3.56 3.08 -1.13 0.16 114.38 120.84 2nut h ARG 548 Ca 0.00 -0.05 -0.20 0.00 0.07 0.00 0.00 59.98 59.80 2nut h ARG 548 Cb 0.82 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 2nut h ARG 548 CO 0.05 0.59 -0.86 1.96 -1.07 0.00 0.00 179.97 180.64 2nut h GLN 549 N 0.91 0.23 0.08 0.04 1.08 -1.42 -1.19 115.11 114.85 2nut h GLN 549 Ca 0.37 -0.24 -0.00 0.00 -1.45 0.00 0.00 58.65 57.32 2nut h GLN 549 Cb 0.27 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.76 2nut h GLN 549 CO -0.14 0.96 -0.04 1.25 -0.95 0.00 0.00 178.83 179.91 2nut h LEU 550 N 0.14 -0.09 -0.90 1.46 5.85 -0.06 -1.24 115.31 120.46 2nut h LEU 550 Ca -0.04 -0.20 -0.00 0.00 0.84 0.00 0.00 57.88 58.48 2nut h LEU 550 Cb 1.47 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 42.48 2nut h LEU 550 CO 0.13 0.15 0.56 0.40 -0.34 0.00 0.00 178.44 179.35 2nut h ILE 551 N -0.33 1.24 -0.65 4.05 2.04 -0.76 -1.38 117.51 121.73 2nut h ILE 551 Ca -0.01 -0.50 -0.06 0.00 1.00 0.00 0.00 64.86 65.29 2nut h ILE 551 Cb 0.28 -0.05 -0.03 0.00 -0.74 0.00 0.00 36.82 36.28 2nut h ILE 551 CO 0.02 0.25 0.18 0.03 0.00 0.00 0.00 178.15 178.62 2nut h ARG 552 N 1.24 1.00 -0.35 2.37 3.08 -1.09 -1.16 114.38 119.46 2nut h ARG 552 Ca 0.33 -0.21 -0.09 0.00 0.07 0.00 0.00 59.98 60.07 2nut h ARG 552 Cb -0.08 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.80 2nut h ARG 552 CO -0.06 0.88 -0.17 1.25 -1.07 0.00 0.00 179.97 180.80 2nut h LEU 553 N 0.96 0.64 -0.45 3.04 5.85 -0.64 -1.25 115.31 123.47 2nut h LEU 553 Ca 0.21 -0.20 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 2nut h LEU 553 Cb 0.31 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2nut h LEU 553 CO -0.00 0.82 0.12 0.00 -0.34 0.00 0.00 178.44 179.03 2nut h GLN 555 N 0.59 0.60 0.10 0.00 4.20 -1.02 0.26 115.11 119.84 2nut h GLN 555 Ca 0.14 -0.37 -0.27 0.00 0.06 0.00 0.00 58.65 58.21 2nut h GLN 555 Cb 0.31 0.04 0.01 0.00 0.30 0.00 0.00 27.48 28.14 2nut h GLN 555 CO 0.00 0.98 -1.18 -0.22 -0.67 0.00 0.00 178.83 177.74 2nut h LYS 556 N 0.46 0.37 -0.00 1.46 3.64 -1.19 -3.38 116.57 117.93 2nut h LYS 556 Ca 0.01 -0.53 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 2nut h LYS 556 Cb 1.08 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 33.09 2nut h LYS 556 CO 0.10 1.22 -0.11 1.19 -2.27 0.00 0.00 179.45 179.59 2nut n PHE 557 N -3.64 0.00 -0.83 1.91 3.01 -0.76 -5.04 117.46 112.12 2nut n PHE 557 Ca -0.09 0.00 -0.02 0.00 1.01 0.00 0.00 57.45 58.34 2nut n PHE 557 Cb 0.97 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 40.46 2nut n PHE 557 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2nut n GLY 558 N 0.67 -1.77 2.79 1.37 0.00 0.90 -4.76 105.19 104.39 2nut n GLY 558 Ca 0.03 -1.57 -0.17 0.00 0.00 0.00 0.00 46.02 44.31 2nut n GLY 558 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2nut s GLU 559 N -3.22 0.19 -0.13 1.61 0.41 -0.72 -4.98 118.70 111.86 2nut s GLU 559 Ca 0.06 0.13 -0.34 0.00 -0.41 0.00 0.00 54.97 54.41 2nut s GLU 559 Cb -0.00 -0.43 0.15 0.00 -1.78 0.00 0.00 34.13 32.07 2nut s GLU 559 CO 0.04 -0.16 1.43 1.52 -0.49 0.00 0.00 175.26 177.60 2nut s TYR 560 N 1.13 -0.01 -0.16 1.61 -0.85 -1.26 -1.40 117.35 116.41 2nut s TYR 560 Ca -0.08 -0.00 -0.04 0.00 -0.52 0.00 0.00 57.07 56.42 2nut s TYR 560 Cb -0.13 0.50 -0.03 0.00 0.38 0.00 0.00 41.96 42.68 2nut s TYR 560 CO -0.02 -0.02 -0.03 -1.01 -1.52 0.00 0.00 175.55 172.94 2nut s HIS 561 N -2.04 3.03 0.24 -3.49 3.76 -1.26 -5.01 115.29 110.52 2nut s HIS 561 Ca 0.14 -0.31 -0.30 0.00 -0.15 0.00 0.00 55.06 54.45 2nut s HIS 561 Cb 0.06 -1.97 -0.14 0.00 1.11 0.00 0.00 32.58 31.64 2nut s HIS 561 CO -0.06 -0.05 1.15 1.63 -0.85 0.00 0.00 174.74 176.56 2nut n LYS 562 N 3.59 1.46 -1.10 1.40 5.02 -1.26 -1.78 118.16 125.50 2nut n LYS 562 Ca -0.17 0.52 -0.03 0.00 -2.02 0.00 0.00 58.31 56.60 2nut n LYS 562 Cb 0.52 -2.00 -0.01 0.00 -0.02 0.00 0.00 35.03 33.52 2nut n LYS 562 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2nut n ASP 563 N 1.64 -4.62 -3.81 4.39 8.00 0.11 -4.96 116.55 117.30 2nut n ASP 563 Ca 0.11 0.09 -0.28 0.00 0.71 0.00 0.00 54.79 55.42 2nut n ASP 563 Cb 0.30 -2.43 -0.12 0.00 -0.02 0.00 0.00 41.12 38.85 2nut n ASP 563 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2nut s ASP 564 N -2.26 4.14 0.36 -2.24 2.15 -0.73 -4.98 116.67 113.12 2nut s ASP 564 Ca 0.00 -3.58 0.18 0.00 0.43 0.00 0.00 52.55 49.58 2nut s ASP 564 Cb 0.00 -1.40 1.19 0.00 -0.30 0.00 0.00 42.92 42.41 2nut s ASP 564 CO 0.00 -0.12 1.65 -0.65 -0.17 0.00 0.00 175.17 175.88 2nut h PRO 565 N 5.60 0.23 0.00 4.34 0.11 -1.83 0.17 132.00 140.62 2nut h PRO 565 Ca 0.14 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.23 2nut h PRO 565 Cb 0.80 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.86 2nut h PRO 565 CO 0.64 0.15 -0.04 0.77 -0.21 0.00 0.00 178.00 179.32 2nut h SER 566 N 0.23 0.00 1.90 -2.05 0.02 -1.93 -2.26 113.55 109.47 2nut h SER 566 Ca 0.76 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.70 2nut h SER 566 Cb 1.91 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 64.45 2nut h SER 566 CO -0.59 0.04 -0.06 0.77 -1.14 0.00 0.00 176.83 175.85 2nut h SER 567 N 0.00 0.00 -2.78 3.07 4.64 -0.99 -3.46 113.55 114.03 2nut h SER 567 Ca -0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 2nut h SER 567 Cb 0.14 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.30 2nut h SER 567 CO 0.00 0.06 0.91 0.33 -0.87 0.00 0.00 176.83 177.26 2nut n PHE 568 N -3.12 2.66 -3.94 4.77 7.35 -0.85 -4.41 117.46 119.92 2nut n PHE 568 Ca 0.04 0.17 -0.09 0.00 -0.76 0.00 0.00 57.45 56.80 2nut n PHE 568 Cb 0.54 -2.62 -0.07 0.00 0.35 0.00 0.00 39.48 37.69 2nut n PHE 568 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 2nut s ARG 569 N 0.52 1.11 0.03 -4.13 0.52 -0.50 -4.98 118.95 111.52 2nut s ARG 569 Ca 0.72 -1.14 0.02 0.00 -0.52 0.00 0.00 55.73 54.81 2nut s ARG 569 Cb -0.54 0.37 -0.02 0.00 0.52 0.00 0.00 34.95 35.28 2nut s ARG 569 CO 0.39 -0.40 -0.08 -0.06 0.02 0.00 0.00 175.30 175.17 2nut s PHE 570 N -3.95 0.69 1.06 -0.53 2.99 -1.26 -1.76 117.98 115.21 2nut s PHE 570 Ca 0.15 -0.35 -0.14 0.00 0.00 0.00 0.00 56.93 56.60 2nut s PHE 570 Cb 0.04 -0.42 0.22 0.00 0.00 0.00 0.00 43.02 42.86 2nut s PHE 570 CO -0.02 -0.04 1.09 -1.12 -0.00 0.00 0.00 175.22 175.13 2nut s SER 571 N -1.05 2.13 0.58 1.36 0.01 -1.26 -4.60 113.70 110.85 2nut s SER 571 Ca -0.04 1.09 0.38 0.00 1.31 0.00 0.00 55.95 58.70 2nut s SER 571 Cb -0.07 -1.70 2.03 0.00 0.21 0.00 0.00 66.02 66.48 2nut s SER 571 CO 0.00 -3.43 2.17 -0.08 0.41 0.00 0.00 173.24 172.32 2nut h GLU 572 N -2.10 0.00 0.00 12.44 4.81 -2.01 -0.79 114.58 126.93 2nut h GLU 572 Ca -0.54 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 58.64 2nut h GLU 572 Cb 1.33 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.70 2nut h GLU 572 CO 0.54 0.00 -0.26 1.15 -0.73 0.00 0.00 179.01 179.71 2nut h THR 573 N 0.00 0.48 0.00 0.32 2.02 -1.95 -3.37 112.91 110.41 2nut h THR 573 Ca 0.00 -1.50 0.00 0.00 0.77 0.00 0.00 66.41 65.68 2nut h THR 573 Cb 0.07 2.09 0.00 0.00 -1.74 0.00 0.00 68.15 68.58 2nut h THR 573 CO 0.00 0.25 0.00 0.49 0.37 0.00 0.00 175.52 176.63 2nut n PHE 574 N -3.22 0.00 0.26 3.16 3.01 -0.58 -4.30 117.46 115.80 2nut n PHE 574 Ca 0.02 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.58 2nut n PHE 574 Cb 0.58 0.00 0.70 0.00 -0.01 0.00 0.00 39.48 40.75 2nut n PHE 574 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2nut h SER 575 N 0.00 0.00 1.12 4.37 4.64 -1.36 -2.69 113.55 119.62 2nut h SER 575 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2nut h SER 575 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 2nut h SER 575 CO 0.00 0.07 -0.54 -0.07 -0.87 0.00 0.00 176.83 175.42 2nut h LEU 576 N 0.00 0.00 -0.69 5.97 3.38 -1.87 -3.37 115.31 118.72 2nut h LEU 576 Ca -0.00 -0.11 0.09 0.00 0.09 0.00 0.00 57.88 57.94 2nut h LEU 576 Cb 0.14 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.82 2nut h LEU 576 CO 0.01 0.06 0.35 0.22 0.09 0.00 0.00 178.44 179.16 2nut h TYR 577 N 0.00 0.63 -0.68 1.13 3.20 -1.81 -2.04 116.97 117.40 2nut h TYR 577 Ca 0.00 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.92 2nut h TYR 577 Cb 0.83 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 38.88 2nut h TYR 577 CO 0.00 0.24 0.43 -1.35 -1.64 0.00 0.00 178.16 175.84 2nut h PRO 578 N 0.61 0.82 -0.39 1.82 0.11 -1.75 -1.78 132.00 131.44 2nut h PRO 578 Ca 0.34 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.38 2nut h PRO 578 Cb 0.33 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.24 2nut h PRO 578 CO -0.25 0.54 0.17 0.37 -0.21 0.00 0.00 178.00 178.63 2nut h GLN 579 N 0.85 0.56 -0.71 1.05 4.15 -1.66 -0.50 115.11 118.86 2nut h GLN 579 Ca 0.27 -0.09 0.01 0.00 0.77 0.00 0.00 58.65 59.61 2nut h GLN 579 Cb -0.01 -0.10 -0.04 0.00 0.21 0.00 0.00 27.48 27.55 2nut h GLN 579 CO -0.09 0.51 0.47 0.74 -1.93 0.00 0.00 178.83 178.53 2nut h PHE 580 N 0.48 0.87 -0.36 3.99 0.05 -1.17 -1.72 116.94 119.09 2nut h PHE 580 Ca 0.13 0.02 -0.10 0.00 3.82 0.00 0.00 57.97 61.84 2nut h PHE 580 Cb 0.15 -0.29 -0.01 0.00 2.00 0.00 0.00 35.95 37.79 2nut h PHE 580 CO -0.01 0.54 -0.17 1.98 -0.18 0.00 0.00 178.31 180.47 2nut h MET 581 N 0.93 0.74 0.25 1.51 4.05 -0.89 -1.35 114.93 120.17 2nut h MET 581 Ca 0.26 -0.32 0.01 0.00 -0.28 0.00 0.00 59.70 59.37 2nut h MET 581 Cb -0.07 -0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 30.68 2nut h MET 581 CO -0.06 0.93 -0.36 0.35 0.23 0.00 0.00 176.91 178.00 2nut h PHE 582 N 0.53 -0.98 -0.46 1.39 3.57 -0.33 -2.20 116.94 118.45 2nut h PHE 582 Ca 0.08 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 2nut h PHE 582 Cb 0.71 0.40 -0.02 0.00 2.79 0.00 0.00 35.95 39.82 2nut h PHE 582 CO 0.06 -0.48 0.23 0.45 -2.23 0.00 0.00 178.31 176.33 2nut h HIS 583 N -0.67 0.62 -0.29 0.41 3.86 -1.28 -2.99 115.15 114.81 2nut h HIS 583 Ca 0.00 -0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.17 2nut h HIS 583 Cb 0.64 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 28.90 2nut h HIS 583 CO -0.26 0.46 0.06 1.25 0.86 0.00 0.00 177.93 180.30 2nut h LEU 584 N 0.64 0.45 -0.10 2.43 5.85 -0.96 -1.45 115.31 122.17 2nut h LEU 584 Ca 0.16 -0.25 0.00 0.00 0.84 0.00 0.00 57.88 58.64 2nut h LEU 584 Cb 0.06 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 40.97 2nut h LEU 584 CO -0.02 0.58 0.00 -2.11 -0.34 0.00 0.00 178.44 176.55 2nut n ARG 585 N -4.66 0.05 0.00 1.25 1.85 -0.85 -2.46 116.66 111.85 2nut n ARG 585 Ca -0.02 0.20 0.08 0.00 -1.00 0.00 0.00 57.85 57.10 2nut n ARG 585 Cb 0.20 -1.58 -0.04 0.00 -1.05 0.00 0.00 32.46 29.99 2nut n ARG 585 CO 0.00 0.00 0.00 2.89 -0.01 0.00 0.00 177.63 180.51 2nut n ARG 586 N -1.68 1.81 -1.14 2.89 1.85 -1.13 -4.68 116.66 114.57 2nut n ARG 586 Ca 0.05 -0.48 -0.30 0.00 -1.00 0.00 0.00 57.85 56.11 2nut n ARG 586 Cb 0.26 -1.25 0.13 0.00 -1.05 0.00 0.00 32.46 30.54 2nut n ARG 586 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 2nut s SER 587 N -2.11 3.68 0.00 2.89 1.04 -0.56 -4.78 113.70 113.86 2nut s SER 587 Ca 0.10 1.69 0.20 0.00 0.48 0.00 0.00 55.95 58.43 2nut s SER 587 Cb 0.12 -2.35 1.08 0.00 0.10 0.00 0.00 66.02 64.98 2nut s SER 587 CO 0.49 -2.54 1.64 -0.24 0.98 0.00 0.00 173.24 173.58 2nut n SER 588 N -3.84 0.00 0.14 7.02 2.88 -1.26 -1.34 113.62 117.22 2nut n SER 588 Ca 0.08 -0.16 0.01 0.00 -1.33 0.00 0.00 58.87 57.47 2nut n SER 588 Cb 0.54 -0.22 0.11 0.00 -0.75 0.00 0.00 64.21 63.90 2nut n SER 588 CO 0.00 0.00 0.00 -0.26 -1.23 0.00 0.00 175.04 173.55 2nut h PHE 589 N 0.00 0.00 0.00 0.66 -1.00 -1.91 -3.38 116.94 111.31 2nut h PHE 589 Ca 0.00 0.00 -0.08 0.00 2.81 0.00 0.00 57.97 60.70 2nut h PHE 589 Cb 0.14 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.69 2nut h PHE 589 CO 0.00 0.56 -1.30 1.28 -1.61 0.00 0.00 178.31 177.25 2nut n LEU 590 N -3.39 0.94 -4.37 1.54 4.77 -1.01 -4.83 117.00 110.65 2nut n LEU 590 Ca 0.01 -0.01 -0.45 0.00 -0.03 0.00 0.00 56.01 55.53 2nut n LEU 590 Cb 0.69 0.01 -0.00 0.00 -2.33 0.00 0.00 43.42 41.79 2nut n LEU 590 CO 0.41 0.26 0.91 -1.10 -1.33 0.00 0.00 177.39 176.54 2nut s GLN 591 N -2.10 4.09 0.21 3.23 -1.52 -0.45 -4.90 119.66 118.22 2nut s GLN 591 Ca -0.04 -2.93 -0.06 0.00 -1.95 0.00 0.00 55.36 50.39 2nut s GLN 591 Cb 0.01 -4.69 0.18 0.00 -0.22 0.00 0.00 33.01 28.29 2nut s GLN 591 CO 0.16 -1.40 1.67 -0.39 -0.25 0.00 0.00 175.29 175.07 2nut h VAL 592 N 4.11 1.26 -3.79 1.09 -1.51 -1.85 -3.41 116.25 112.15 2nut h VAL 592 Ca 0.21 -1.18 -0.55 0.00 -1.23 0.00 0.00 66.70 63.94 2nut h VAL 592 Cb 0.90 0.97 0.18 0.00 -2.13 0.00 0.00 31.29 31.20 2nut h VAL 592 CO 1.05 0.41 0.12 0.49 -1.23 0.00 0.00 177.57 178.41 2nut n PHE 593 N -4.16 0.72 -0.59 5.19 3.01 -1.26 -1.89 117.46 118.48 2nut n PHE 593 Ca 0.02 0.40 0.00 0.00 1.01 0.00 0.00 57.45 58.87 2nut n PHE 593 Cb 0.37 -2.09 0.00 0.00 -0.01 0.00 0.00 39.48 37.75 2nut n PHE 593 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 2nut n ASN 594 N -1.73 -0.57 -4.06 4.37 3.02 -1.26 -5.02 115.26 110.02 2nut n ASN 594 Ca 0.13 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.58 2nut n ASN 594 Cb 0.49 -0.09 -0.11 0.00 -0.61 0.00 0.00 39.78 39.46 2nut n ASN 594 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2nut s ASN 595 N -2.68 0.66 0.40 6.41 0.01 -0.79 -5.15 114.94 113.81 2nut s ASN 595 Ca 0.00 -0.70 -0.19 0.00 -0.71 0.00 0.00 52.86 51.26 2nut s ASN 595 Cb 0.00 0.09 -0.10 0.00 0.41 0.00 0.00 41.25 41.65 2nut s ASN 595 CO 0.00 -0.35 0.89 -0.94 -1.51 0.00 0.00 177.10 175.19 2nut s SER 596 N -2.05 6.88 0.46 -1.22 1.04 -1.26 -4.64 113.70 112.91 2nut s SER 596 Ca -0.05 1.56 0.20 0.00 0.48 0.00 0.00 55.95 58.15 2nut s SER 596 Cb -0.04 -2.49 1.18 0.00 0.10 0.00 0.00 66.02 64.77 2nut s SER 596 CO -0.03 -0.32 1.90 -0.65 0.98 0.00 0.00 173.24 175.12 2nut h PRO 597 N 1.98 0.28 -0.30 4.02 0.11 -1.92 -0.86 132.00 135.31 2nut h PRO 597 Ca -0.49 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 65.46 2nut h PRO 597 Cb 1.18 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2nut h PRO 597 CO 0.62 0.19 -0.42 -0.44 -0.21 0.00 0.00 178.00 177.74 2nut h ASP 598 N 0.29 0.80 -0.53 -2.05 5.19 -1.93 -2.48 116.42 115.72 2nut h ASP 598 Ca 0.40 -0.37 -0.10 0.00 -0.62 0.00 0.00 57.03 56.34 2nut h ASP 598 Cb 1.13 -0.23 -0.02 0.00 0.18 0.00 0.00 39.33 40.39 2nut h ASP 598 CO -0.11 1.11 -0.05 -0.33 -3.12 0.00 0.00 179.24 176.75 2nut h GLU 599 N 0.61 0.97 -0.70 3.56 5.08 -1.55 -2.02 114.58 120.52 2nut h GLU 599 Ca 0.05 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.07 2nut h GLU 599 Cb 0.97 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.11 2nut h GLU 599 CO 0.09 1.00 0.42 0.77 -1.00 0.00 0.00 179.01 180.29 2nut h SER 600 N 0.84 0.85 0.30 1.42 0.02 -1.35 -0.78 113.55 114.85 2nut h SER 600 Ca 0.14 -0.07 -0.10 0.00 -0.84 0.00 0.00 61.79 60.93 2nut h SER 600 Cb 0.60 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.91 2nut h SER 600 CO 0.04 0.67 -0.41 0.28 -1.14 0.00 0.00 176.83 176.27 2nut h SER 601 N 0.96 0.16 -0.10 3.07 0.02 -1.26 -2.33 113.55 114.08 2nut h SER 601 Ca 0.25 -0.06 -0.04 0.00 -0.84 0.00 0.00 61.79 61.09 2nut h SER 601 Cb -0.02 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 62.47 2nut h SER 601 CO -0.05 0.55 -0.11 0.22 -1.14 0.00 0.00 176.83 176.31 2nut h TYR 602 N 0.13 0.30 -0.30 3.45 3.20 -0.86 -1.80 116.97 121.08 2nut h TYR 602 Ca 0.01 -0.09 0.02 0.00 3.14 0.00 0.00 58.73 61.81 2nut h TYR 602 Cb 0.78 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.96 2nut h TYR 602 CO 0.01 0.68 0.15 1.88 -1.64 0.00 0.00 178.16 179.24 2nut h TYR 603 N -0.17 0.28 -0.50 -3.82 0.99 -1.02 -2.74 116.97 109.99 2nut h TYR 603 Ca 0.01 0.01 -0.11 0.00 2.00 0.00 0.00 58.73 60.65 2nut h TYR 603 Cb 0.64 -0.08 -0.02 0.00 1.00 0.00 0.00 36.73 38.27 2nut h TYR 603 CO 0.09 0.15 -0.12 0.00 -0.00 0.00 0.00 178.16 178.29 2nut h ARG 604 N 0.32 0.93 -0.52 4.88 3.08 -1.48 -2.00 114.38 119.60 2nut h ARG 604 Ca 0.12 -0.34 0.08 0.00 0.07 0.00 0.00 59.98 59.91 2nut h ARG 604 Cb 0.04 -0.06 -0.06 0.00 0.08 0.00 0.00 29.97 29.96 2nut h ARG 604 CO -0.08 1.00 0.17 1.25 -1.07 0.00 0.00 179.97 181.23 2nut h HIS 605 N 0.83 0.30 -0.03 3.04 2.76 -1.09 0.02 115.15 120.98 2nut h HIS 605 Ca 0.13 0.03 -0.16 0.00 -2.20 0.00 0.00 60.37 58.16 2nut h HIS 605 Cb 0.66 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.55 2nut h HIS 605 CO 0.04 0.08 -0.71 0.45 -1.30 0.00 0.00 177.93 176.49 2nut h HIS 606 N 0.34 0.25 -0.23 5.26 3.86 -1.37 -3.11 115.15 120.15 2nut h HIS 606 Ca 0.25 -0.11 -0.11 0.00 -1.16 0.00 0.00 60.37 59.24 2nut h HIS 606 Cb 0.29 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.71 2nut h HIS 606 CO -0.18 0.83 -0.32 0.35 0.86 0.00 0.00 177.93 179.47 2nut h PHE 607 N 0.12 0.56 0.00 2.45 3.57 -0.58 -2.71 116.94 120.35 2nut h PHE 607 Ca -0.02 -0.14 0.00 0.00 3.53 0.00 0.00 57.97 61.34 2nut h PHE 607 Cb 1.26 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.87 2nut h PHE 607 CO 0.02 0.75 0.00 -1.33 -2.23 0.00 0.00 178.31 175.52 2nut n MET 608 N -4.08 0.78 0.00 1.11 2.81 -0.08 -3.49 117.12 114.18 2nut n MET 608 Ca -0.01 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.88 2nut n MET 608 Cb 0.45 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.46 2nut n MET 608 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2nut n ARG 609 N -1.02 1.39 -1.80 0.03 1.74 -1.15 -4.20 116.66 111.65 2nut n ARG 609 Ca 0.19 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.95 2nut n ARG 609 Cb 0.09 -0.88 0.03 0.00 -1.02 0.00 0.00 32.46 30.69 2nut n ARG 609 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2nut s GLN 610 N -1.67 3.04 0.93 5.56 -1.52 -1.03 -0.23 119.66 124.73 2nut s GLN 610 Ca 0.00 1.16 -0.15 0.00 -1.95 0.00 0.00 55.36 54.42 2nut s GLN 610 Cb 0.00 -2.00 0.17 0.00 -0.22 0.00 0.00 33.01 30.97 2nut s GLN 610 CO 0.00 -1.04 1.29 0.16 -0.25 0.00 0.00 175.29 175.46 2nut s ASP 611 N -3.08 3.42 0.08 5.90 3.84 -1.26 -4.63 116.67 120.95 2nut s ASP 611 Ca 0.62 0.37 -0.34 0.00 -0.00 0.00 0.00 52.55 53.20 2nut s ASP 611 Cb -0.16 -0.51 -0.17 0.00 -1.38 0.00 0.00 42.92 40.70 2nut s ASP 611 CO 0.44 -2.55 1.59 0.25 -0.00 0.00 0.00 175.17 174.90 2nut h LEU 612 N -1.51 -1.11 -0.26 2.11 5.85 -1.96 -0.76 115.31 117.66 2nut h LEU 612 Ca -0.45 0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.39 2nut h LEU 612 Cb 1.25 0.35 -0.07 0.00 0.37 0.00 0.00 40.66 42.56 2nut h LEU 612 CO 0.44 -0.62 -0.53 0.74 -0.34 0.00 0.00 178.44 178.13 2nut h THR 613 N -0.97 0.00 -0.74 1.05 2.02 -2.00 -0.47 112.91 111.80 2nut h THR 613 Ca -0.07 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.15 2nut h THR 613 Cb 0.81 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 67.18 2nut h THR 613 CO 0.02 0.00 0.49 1.56 0.37 0.00 0.00 175.52 177.95 2nut h GLN 614 N -0.47 0.86 -0.44 6.66 1.08 -1.95 -2.62 115.11 118.23 2nut h GLN 614 Ca 0.05 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.19 2nut h GLN 614 Cb 0.61 -0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 27.83 2nut h GLN 614 CO -0.50 0.57 0.26 0.77 -0.95 0.00 0.00 178.83 178.99 2nut h SER 615 N 0.89 0.54 -1.00 1.46 0.02 0.07 -2.19 113.55 113.34 2nut h SER 615 Ca 0.30 -0.06 0.02 0.00 -0.84 0.00 0.00 61.79 61.21 2nut h SER 615 Cb 0.07 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.42 2nut h SER 615 CO -0.09 0.44 0.66 -0.07 -1.14 0.00 0.00 176.83 176.64 2nut h LEU 616 N 0.59 1.11 -0.77 5.07 3.38 -0.76 -2.22 115.31 121.70 2nut h LEU 616 Ca 0.16 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 2nut h LEU 616 Cb 0.01 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.46 2nut h LEU 616 CO -0.03 0.78 0.26 0.40 0.09 0.00 0.00 178.44 179.95 2nut h ILE 617 N 1.30 1.26 -0.73 1.22 2.04 -1.27 0.56 117.51 121.89 2nut h ILE 617 Ca 0.38 -0.89 0.01 0.00 1.00 0.00 0.00 64.86 65.36 2nut h ILE 617 Cb -0.07 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 36.36 2nut h ILE 617 CO -0.10 0.36 0.48 0.24 0.00 0.00 0.00 178.15 179.13 2nut h MET 618 N 1.14 0.96 0.04 2.37 2.86 -0.82 -2.68 114.93 118.79 2nut h MET 618 Ca 0.25 -0.06 -0.17 0.00 -2.06 0.00 0.00 59.70 57.66 2nut h MET 618 Cb 0.28 -0.22 0.02 0.00 0.06 0.00 0.00 31.60 31.74 2nut h MET 618 CO -0.01 0.63 -0.70 0.82 1.06 0.00 0.00 176.91 178.71 2nut h ILE 619 N 0.99 1.43 -3.02 -1.22 1.08 -1.17 -3.42 117.51 112.18 2nut h ILE 619 Ca 0.27 -2.21 -0.60 0.00 -0.39 0.00 0.00 64.86 61.93 2nut h ILE 619 Cb -0.11 2.73 -0.40 0.00 -3.07 0.00 0.00 36.82 35.97 2nut h ILE 619 CO -0.06 0.64 -0.75 -1.58 -0.69 0.00 0.00 178.15 175.71 2nut s GLN 620 N -3.03 1.03 0.20 2.37 0.74 0.16 -4.55 119.66 116.59 2nut s GLN 620 Ca -0.13 -1.63 -0.32 0.00 0.05 0.00 0.00 55.36 53.33 2nut s GLN 620 Cb 0.03 -2.14 -0.15 0.00 1.10 0.00 0.00 33.01 31.85 2nut s GLN 620 CO 0.83 -1.10 1.22 -2.30 -0.55 0.00 0.00 175.29 173.39 2nut n PRO 621 N 4.04 1.44 -2.97 1.67 -0.02 -1.02 -4.41 135.00 133.74 2nut n PRO 621 Ca 0.05 0.51 -0.35 0.00 -2.02 0.00 0.00 63.50 61.69 2nut n PRO 621 Cb 0.37 -2.04 -0.06 0.00 -0.02 0.00 0.00 33.50 31.75 2nut n PRO 621 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 2nut s ILE 622 N -0.23 4.45 -0.05 4.25 -5.25 -1.17 -4.83 121.20 118.36 2nut s ILE 622 Ca 0.70 1.44 0.02 0.00 -0.99 0.00 0.00 60.65 61.82 2nut s ILE 622 Cb -0.78 -3.84 0.02 0.00 2.95 0.00 0.00 42.46 40.81 2nut s ILE 622 CO 0.52 0.07 -0.09 -0.22 -1.79 0.00 0.00 174.94 173.43 2nut s LEU 623 N -2.29 1.53 -0.05 0.37 2.96 -1.26 -1.79 118.68 118.15 2nut s LEU 623 Ca 0.49 -0.23 0.06 0.00 -0.22 0.00 0.00 54.13 54.23 2nut s LEU 623 Cb -0.15 -0.67 -0.02 0.00 0.50 0.00 0.00 46.19 45.85 2nut s LEU 623 CO 0.20 0.00 -0.22 -0.31 -1.32 0.00 0.00 176.35 174.70 2nut s TYR 624 N 0.73 2.49 -0.10 5.38 1.51 -0.26 -0.47 117.35 126.62 2nut s TYR 624 Ca -0.13 -0.50 -0.04 0.00 -1.01 0.00 0.00 57.07 55.38 2nut s TYR 624 Cb -0.15 -1.59 -0.04 0.00 -0.11 0.00 0.00 41.96 40.07 2nut s TYR 624 CO 0.02 -0.07 0.06 0.00 -1.11 0.00 0.00 175.55 174.45 2nut s ALA 625 N -0.39 3.54 -0.08 3.71 0.00 0.67 -0.93 121.76 128.28 2nut s ALA 625 Ca 0.04 -0.73 0.02 0.00 0.00 0.00 0.00 51.96 51.28 2nut s ALA 625 Cb -0.12 -1.70 0.02 0.00 0.00 0.00 0.00 23.12 21.32 2nut s ALA 625 CO 0.02 0.60 -0.12 0.71 0.00 0.00 0.00 175.76 176.96 2nut s TYR 626 N -0.93 1.55 0.12 0.00 1.51 0.27 -2.17 117.35 117.71 2nut s TYR 626 Ca 0.14 -0.64 -0.25 0.00 -1.01 0.00 0.00 57.07 55.31 2nut s TYR 626 Cb -0.12 -1.16 0.07 0.00 -0.11 0.00 0.00 41.96 40.64 2nut s TYR 626 CO 0.03 -0.36 0.77 -1.54 -1.11 0.00 0.00 175.55 173.34 2nut s SER 627 N 0.93 -0.39 0.27 2.29 1.04 -1.26 0.83 113.70 117.40 2nut s SER 627 Ca -0.09 -0.16 -0.02 0.00 0.48 0.00 0.00 55.95 56.16 2nut s SER 627 Cb -0.15 0.53 0.42 0.00 0.10 0.00 0.00 66.02 66.92 2nut s SER 627 CO 0.00 -0.90 1.87 -0.26 0.98 0.00 0.00 173.24 174.94 2nut h PHE 628 N 2.00 1.18 0.00 5.02 -1.00 -1.98 -3.32 116.94 118.84 2nut h PHE 628 Ca -0.26 0.03 -0.56 0.00 2.81 0.00 0.00 57.97 59.99 2nut h PHE 628 Cb 1.27 -0.38 0.06 0.00 3.61 0.00 0.00 35.95 40.51 2nut h PHE 628 CO 0.29 0.59 2.06 -1.13 -1.61 0.00 0.00 178.31 178.51 2nut n SER 629 N -4.53 2.34 0.00 2.17 3.41 -1.26 -4.74 113.62 111.01 2nut n SER 629 Ca 0.16 -2.55 0.00 0.00 -0.26 0.00 0.00 58.87 56.22 2nut n SER 629 Cb 0.21 -0.94 0.00 0.00 -0.26 0.00 0.00 64.21 63.22 2nut n SER 629 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2nut n GLY 630 N 4.50 2.39 3.76 5.00 0.00 -1.25 -5.06 105.19 114.53 2nut n GLY 630 Ca 0.45 -1.89 -0.29 0.00 0.00 0.00 0.00 46.02 44.29 2nut n GLY 630 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2nut s PRO 631 N -3.13 1.39 0.22 1.61 0.04 -1.26 -4.33 135.00 129.53 2nut s PRO 631 Ca 0.00 0.55 -0.30 0.00 0.04 0.00 0.00 61.00 61.29 2nut s PRO 631 Cb 0.00 -1.85 -0.15 0.00 0.04 0.00 0.00 34.50 32.54 2nut s PRO 631 CO 0.00 -2.09 1.01 -2.30 0.04 0.00 0.00 177.00 173.66 2nut n PRO 632 N -3.73 1.06 -3.89 0.56 -0.02 -1.26 -4.88 135.00 122.83 2nut n PRO 632 Ca 0.07 0.37 -0.11 0.00 -2.02 0.00 0.00 63.50 61.81 2nut n PRO 632 Cb 0.57 -1.75 -0.10 0.00 -0.02 0.00 0.00 33.50 32.20 2nut n PRO 632 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2nut s GLU 633 N -0.95 0.41 0.26 -0.52 2.02 -0.92 -4.96 118.70 114.03 2nut s GLU 633 Ca 0.66 -0.39 -0.30 0.00 0.02 0.00 0.00 54.97 54.96 2nut s GLU 633 Cb -0.81 0.17 -0.09 0.00 0.10 0.00 0.00 34.13 33.50 2nut s GLU 633 CO 0.56 -0.09 1.03 -2.14 0.02 0.00 0.00 175.26 174.64 2nut s PRO 634 N -1.26 4.74 0.07 0.39 0.02 -1.26 -0.24 135.00 137.46 2nut s PRO 634 Ca -0.14 1.66 0.01 0.00 0.02 0.00 0.00 61.00 62.56 2nut s PRO 634 Cb -0.07 -3.23 -0.04 0.00 0.02 0.00 0.00 34.50 31.17 2nut s PRO 634 CO 0.01 0.34 -0.05 0.14 -0.33 0.00 0.00 177.00 177.11 2nut s VAL 635 N -1.14 0.51 0.43 3.83 -7.23 0.38 -4.88 120.40 112.30 2nut s VAL 635 Ca 0.43 -1.75 -0.25 0.00 -1.81 0.00 0.00 61.98 58.60 2nut s VAL 635 Cb -0.29 -1.44 -0.10 0.00 0.56 0.00 0.00 36.38 35.11 2nut s VAL 635 CO 0.37 -0.84 1.17 0.18 -0.31 0.00 0.00 175.10 175.67 2nut n LEU 636 N 0.25 3.53 -4.22 1.32 4.32 -1.26 -4.25 117.00 116.69 2nut n LEU 636 Ca -0.14 1.07 -0.42 0.00 -0.02 0.00 0.00 56.01 56.50 2nut n LEU 636 Cb 0.60 -1.44 -0.01 0.00 -1.62 0.00 0.00 43.42 40.95 2nut n LEU 636 CO 0.28 -0.99 2.22 -0.11 -1.22 0.00 0.00 177.39 177.57 2nut n LEU 637 N 0.25 5.49 -3.98 2.23 0.00 -1.26 -4.67 117.00 115.07 2nut n LEU 637 Ca 0.08 -3.90 -0.08 0.00 0.00 0.00 0.00 56.01 52.10 2nut n LEU 637 Cb 0.40 -1.69 -0.09 0.00 0.00 0.00 0.00 43.42 42.04 2nut n LEU 637 CO 0.58 0.35 -0.25 -0.62 0.00 0.00 0.00 177.39 177.45 2nut s ASP 638 N 4.03 0.29 0.52 1.96 -1.08 -1.26 -2.24 116.67 118.89 2nut s ASP 638 Ca 0.53 -0.75 0.26 0.00 -0.52 0.00 0.00 52.55 52.07 2nut s ASP 638 Cb 0.08 0.24 1.46 0.00 -1.46 0.00 0.00 42.92 43.24 2nut s ASP 638 CO 0.02 -0.60 2.09 0.28 0.52 0.00 0.00 175.17 177.49 2nut h SER 639 N 3.25 0.00 0.40 -0.34 0.02 -1.90 -1.75 113.55 113.23 2nut h SER 639 Ca -0.33 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 2nut h SER 639 Cb 1.17 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.71 2nut h SER 639 CO 0.58 0.11 0.00 -1.54 -1.14 0.00 0.00 176.83 174.84 2nut n SER 640 N -3.75 0.00 -0.28 3.07 3.41 -1.26 -1.92 113.62 112.89 2nut n SER 640 Ca -0.02 0.41 0.11 0.00 -0.26 0.00 0.00 58.87 59.11 2nut n SER 640 Cb 0.21 -0.45 0.02 0.00 -0.26 0.00 0.00 64.21 63.73 2nut n SER 640 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2nut n SER 641 N -1.45 1.49 -4.45 4.04 7.64 -0.66 -4.72 113.62 115.51 2nut n SER 641 Ca 0.04 -1.19 -0.43 0.00 1.01 0.00 0.00 58.87 58.29 2nut n SER 641 Cb 0.14 0.59 0.00 0.00 -1.01 0.00 0.00 64.21 63.93 2nut n SER 641 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2nut n ILE 642 N -0.66 4.08 -2.60 0.44 2.08 -0.81 -4.99 119.36 116.89 2nut n ILE 642 Ca 0.08 -4.35 -0.29 0.00 0.56 0.00 0.00 62.75 58.75 2nut n ILE 642 Cb 0.40 -2.41 -0.01 0.00 -0.75 0.00 0.00 39.64 36.86 2nut n ILE 642 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 2nut s LEU 643 N 2.71 3.65 0.21 1.39 1.43 -1.26 -5.01 118.68 121.81 2nut s LEU 643 Ca 0.48 1.11 0.11 0.00 -1.03 0.00 0.00 54.13 54.81 2nut s LEU 643 Cb 0.02 -4.05 -0.03 0.00 0.03 0.00 0.00 46.19 42.15 2nut s LEU 643 CO 0.03 -0.55 1.38 0.00 0.23 0.00 0.00 176.35 177.45 2nut h ALA 644 N 0.60 0.54 -0.81 4.21 0.00 -1.94 -3.31 119.26 118.55 2nut h ALA 644 Ca -0.47 -0.66 -0.49 0.00 0.00 0.00 0.00 54.91 53.30 2nut h ALA 644 Cb 1.19 -0.12 -0.27 0.00 0.00 0.00 0.00 17.79 18.60 2nut h ALA 644 CO 0.63 0.90 0.37 -0.40 0.00 0.00 0.00 179.25 180.75 2nut n ASP 645 N -3.30 4.71 -3.96 0.00 5.75 -1.26 -1.60 116.55 116.89 2nut n ASP 645 Ca 0.01 -3.73 -0.09 0.00 -0.01 0.00 0.00 54.79 50.97 2nut n ASP 645 Cb 0.82 -0.78 -0.10 0.00 -1.03 0.00 0.00 41.12 40.03 2nut n ASP 645 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 2nut s ARG 646 N -3.48 0.50 -0.14 0.11 3.52 -1.25 -4.77 118.95 113.45 2nut s ARG 646 Ca 0.56 -0.73 -0.02 0.00 -0.13 0.00 0.00 55.73 55.40 2nut s ARG 646 Cb 0.46 0.19 -0.02 0.00 -1.56 0.00 0.00 34.95 34.02 2nut s ARG 646 CO 0.04 -0.11 -0.06 0.42 -0.81 0.00 0.00 175.30 174.77 2nut s ILE 647 N -2.31 3.65 -0.01 4.11 -1.09 0.24 -2.64 121.20 123.15 2nut s ILE 647 Ca -0.08 -0.45 0.02 0.00 -2.23 0.00 0.00 60.65 57.91 2nut s ILE 647 Cb -0.03 -2.58 -0.03 0.00 -1.58 0.00 0.00 42.46 38.24 2nut s ILE 647 CO -0.04 0.51 -0.03 -0.76 -1.23 0.00 0.00 174.94 173.39 2nut s LEU 648 N 0.25 3.34 -0.15 2.97 1.43 -0.29 0.95 118.68 127.17 2nut s LEU 648 Ca -0.05 -0.06 0.01 0.00 -1.03 0.00 0.00 54.13 53.01 2nut s LEU 648 Cb -0.14 -1.89 0.02 0.00 0.03 0.00 0.00 46.19 44.20 2nut s LEU 648 CO 0.04 0.29 -0.18 -0.22 0.23 0.00 0.00 176.35 176.51 2nut s LEU 649 N -1.40 1.93 -0.19 1.79 2.96 -0.11 -0.44 118.68 123.21 2nut s LEU 649 Ca 0.18 -0.56 -0.02 0.00 -0.22 0.00 0.00 54.13 53.50 2nut s LEU 649 Cb -0.11 -1.33 -0.01 0.00 0.50 0.00 0.00 46.19 45.25 2nut s LEU 649 CO 0.08 0.00 -0.09 -0.32 -1.32 0.00 0.00 176.35 174.70 2nut s MET 650 N 1.22 3.33 -0.55 1.98 -2.45 0.10 -1.10 119.30 121.82 2nut s MET 650 Ca 0.01 -0.67 -0.12 0.00 -1.25 0.00 0.00 55.69 53.66 2nut s MET 650 Cb -0.14 -2.85 0.14 0.00 1.25 0.00 0.00 34.83 33.23 2nut s MET 650 CO -0.09 -0.09 0.46 0.34 1.05 0.00 0.00 175.02 176.69 2nut s ASP 651 N 1.16 6.00 0.18 1.11 2.15 -0.74 -0.60 116.67 125.93 2nut s ASP 651 Ca 0.02 -2.02 -0.11 0.00 0.43 0.00 0.00 52.55 50.87 2nut s ASP 651 Cb -0.14 -2.10 -0.07 0.00 -0.30 0.00 0.00 42.92 40.30 2nut s ASP 651 CO -0.03 -0.73 0.53 -0.89 -0.17 0.00 0.00 175.17 173.89 2nut s THR 652 N 1.22 4.93 0.30 1.71 2.01 0.28 -3.07 115.64 123.03 2nut s THR 652 Ca 0.07 0.57 -0.01 0.00 0.31 0.00 0.00 61.69 62.62 2nut s THR 652 Cb -0.25 -3.66 0.27 0.00 0.01 0.00 0.00 72.50 68.87 2nut s THR 652 CO -0.00 0.07 1.96 0.15 -0.69 0.00 0.00 174.62 176.10 2nut h PHE 653 N 3.01 1.03 0.00 4.92 3.57 -1.89 -2.25 116.94 125.34 2nut h PHE 653 Ca -0.48 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.01 2nut h PHE 653 Cb 1.18 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 39.57 2nut h PHE 653 CO 0.63 0.62 -0.21 0.74 -2.23 0.00 0.00 178.31 177.87 2nut h PHE 654 N 1.09 0.00 -3.54 0.41 -1.00 -1.95 -3.42 116.94 108.52 2nut h PHE 654 Ca 0.32 0.00 -0.18 0.00 2.81 0.00 0.00 57.97 60.92 2nut h PHE 654 Cb -0.04 0.00 -0.24 0.00 3.61 0.00 0.00 35.95 39.27 2nut h PHE 654 CO -0.00 0.21 -0.57 -0.65 -1.61 0.00 0.00 178.31 175.69 2nut s GLN 655 N -3.21 0.26 -0.25 1.51 -0.21 -0.84 -2.09 119.66 114.83 2nut s GLN 655 Ca 0.05 -0.11 -0.02 0.00 0.02 0.00 0.00 55.36 55.30 2nut s GLN 655 Cb 0.07 0.11 0.02 0.00 1.00 0.00 0.00 33.01 34.21 2nut s GLN 655 CO 0.68 -0.05 -0.06 0.42 -2.12 0.00 0.00 175.29 174.17 2nut s ILE 656 N -0.56 2.95 -0.04 1.08 -1.09 -0.80 0.10 121.20 122.83 2nut s ILE 656 Ca -0.06 -0.95 0.07 0.00 -2.23 0.00 0.00 60.65 57.47 2nut s ILE 656 Cb -0.04 -2.47 -0.02 0.00 -1.58 0.00 0.00 42.46 38.35 2nut s ILE 656 CO 0.00 0.23 -0.25 -0.22 -1.23 0.00 0.00 174.94 173.47 2nut s LEU 657 N 1.35 2.10 -0.19 2.97 0.20 0.23 -1.96 118.68 123.37 2nut s LEU 657 Ca 0.01 -0.47 -0.01 0.00 0.69 0.00 0.00 54.13 54.34 2nut s LEU 657 Cb -0.16 -1.37 0.01 0.00 -0.43 0.00 0.00 46.19 44.23 2nut s LEU 657 CO -0.04 0.28 -0.13 -0.63 -0.29 0.00 0.00 176.35 175.54 2nut s ILE 658 N -0.39 2.69 -0.15 6.68 1.01 0.05 0.01 121.20 131.10 2nut s ILE 658 Ca 0.03 -0.73 -0.03 0.00 0.00 0.00 0.00 60.65 59.93 2nut s ILE 658 Cb -0.12 -2.18 -0.02 0.00 0.01 0.00 0.00 42.46 40.15 2nut s ILE 658 CO 0.01 0.49 -0.07 -0.47 0.00 0.00 0.00 174.94 174.91 2nut s TYR 659 N 1.32 2.96 -0.37 3.97 5.04 0.41 -1.59 117.35 129.09 2nut s TYR 659 Ca 0.04 -0.41 -0.09 0.00 -2.44 0.00 0.00 57.07 54.18 2nut s TYR 659 Cb -0.14 -1.92 0.04 0.00 0.35 0.00 0.00 41.96 40.29 2nut s TYR 659 CO -0.07 -0.09 0.17 -1.01 -1.34 0.00 0.00 175.55 173.21 2nut s HIS 660 N 0.37 3.27 0.63 4.97 3.76 -0.77 -1.14 115.29 126.37 2nut s HIS 660 Ca -0.06 -1.26 -0.18 0.00 -0.15 0.00 0.00 55.06 53.41 2nut s HIS 660 Cb -0.15 -2.47 -0.04 0.00 1.11 0.00 0.00 32.58 31.03 2nut s HIS 660 CO 0.04 -0.72 0.86 0.41 -0.85 0.00 0.00 174.74 174.48 2nut n GLY 661 N 4.90 -0.63 0.32 -2.22 0.00 -1.08 -1.94 105.19 104.55 2nut n GLY 661 Ca -0.12 -0.20 -0.06 0.00 0.00 0.00 0.00 46.02 45.64 2nut n GLY 661 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2nut n GLU 662 N -1.01 -0.30 0.15 1.61 2.13 -1.22 0.61 120.64 122.60 2nut n GLU 662 Ca 0.13 1.20 -0.14 0.00 0.66 0.00 0.00 57.16 59.01 2nut n GLU 662 Cb 0.48 -1.77 -0.07 0.00 0.27 0.00 0.00 31.44 30.35 2nut n GLU 662 CO 0.00 0.00 0.00 1.15 -0.41 0.00 0.00 177.13 177.87 2nut h THR 663 N 0.00 0.24 0.00 6.31 2.02 -1.63 0.02 112.91 119.87 2nut h THR 663 Ca 0.17 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.35 2nut h THR 663 Cb 0.37 0.24 -0.00 0.00 -1.74 0.00 0.00 68.15 67.02 2nut h THR 663 CO -0.76 0.00 -0.00 0.40 0.37 0.00 0.00 175.52 175.53 2nut h ILE 664 N -0.64 0.01 -0.27 3.11 1.08 -0.61 -0.53 117.51 119.66 2nut h ILE 664 Ca 0.01 -0.28 -0.18 0.00 -0.39 0.00 0.00 64.86 64.01 2nut h ILE 664 Cb 0.64 1.28 0.00 0.00 -3.07 0.00 0.00 36.82 35.67 2nut h ILE 664 CO -0.17 0.00 -0.55 0.00 -0.69 0.00 0.00 178.15 176.74 2nut h ALA 665 N 2.00 0.43 0.51 1.87 0.00 0.16 -2.29 119.26 121.94 2nut h ALA 665 Ca -0.00 -0.52 -0.03 0.00 0.00 0.00 0.00 54.91 54.37 2nut h ALA 665 Cb 0.28 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.01 2nut h ALA 665 CO 0.00 0.65 -0.25 1.96 0.00 0.00 0.00 179.25 181.61 2nut h GLN 666 N 0.62 -0.67 -0.89 0.00 4.20 0.18 0.27 115.11 118.82 2nut h GLN 666 Ca 0.01 0.05 0.26 0.00 0.06 0.00 0.00 58.65 59.02 2nut h GLN 666 Cb 1.16 0.15 -0.04 0.00 0.30 0.00 0.00 27.48 29.06 2nut h GLN 666 CO 0.12 -0.42 0.88 -1.49 -0.67 0.00 0.00 178.83 177.26 2nut h TRP 667 N -1.16 0.00 0.02 2.96 6.55 -1.23 1.50 115.95 124.60 2nut h TRP 667 Ca -0.07 0.00 -0.30 0.00 0.95 0.00 0.00 58.89 59.47 2nut h TRP 667 Cb 0.55 0.00 -0.04 0.00 -0.86 0.00 0.00 29.16 28.81 2nut h TRP 667 CO 0.00 0.00 -1.73 -0.09 -1.05 0.00 0.00 178.44 175.58 2nut h ARG 668 N 0.00 0.04 0.00 0.49 1.12 -1.21 -3.01 114.38 111.81 2nut h ARG 668 Ca 0.42 -0.07 -0.13 0.00 -1.11 0.00 0.00 59.98 59.10 2nut h ARG 668 Cb 2.19 0.02 -0.02 0.00 -0.01 0.00 0.00 29.97 32.16 2nut h ARG 668 CO -0.00 0.61 -0.61 0.87 -3.11 0.00 0.00 179.97 177.72 2nut h LYS 669 N 0.01 0.00 -0.18 0.20 1.57 0.49 -3.21 116.57 115.44 2nut h LYS 669 Ca -0.30 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.42 2nut h LYS 669 Cb 2.01 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 34.32 2nut h LYS 669 CO 0.08 0.61 -0.15 1.03 -0.57 0.00 0.00 179.45 180.45 2nut h SER 670 N 0.00 0.45 0.00 0.86 0.87 0.15 -3.48 113.55 112.39 2nut h SER 670 Ca -0.01 -0.46 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 2nut h SER 670 Cb 1.31 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 2nut h SER 670 CO 0.08 0.82 0.00 0.61 -0.53 0.00 0.00 176.83 177.81 2nut n GLY 671 N 0.14 0.92 0.38 5.77 0.00 -1.15 -4.99 105.19 106.27 2nut n GLY 671 Ca -0.05 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.11 2nut n GLY 671 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2nut h TYR 672 N 0.00 0.00 -0.73 1.61 -1.99 -1.84 -2.16 116.97 111.86 2nut h TYR 672 Ca 0.00 0.00 0.06 0.00 2.00 0.00 0.00 58.73 60.79 2nut h TYR 672 Cb 0.00 0.00 -0.06 0.00 2.00 0.00 0.00 36.73 38.67 2nut h TYR 672 CO 0.00 0.00 0.43 1.96 -0.00 0.00 0.00 178.16 180.55 2nut h GLN 673 N 0.00 0.77 -0.33 4.88 7.50 -1.86 -2.98 115.11 123.08 2nut h GLN 673 Ca 0.14 -0.05 -0.13 0.00 0.50 0.00 0.00 58.65 59.11 2nut h GLN 673 Cb 1.56 -0.17 -0.01 0.00 0.05 0.00 0.00 27.48 28.91 2nut h GLN 673 CO -0.00 0.51 -0.30 0.22 -1.50 0.00 0.00 178.83 177.75 2nut h ASP 674 N 0.79 0.84 -1.61 1.46 3.58 -1.72 -3.44 116.42 116.33 2nut h ASP 674 Ca 0.32 -0.46 -0.69 0.00 0.42 0.00 0.00 57.03 56.62 2nut h ASP 674 Cb 0.17 -0.24 0.05 0.00 1.72 0.00 0.00 39.33 41.04 2nut h ASP 674 CO -0.17 1.13 0.46 0.23 -2.88 0.00 0.00 179.24 178.00 2nut n MET 675 N -4.20 1.04 0.11 0.28 2.81 -1.13 -4.80 117.12 111.24 2nut n MET 675 Ca -0.03 0.38 0.09 0.00 -1.81 0.00 0.00 57.70 56.33 2nut n MET 675 Cb 0.49 -2.01 0.43 0.00 -0.71 0.00 0.00 33.22 31.42 2nut n MET 675 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 2nut n PRO 676 N 2.66 0.12 -0.04 0.03 -0.04 -1.26 -1.38 135.00 135.08 2nut n PRO 676 Ca 0.19 0.51 -0.13 0.00 -0.04 0.00 0.00 63.50 64.04 2nut n PRO 676 Cb 0.18 -1.81 -0.00 0.00 -0.04 0.00 0.00 33.50 31.83 2nut n PRO 676 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2nut h GLU 677 N 0.00 0.73 -2.11 0.54 5.08 -1.90 -3.33 114.58 113.59 2nut h GLU 677 Ca 0.00 -0.47 -0.75 0.00 -1.00 0.00 0.00 59.36 57.13 2nut h GLU 677 Cb 0.13 0.06 -0.30 0.00 0.50 0.00 0.00 28.75 29.14 2nut h GLU 677 CO 0.00 1.10 0.72 0.66 -1.00 0.00 0.00 179.01 180.48 2nut n TYR 678 N -3.98 3.04 0.56 4.33 4.02 -0.48 -4.62 117.16 120.03 2nut n TYR 678 Ca -0.04 -2.69 0.08 0.00 -0.01 0.00 0.00 57.90 55.25 2nut n TYR 678 Cb 0.63 -1.03 0.36 0.00 -0.02 0.00 0.00 39.34 39.29 2nut n TYR 678 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 2nut n GLU 679 N -0.28 0.01 0.11 -0.72 1.02 -1.25 -1.96 120.64 117.57 2nut n GLU 679 Ca 0.47 0.23 -0.23 0.00 -0.02 0.00 0.00 57.16 57.61 2nut n GLU 679 Cb 0.30 -1.53 -0.15 0.00 -0.02 0.00 0.00 31.44 30.04 2nut n GLU 679 CO 0.00 0.00 0.00 -2.95 1.18 0.00 0.00 177.13 175.36 2nut h ASN 680 N 0.00 0.70 0.51 1.62 -1.07 -1.92 -3.05 115.58 112.36 2nut h ASN 680 Ca 0.00 -0.87 0.00 0.00 0.07 0.00 0.00 56.30 55.50 2nut h ASN 680 Cb 0.29 -0.23 0.00 0.00 -2.07 0.00 0.00 38.32 36.32 2nut h ASN 680 CO 0.00 1.71 0.00 0.15 0.07 0.00 0.00 177.43 179.36 2nut h PHE 681 N 0.12 0.00 0.00 4.14 3.57 -1.76 -2.56 116.94 120.45 2nut h PHE 681 Ca -0.29 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.19 2nut h PHE 681 Cb 2.12 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.86 2nut h PHE 681 CO 0.11 0.00 -0.13 0.00 -2.23 0.00 0.00 178.31 176.06 2nut h ARG 682 N 0.00 0.00 -1.03 1.11 3.08 -1.55 -2.00 114.38 114.00 2nut h ARG 682 Ca 0.00 0.00 0.25 0.00 0.07 0.00 0.00 59.98 60.30 2nut h ARG 682 Cb 0.25 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.20 2nut h ARG 682 CO 0.00 0.91 0.65 0.45 -1.07 0.00 0.00 179.97 180.91 2nut h HIS 683 N -1.00 0.73 0.47 3.04 3.86 -1.38 -0.60 115.15 120.27 2nut h HIS 683 Ca -0.04 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.18 2nut h HIS 683 Cb 0.95 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 29.21 2nut h HIS 683 CO 0.24 0.08 -0.23 1.25 0.86 0.00 0.00 177.93 180.13 2nut h LEU 684 N 0.45 -0.53 -2.21 2.43 5.85 -1.52 -0.35 115.31 119.43 2nut h LEU 684 Ca 0.59 0.02 0.00 0.00 0.84 0.00 0.00 57.88 59.33 2nut h LEU 684 Cb 1.40 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.57 2nut h LEU 684 CO -0.32 -0.22 0.26 -0.07 -0.34 0.00 0.00 178.44 177.75 2nut h LEU 685 N -0.96 0.00 -0.51 2.25 3.38 -0.59 -1.69 115.31 117.19 2nut h LEU 685 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2nut h LEU 685 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2nut h LEU 685 CO 0.11 0.00 -0.27 1.67 0.09 0.00 0.00 178.44 180.03 2nut n GLN 686 N -2.92 2.72 -0.14 1.13 7.27 -0.31 -4.50 117.38 120.63 2nut n GLN 686 Ca -0.02 -0.40 -0.06 0.00 0.07 0.00 0.00 57.00 56.59 2nut n GLN 686 Cb 0.31 -1.02 0.03 0.00 2.41 0.00 0.00 30.24 31.96 2nut n GLN 686 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2nut h ALA 687 N 1.54 0.57 -0.19 1.69 0.00 -0.07 0.45 119.26 123.25 2nut h ALA 687 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 2nut h ALA 687 Cb 0.29 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2nut h ALA 687 CO 0.00 -0.08 -0.42 -1.00 0.00 0.00 0.00 179.25 177.75 2nut h PRO 688 N 0.50 0.44 -0.21 0.00 0.13 -1.81 -2.59 132.00 128.46 2nut h PRO 688 Ca 0.18 -0.22 -0.07 0.00 -0.87 0.00 0.00 66.00 65.02 2nut h PRO 688 Cb 0.05 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.17 2nut h PRO 688 CO -0.10 0.78 -0.17 0.28 -0.23 0.00 0.00 178.00 178.56 2nut h VAL 689 N 0.36 1.22 0.20 1.56 2.07 -1.65 -1.47 116.25 118.54 2nut h VAL 689 Ca 0.03 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.52 2nut h VAL 689 Cb 0.89 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 2nut h VAL 689 CO 0.07 0.32 -0.09 0.44 0.02 0.00 0.00 177.57 178.33 2nut h ASP 690 N 0.34 -0.22 0.15 0.57 5.19 -0.69 -2.83 116.42 118.92 2nut h ASP 690 Ca 0.06 -0.28 -0.02 0.00 -0.62 0.00 0.00 57.03 56.17 2nut h ASP 690 Cb 0.50 0.06 -0.00 0.00 0.18 0.00 0.00 39.33 40.07 2nut h ASP 690 CO 0.03 0.21 -0.09 0.44 -3.12 0.00 0.00 179.24 176.71 2nut h ASP 691 N -0.70 0.00 0.54 6.45 3.32 -1.41 -2.92 116.42 121.70 2nut h ASP 691 Ca -0.03 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.00 2nut h ASP 691 Cb 0.49 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.05 2nut h ASP 691 CO 0.04 0.09 -0.26 0.00 -1.72 0.00 0.00 179.24 177.40 2nut h ALA 692 N 1.91 -0.73 -0.98 3.45 0.00 -1.21 -3.29 119.26 118.42 2nut h ALA 692 Ca -0.00 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 54.84 2nut h ALA 692 Cb 0.19 0.28 -0.14 0.00 0.00 0.00 0.00 17.79 18.12 2nut h ALA 692 CO 0.01 -0.78 -0.46 1.04 0.00 0.00 0.00 179.25 179.06 2nut n GLN 693 N -5.31 -0.31 -0.10 0.00 1.13 -1.08 -0.12 117.38 111.59 2nut n GLN 693 Ca -0.11 1.50 -0.09 0.00 -1.94 0.00 0.00 57.00 56.35 2nut n GLN 693 Cb 0.33 -2.21 -0.06 0.00 0.11 0.00 0.00 30.24 28.40 2nut n GLN 693 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 2nut h GLU 694 N 0.00 -0.23 0.00 -1.09 5.08 -1.63 -1.20 114.58 115.51 2nut h GLU 694 Ca 0.27 0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.57 2nut h GLU 694 Cb 0.51 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 2nut h GLU 694 CO -0.95 -0.15 -0.35 0.97 -1.00 0.00 0.00 179.01 177.53 2nut h ILE 695 N -0.24 0.98 0.00 3.13 6.09 -1.57 -2.91 117.51 122.99 2nut h ILE 695 Ca 0.05 -1.32 0.00 0.00 -1.37 0.00 0.00 64.86 62.21 2nut h ILE 695 Cb 0.37 1.77 0.00 0.00 0.47 0.00 0.00 36.82 39.44 2nut h ILE 695 CO -0.39 0.34 0.00 -0.11 -3.07 0.00 0.00 178.15 174.92 2nut n LEU 696 N -3.73 1.97 0.00 2.19 7.94 0.82 -3.09 117.00 123.10 2nut n LEU 696 Ca -0.01 -0.98 0.00 0.00 -1.11 0.00 0.00 56.01 53.91 2nut n LEU 696 Cb 0.44 -0.33 0.00 0.00 0.53 0.00 0.00 43.42 44.06 2nut n LEU 696 CO 0.37 0.33 0.00 1.41 -1.11 0.00 0.00 177.39 178.38 2nut n HIS 697 N 0.66 -0.28 -0.29 1.96 8.25 -1.10 -4.88 115.22 119.53 2nut n HIS 697 Ca 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.40 2nut n HIS 697 Cb 0.33 0.15 0.06 0.00 1.12 0.00 0.00 29.99 31.65 2nut n HIS 697 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2nut h SER 698 N 0.00 1.08 -2.68 0.41 4.64 -1.52 -3.43 113.55 112.05 2nut h SER 698 Ca 0.00 -0.16 -0.53 0.00 -0.47 0.00 0.00 61.79 60.63 2nut h SER 698 Cb 0.00 -0.28 0.04 0.00 -0.31 0.00 0.00 62.40 61.85 2nut h SER 698 CO 0.00 0.95 1.00 -0.60 -0.87 0.00 0.00 176.83 177.30 2nut s ARG 699 N -5.59 4.17 0.00 4.77 3.52 -1.20 -4.97 118.95 119.65 2nut s ARG 699 Ca -0.12 2.48 0.00 0.00 -0.13 0.00 0.00 55.73 57.95 2nut s ARG 699 Cb 0.16 -3.35 0.00 0.00 -1.56 0.00 0.00 34.95 30.20 2nut s ARG 699 CO 0.83 -0.73 0.55 0.34 -0.81 0.00 0.00 175.30 175.49 2nut n PHE 700 N 4.78 0.00 -1.71 5.12 7.35 -1.26 -3.80 117.46 127.93 2nut n PHE 700 Ca 0.16 0.00 -0.42 0.00 -0.76 0.00 0.00 57.45 56.42 2nut n PHE 700 Cb 0.38 -0.05 -0.03 0.00 0.35 0.00 0.00 39.48 40.13 2nut n PHE 700 CO 0.00 0.00 0.00 -2.14 -0.76 0.00 0.00 176.76 173.86 2nut s PRO 701 N -1.22 3.85 0.17 -7.13 0.02 -1.26 -4.78 135.00 124.66 2nut s PRO 701 Ca 0.00 2.36 -0.32 0.00 0.02 0.00 0.00 61.00 63.06 2nut s PRO 701 Cb 0.00 -4.20 -0.10 0.00 0.02 0.00 0.00 34.50 30.22 2nut s PRO 701 CO 0.00 -1.27 1.60 1.41 -0.33 0.00 0.00 177.00 178.40 2nut s MET 702 N 4.94 4.20 0.59 5.54 1.75 -1.25 -4.95 119.30 130.12 2nut s MET 702 Ca 0.89 2.40 -0.17 0.00 -1.25 0.00 0.00 55.69 57.57 2nut s MET 702 Cb -0.38 -3.15 -0.03 0.00 2.84 0.00 0.00 34.83 34.11 2nut s MET 702 CO 0.38 -0.63 1.09 -1.25 -0.65 0.00 0.00 175.02 173.95 2nut s PRO 703 N 1.17 3.20 0.22 4.11 0.04 -1.26 -4.99 135.00 137.48 2nut s PRO 703 Ca 0.71 1.36 -0.30 0.00 0.04 0.00 0.00 61.00 62.81 2nut s PRO 703 Cb -0.45 -2.01 -0.08 0.00 0.04 0.00 0.00 34.50 32.00 2nut s PRO 703 CO 0.31 -0.93 1.09 0.50 0.04 0.00 0.00 177.00 178.02 2nut s ARG 704 N -3.84 4.63 -0.16 4.56 3.52 -0.89 -4.81 118.95 121.96 2nut s ARG 704 Ca 0.67 1.74 -0.07 0.00 -0.13 0.00 0.00 55.73 57.94 2nut s ARG 704 Cb -0.19 -3.24 -0.04 0.00 -1.56 0.00 0.00 34.95 29.92 2nut s ARG 704 CO 0.35 0.15 0.08 -0.47 -0.81 0.00 0.00 175.30 174.60 2nut s TYR 705 N -0.65 3.33 -0.04 5.12 5.04 -1.26 -1.91 117.35 126.97 2nut s TYR 705 Ca 0.47 0.22 0.02 0.00 -2.44 0.00 0.00 57.07 55.34 2nut s TYR 705 Cb -0.30 -2.02 0.02 0.00 0.35 0.00 0.00 41.96 40.00 2nut s TYR 705 CO 0.37 0.33 -0.07 0.42 -1.34 0.00 0.00 175.55 175.27 2nut s ILE 706 N -0.08 0.69 -0.31 3.14 -1.09 -0.83 -5.01 121.20 117.71 2nut s ILE 706 Ca 0.08 -0.24 0.03 0.00 -2.23 0.00 0.00 60.65 58.29 2nut s ILE 706 Cb -0.12 -0.66 0.08 0.00 -1.58 0.00 0.00 42.46 40.18 2nut s ILE 706 CO 0.01 0.25 -0.01 -0.62 -1.23 0.00 0.00 174.94 173.33 2nut s ASP 707 N 0.67 4.67 0.26 3.58 -1.08 -1.26 -0.77 116.67 122.73 2nut s ASP 707 Ca -0.10 -1.81 0.03 0.00 -0.52 0.00 0.00 52.55 50.15 2nut s ASP 707 Cb -0.13 -1.61 -0.01 0.00 -1.46 0.00 0.00 42.92 39.71 2nut s ASP 707 CO 0.01 -0.31 0.12 1.07 0.52 0.00 0.00 175.17 176.58 2nut n THR 708 N 4.35 0.00 -3.81 1.71 5.66 -0.62 -5.02 114.28 116.55 2nut n THR 708 Ca -0.04 -1.58 -0.09 0.00 -3.05 0.00 0.00 64.05 59.29 2nut n THR 708 Cb 0.42 0.62 0.02 0.00 -1.55 0.00 0.00 70.33 69.84 2nut n THR 708 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 2nut s GLU 709 N -2.99 2.20 -0.01 1.09 1.03 -1.26 -1.85 118.70 116.90 2nut s GLU 709 Ca 0.17 -1.41 -0.33 0.00 0.03 0.00 0.00 54.97 53.43 2nut s GLU 709 Cb 0.01 0.62 -0.11 0.00 -0.80 0.00 0.00 34.13 33.85 2nut s GLU 709 CO 0.12 -1.03 1.89 1.58 -1.33 0.00 0.00 175.26 176.49 2nut n HIS 710 N -0.53 2.41 0.00 4.83 -0.00 -0.82 -0.33 115.22 120.79 2nut n HIS 710 Ca -0.08 -0.12 0.00 0.00 -0.00 0.00 0.00 57.72 57.52 2nut n HIS 710 Cb 0.60 -2.71 0.00 0.00 -0.00 0.00 0.00 29.99 27.88 2nut n HIS 710 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2nut n GLY 711 N 4.37 2.52 3.53 1.57 0.00 -1.26 -4.81 105.19 111.10 2nut n GLY 711 Ca 0.21 -0.37 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 2nut n GLY 711 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nut n GLY 712 N 0.00 -1.26 0.10 -0.02 0.00 0.55 -4.91 105.19 99.65 2nut n GLY 712 Ca 0.00 -0.69 -0.02 0.00 0.00 0.00 0.00 46.02 45.31 2nut n GLY 712 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2nut h SER 713 N -1.54 0.00 0.43 1.61 4.64 -1.97 -3.26 113.55 113.46 2nut h SER 713 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 2nut h SER 713 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2nut h SER 713 CO 0.38 0.70 0.00 0.00 -0.87 0.00 0.00 176.83 177.04 2nut n GLN 714 N -3.14 0.41 0.23 4.77 6.02 -1.26 -2.97 117.38 121.44 2nut n GLN 714 Ca -0.04 0.04 0.09 0.00 -0.01 0.00 0.00 57.00 57.08 2nut n GLN 714 Cb 0.85 -1.50 0.58 0.00 1.02 0.00 0.00 30.24 31.19 2nut n GLN 714 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2nut h ALA 715 N 3.24 1.38 -1.22 -1.58 0.00 -1.83 -2.89 119.26 116.37 2nut h ALA 715 Ca 0.00 -0.18 0.35 0.00 0.00 0.00 0.00 54.91 55.08 2nut h ALA 715 Cb 0.22 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.90 2nut h ALA 715 CO 0.00 0.25 0.84 0.07 0.00 0.00 0.00 179.25 180.40 2nut h ARG 716 N 0.00 0.13 -0.64 0.00 0.11 -1.78 0.74 114.38 112.93 2nut h ARG 716 Ca -0.00 -0.01 -0.07 0.00 0.10 0.00 0.00 59.98 60.00 2nut h ARG 716 Cb 0.43 -0.03 -0.03 0.00 1.11 0.00 0.00 29.97 31.46 2nut h ARG 716 CO 0.03 0.08 0.14 0.74 0.10 0.00 0.00 179.97 181.06 2nut h PHE 717 N 0.13 1.09 -0.16 4.08 -1.00 -1.79 -1.25 116.94 118.04 2nut h PHE 717 Ca 0.63 -0.14 -0.16 0.00 2.81 0.00 0.00 57.97 61.12 2nut h PHE 717 Cb 2.19 -0.31 0.00 0.00 3.61 0.00 0.00 35.95 41.45 2nut h PHE 717 CO -0.00 0.92 -0.50 1.25 -1.61 0.00 0.00 178.31 178.36 2nut h LEU 718 N 0.96 0.73 -1.57 1.54 5.85 -1.10 -3.14 115.31 118.58 2nut h LEU 718 Ca 0.20 -0.59 0.00 0.00 0.84 0.00 0.00 57.88 58.33 2nut h LEU 718 Cb 0.39 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 2nut h LEU 718 CO 0.01 1.20 0.29 -0.07 -0.34 0.00 0.00 178.44 179.52 2nut h LEU 719 N 0.30 0.50 0.00 2.25 3.38 -1.14 -1.85 115.31 118.75 2nut h LEU 719 Ca -0.02 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.90 2nut h LEU 719 Cb 1.13 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 2nut h LEU 719 CO 0.11 0.36 -0.41 0.77 0.09 0.00 0.00 178.44 179.37 2nut h SER 720 N 0.59 0.00 0.91 -0.43 4.64 -1.27 -3.29 113.55 114.69 2nut h SER 720 Ca 0.16 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.39 2nut h SER 720 Cb -0.06 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.01 2nut h SER 720 CO -0.03 0.15 -1.15 0.11 -0.87 0.00 0.00 176.83 175.04 2nut h LYS 721 N 0.00 0.00 0.00 4.77 1.79 -1.44 -3.48 116.57 118.22 2nut h LYS 721 Ca -0.01 0.00 -0.28 0.00 -2.18 0.00 0.00 60.65 58.17 2nut h LYS 721 Cb 1.13 0.00 0.14 0.00 -1.58 0.00 0.00 32.23 31.92 2nut h LYS 721 CO 0.02 0.17 0.10 1.55 -1.08 0.00 0.00 179.45 180.21 2nut n VAL 722 N -2.82 0.00 0.00 0.50 3.14 -0.72 -4.95 118.33 113.48 2nut n VAL 722 Ca -0.05 -0.37 0.00 0.00 -2.96 0.00 0.00 64.34 60.96 2nut n VAL 722 Cb 0.70 -1.21 0.00 0.00 -1.06 0.00 0.00 33.84 32.27 2nut n VAL 722 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 2nut n ASN 723 N -4.26 0.00 0.00 6.55 5.03 -0.95 -4.90 115.26 116.73 2nut n ASN 723 Ca 0.11 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.56 2nut n ASN 723 Cb 0.42 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.18 2nut n ASN 723 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 2nut n ASP 746 N 3.48 0.00 0.00 6.41 8.00 -1.26 -3.90 116.55 129.28 2nut n ASP 746 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2nut n ASP 746 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2nut n ASP 746 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2nut n VAL 747 N 0.00 0.00 -1.81 2.53 0.31 -1.26 -5.08 118.33 113.01 2nut n VAL 747 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.03 2nut n VAL 747 Cb 0.00 0.00 0.04 0.00 -0.91 0.00 0.00 33.84 32.97 2nut n VAL 747 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2nut s SER 748 N 0.73 5.60 0.45 4.52 1.04 -1.26 -4.84 113.70 119.94 2nut s SER 748 Ca 0.00 1.29 0.11 0.00 0.48 0.00 0.00 55.95 57.83 2nut s SER 748 Cb 0.00 -2.17 1.01 0.00 0.10 0.00 0.00 66.02 64.96 2nut s SER 748 CO 0.00 -1.26 2.08 0.25 0.98 0.00 0.00 173.24 175.29 2nut h LEU 749 N -0.60 0.31 -0.11 2.42 5.85 -1.99 0.66 115.31 121.85 2nut h LEU 749 Ca -0.45 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.25 2nut h LEU 749 Cb 1.23 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.18 2nut h LEU 749 CO 0.62 0.22 0.01 1.56 -0.34 0.00 0.00 178.44 180.50 2nut h GLN 750 N 0.36 0.19 -0.47 1.25 7.50 -1.93 0.14 115.11 122.15 2nut h GLN 750 Ca 0.12 -0.06 -0.09 0.00 0.50 0.00 0.00 58.65 59.12 2nut h GLN 750 Cb 0.03 -0.02 -0.02 0.00 0.05 0.00 0.00 27.48 27.53 2nut h GLN 750 CO -0.03 0.43 -0.06 0.28 -1.50 0.00 0.00 178.83 177.95 2nut h VAL 751 N -0.07 1.26 -0.51 -0.54 2.07 -1.82 -1.83 116.25 114.81 2nut h VAL 751 Ca 0.03 -1.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.41 2nut h VAL 751 Cb 0.34 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 2nut h VAL 751 CO 0.00 0.39 0.27 0.15 0.02 0.00 0.00 177.57 178.40 2nut h PHE 752 N 0.76 0.72 -0.20 1.57 3.57 -0.66 -2.73 116.94 119.97 2nut h PHE 752 Ca 0.13 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 2nut h PHE 752 Cb 0.55 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 2nut h PHE 752 CO 0.03 0.54 0.10 0.52 -2.23 0.00 0.00 178.31 177.27 2nut h MET 753 N 0.68 0.29 -0.75 1.11 2.86 -0.45 -2.34 114.93 116.33 2nut h MET 753 Ca 0.18 -0.04 0.07 0.00 -2.06 0.00 0.00 59.70 57.85 2nut h MET 753 Cb 0.08 -0.05 -0.06 0.00 0.06 0.00 0.00 31.60 31.62 2nut h MET 753 CO -0.03 0.31 0.43 -0.44 1.06 0.00 0.00 176.91 178.24 2nut h ASP 754 N 0.19 0.63 -0.46 1.22 3.32 -1.21 -0.62 116.42 119.50 2nut h ASP 754 Ca 0.07 0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.11 2nut h ASP 754 Cb 0.12 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 2nut h ASP 754 CO -0.01 0.39 0.11 -0.74 -1.72 0.00 0.00 179.24 177.27 2nut h HIS 755 N 0.76 0.76 -0.98 4.55 2.76 -1.40 -0.58 115.15 121.03 2nut h HIS 755 Ca 0.35 -0.09 0.04 0.00 -2.20 0.00 0.00 60.37 58.46 2nut h HIS 755 Cb 0.25 -0.22 -0.06 0.00 1.55 0.00 0.00 27.41 28.94 2nut h HIS 755 CO -0.07 0.70 0.64 1.25 -1.30 0.00 0.00 177.93 179.16 2nut h LEU 756 N 0.61 1.07 -0.52 0.26 5.85 -0.78 -1.49 115.31 120.31 2nut h LEU 756 Ca 0.14 -0.01 -0.16 0.00 0.84 0.00 0.00 57.88 58.69 2nut h LEU 756 Cb 0.32 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 2nut h LEU 756 CO 0.00 0.74 -0.52 0.11 -0.34 0.00 0.00 178.44 178.43 2nut h LYS 757 N 1.25 0.60 0.00 1.25 1.57 -0.83 0.63 116.57 121.03 2nut h LYS 757 Ca 0.39 -0.36 -0.04 0.00 -1.87 0.00 0.00 60.65 58.77 2nut h LYS 757 Cb -0.01 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 2nut h LYS 757 CO -0.12 0.97 -0.19 0.87 -0.57 0.00 0.00 179.45 180.42 2nut h LYS 758 N 0.47 0.00 0.00 3.15 1.57 -0.25 -2.48 116.57 119.03 2nut h LYS 758 Ca 0.02 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 2nut h LYS 758 Cb 1.06 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.37 2nut h LYS 758 CO 0.10 0.19 -1.47 1.28 -0.57 0.00 0.00 179.45 178.98 2nut n LEU 759 N -4.08 0.48 -0.03 2.94 4.77 -0.64 -3.90 117.00 116.53 2nut n LEU 759 Ca -0.02 0.19 -0.16 0.00 -0.03 0.00 0.00 56.01 55.99 2nut n LEU 759 Cb 0.26 -0.01 -0.08 0.00 -2.33 0.00 0.00 43.42 41.26 2nut n LEU 759 CO 0.35 -0.08 0.38 0.00 -1.33 0.00 0.00 177.39 176.71 2nut h ALA 760 N 1.94 0.21 -0.00 -1.18 0.00 -0.46 -3.26 119.26 116.51 2nut h ALA 760 Ca -0.02 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2nut h ALA 760 Cb 1.06 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2nut h ALA 760 CO 0.00 0.39 -0.05 1.33 0.00 0.00 0.00 179.25 180.92 2nut n VAL 761 N -4.24 0.00 -0.85 0.00 0.24 -0.97 -4.69 118.33 107.82 2nut n VAL 761 Ca -0.08 -0.03 0.00 0.00 -2.04 0.00 0.00 64.34 62.20 2nut n VAL 761 Cb 0.59 -0.32 0.00 0.00 -1.47 0.00 0.00 33.84 32.64 2nut n VAL 761 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2nut n SER 762 N -1.13 0.00 -4.76 -1.34 3.41 -1.23 0.06 113.62 108.62 2nut n SER 762 Ca 0.15 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.34 2nut n SER 762 Cb 0.25 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.19 2nut n SER 762 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2nut s SER 763 N -1.00 6.33 0.00 4.04 1.04 -1.26 -4.90 113.70 117.95 2nut s SER 763 Ca 0.00 3.02 0.22 0.00 0.48 0.00 0.00 55.95 59.67 2nut s SER 763 Cb 0.00 -2.65 1.31 0.00 0.10 0.00 0.00 66.02 64.78 2nut s SER 763 CO 0.00 -0.92 1.68 0.00 0.98 0.00 0.00 173.24 174.99