#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nmu n ASN 7 N 0.00 -5.51 -4.96 0.41 3.02 -1.26 -4.98 115.26 101.99 2nmu n ASN 7 Ca 0.00 -0.09 -0.22 0.00 -0.03 0.00 0.00 54.58 54.24 2nmu n ASN 7 Cb 0.00 -4.55 -0.02 0.00 -0.61 0.00 0.00 39.78 34.60 2nmu n ASN 7 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2nmu s ALA 8 N -3.01 3.84 -0.20 5.41 0.00 -1.26 -5.06 121.76 121.48 2nmu s ALA 8 Ca 0.12 -1.10 -0.33 0.00 0.00 0.00 0.00 51.96 50.66 2nmu s ALA 8 Cb -0.06 -1.88 0.15 0.00 0.00 0.00 0.00 23.12 21.33 2nmu s ALA 8 CO 0.15 0.15 1.20 0.45 0.00 0.00 0.00 175.76 177.71 2nmu s SER 9 N -3.98 -0.16 0.94 0.00 0.15 -1.26 -4.77 113.70 104.62 2nmu s SER 9 Ca 0.36 0.08 -0.15 0.00 0.70 0.00 0.00 55.95 56.95 2nmu s SER 9 Cb -0.09 0.15 0.19 0.00 -1.71 0.00 0.00 66.02 64.56 2nmu s SER 9 CO 0.32 -0.21 1.30 0.42 1.20 0.00 0.00 173.24 176.26 2nmu s THR 10 N -1.85 2.01 0.02 6.45 -4.23 -1.26 -5.01 115.64 111.77 2nmu s THR 10 Ca 0.07 -0.04 0.02 0.00 -1.18 0.00 0.00 61.69 60.55 2nmu s THR 10 Cb -0.01 -2.97 -0.02 0.00 1.34 0.00 0.00 72.50 70.85 2nmu s THR 10 CO -0.05 0.00 -0.06 0.00 -0.54 0.00 0.00 174.62 173.98 2nmu s ALA 11 N -3.83 0.43 -0.07 3.99 0.00 -1.26 -4.05 121.76 116.97 2nmu s ALA 11 Ca 0.73 -0.56 0.04 0.00 0.00 0.00 0.00 51.96 52.17 2nmu s ALA 11 Cb -0.04 0.02 -0.02 0.00 0.00 0.00 0.00 23.12 23.08 2nmu s ALA 11 CO 0.52 -0.01 -0.18 0.50 0.00 0.00 0.00 175.76 176.59 2nmu s ARG 12 N -1.10 2.74 0.09 0.00 3.52 -0.40 -4.94 118.95 118.86 2nmu s ARG 12 Ca -0.07 -0.77 0.08 0.00 -0.13 0.00 0.00 55.73 54.84 2nmu s ARG 12 Cb -0.07 -2.37 -0.04 0.00 -1.56 0.00 0.00 34.95 30.91 2nmu s ARG 12 CO 0.00 0.43 -0.16 -0.06 -0.81 0.00 0.00 175.30 174.71 2nmu s PHE 13 N -0.26 2.60 0.01 5.12 0.08 -1.26 -0.65 117.98 123.61 2nmu s PHE 13 Ca 0.01 -0.23 0.05 0.00 0.12 0.00 0.00 56.93 56.88 2nmu s PHE 13 Cb -0.13 -1.40 -0.02 0.00 -0.57 0.00 0.00 43.02 40.90 2nmu s PHE 13 CO 0.03 0.37 -0.17 0.71 -0.10 0.00 0.00 175.22 176.06 2nmu s TYR 14 N -1.11 1.48 -0.07 0.36 1.51 0.23 -4.97 117.35 114.79 2nmu s TYR 14 Ca 0.18 -0.31 0.05 0.00 -1.01 0.00 0.00 57.07 55.98 2nmu s TYR 14 Cb -0.11 -0.93 -0.02 0.00 -0.11 0.00 0.00 41.96 40.80 2nmu s TYR 14 CO 0.10 0.01 -0.21 0.00 -1.11 0.00 0.00 175.55 174.34 2nmu s ALA 15 N -0.54 2.35 0.11 3.71 0.00 -1.26 -0.51 121.76 125.63 2nmu s ALA 15 Ca 0.06 -1.01 -0.12 0.00 0.00 0.00 0.00 51.96 50.88 2nmu s ALA 15 Cb -0.07 -0.82 0.02 0.00 0.00 0.00 0.00 23.12 22.24 2nmu s ALA 15 CO 0.00 0.43 0.30 -0.48 0.00 0.00 0.00 175.76 176.01 2nmu s LEU 16 N -0.23 0.89 -0.09 0.00 2.34 -0.47 -5.01 118.68 116.11 2nmu s LEU 16 Ca -0.01 -0.52 0.00 0.00 0.06 0.00 0.00 54.13 53.67 2nmu s LEU 16 Cb -0.13 1.44 0.02 0.00 -0.56 0.00 0.00 46.19 46.96 2nmu s LEU 16 CO 0.03 -0.81 -0.08 -0.60 -1.06 0.00 0.00 176.35 173.83 2nmu s ARG 17 N -3.84 1.50 0.34 1.48 3.52 -1.26 -1.14 118.95 119.55 2nmu s ARG 17 Ca 0.05 -0.28 -0.10 0.00 -0.13 0.00 0.00 55.73 55.27 2nmu s ARG 17 Cb 0.03 -1.47 -0.07 0.00 -1.56 0.00 0.00 34.95 31.88 2nmu s ARG 17 CO -0.10 -0.17 0.69 -0.51 -0.81 0.00 0.00 175.30 174.39 2nmu s LEU 18 N 1.38 3.98 0.26 -0.88 1.43 0.49 -4.93 118.68 120.41 2nmu s LEU 18 Ca -0.01 1.06 0.06 0.00 -1.03 0.00 0.00 54.13 54.20 2nmu s LEU 18 Cb -0.14 -3.89 -0.03 0.00 0.03 0.00 0.00 46.19 42.16 2nmu s LEU 18 CO -0.04 -0.27 0.33 -0.76 0.23 0.00 0.00 176.35 175.84 2nmu s LEU 19 N -3.43 4.09 0.21 1.79 1.43 -1.26 -2.98 118.68 118.53 2nmu s LEU 19 Ca 0.50 -0.09 -0.32 0.00 -1.03 0.00 0.00 54.13 53.19 2nmu s LEU 19 Cb -0.10 -2.67 -0.14 0.00 0.03 0.00 0.00 46.19 43.30 2nmu s LEU 19 CO 0.26 -0.14 1.30 -2.65 0.23 0.00 0.00 176.35 175.35 2nmu n PRO 20 N -1.39 1.64 0.00 1.29 -0.02 -1.26 -1.86 135.00 133.41 2nmu n PRO 20 Ca -0.07 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 2nmu n PRO 20 Cb 0.58 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 2nmu n PRO 20 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2nmu n GLY 21 N 2.09 2.90 3.79 -1.23 0.00 -0.04 -4.96 105.19 107.74 2nmu n GLY 21 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 2nmu n GLY 21 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2nmu s GLN 22 N -0.44 3.99 -0.16 1.61 -0.21 -0.78 -4.68 119.66 119.00 2nmu s GLN 22 Ca 0.00 1.50 -0.16 0.00 0.02 0.00 0.00 55.36 56.72 2nmu s GLN 22 Cb 0.00 -2.38 -0.04 0.00 1.00 0.00 0.00 33.01 31.59 2nmu s GLN 22 CO 0.00 -0.29 0.41 -2.00 -2.12 0.00 0.00 175.29 171.28 2nmu s GLU 23 N -2.76 4.26 0.11 2.91 -6.30 -1.26 -0.74 118.70 114.92 2nmu s GLU 23 Ca 0.62 0.28 -0.21 0.00 -2.50 0.00 0.00 54.97 53.15 2nmu s GLU 23 Cb -0.21 -3.47 -0.07 0.00 0.00 0.00 0.00 34.13 30.38 2nmu s GLU 23 CO 0.26 0.10 1.71 0.28 0.02 0.00 0.00 175.26 177.63 2nmu h VAL 24 N 4.83 0.84 -0.39 3.70 2.07 -1.43 -2.61 116.25 123.27 2nmu h VAL 24 Ca -0.39 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.15 2nmu h VAL 24 Cb 1.17 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 31.75 2nmu h VAL 24 CO 0.74 0.00 0.21 -0.26 0.02 0.00 0.00 177.57 178.29 2nmu h PHE 25 N -0.03 0.39 -0.75 1.57 -1.00 -1.95 -0.19 116.94 114.98 2nmu h PHE 25 Ca 0.06 0.01 -0.02 0.00 2.81 0.00 0.00 57.97 60.83 2nmu h PHE 25 Cb 0.12 -0.12 -0.03 0.00 3.61 0.00 0.00 35.95 39.52 2nmu h PHE 25 CO -0.17 0.22 0.38 0.66 -1.61 0.00 0.00 178.31 177.79 2nmu h SER 26 N 0.43 0.97 -0.44 2.17 4.64 -1.95 -1.03 113.55 118.34 2nmu h SER 26 Ca 0.16 -0.12 -0.13 0.00 -0.47 0.00 0.00 61.79 61.22 2nmu h SER 26 Cb 0.04 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 61.86 2nmu h SER 26 CO -0.09 0.82 -0.24 1.56 -0.87 0.00 0.00 176.83 178.01 2nmu h GLN 27 N 1.06 0.96 -0.63 4.77 1.08 -1.15 -0.84 115.11 120.35 2nmu h GLN 27 Ca 0.26 -0.42 -0.06 0.00 -1.45 0.00 0.00 58.65 56.98 2nmu h GLN 27 Cb 0.09 -0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 27.47 2nmu h GLN 27 CO -0.04 1.08 0.15 -0.07 -0.95 0.00 0.00 178.83 179.01 2nmu h LEU 28 N 0.82 0.95 -0.69 1.46 3.38 -0.80 -1.08 115.31 119.35 2nmu h LEU 28 Ca 0.10 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 2nmu h LEU 28 Cb 0.81 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 2nmu h LEU 28 CO 0.07 0.94 0.21 0.45 0.09 0.00 0.00 178.44 180.20 2nmu h HIS 29 N 0.92 1.12 -0.74 1.13 3.86 -1.02 -0.26 115.15 120.16 2nmu h HIS 29 Ca 0.20 -0.11 -0.04 0.00 -1.16 0.00 0.00 60.37 59.25 2nmu h HIS 29 Cb 0.36 -0.32 -0.03 0.00 1.06 0.00 0.00 27.41 28.47 2nmu h HIS 29 CO 0.03 0.90 0.31 0.00 0.86 0.00 0.00 177.93 180.03 2nmu h ALA 30 N 1.10 1.16 -0.33 2.45 0.00 -0.82 0.56 119.26 123.37 2nmu h ALA 30 Ca 0.22 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 2nmu h ALA 30 Cb 0.31 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2nmu h ALA 30 CO -0.01 0.62 -0.13 0.35 0.00 0.00 0.00 179.25 180.08 2nmu h PHE 31 N 1.07 0.77 -0.66 0.00 3.57 -0.77 -0.15 116.94 120.76 2nmu h PHE 31 Ca 0.25 -0.18 0.01 0.00 3.53 0.00 0.00 57.97 61.57 2nmu h PHE 31 Cb 0.17 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.70 2nmu h PHE 31 CO 0.02 0.87 0.43 0.28 -2.23 0.00 0.00 178.31 177.68 2nmu h VAL 32 N 0.45 1.17 -0.15 1.41 2.07 -0.73 -2.09 116.25 118.39 2nmu h VAL 32 Ca 0.08 -0.33 -0.03 0.00 0.82 0.00 0.00 66.70 67.24 2nmu h VAL 32 Cb 0.65 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 2nmu h VAL 32 CO 0.04 0.17 -0.01 1.56 0.02 0.00 0.00 177.57 179.36 2nmu h GLN 33 N 0.90 0.27 -0.88 1.57 1.08 -0.74 0.21 115.11 117.53 2nmu h GLN 33 Ca 0.24 -0.09 0.07 0.00 -1.45 0.00 0.00 58.65 57.42 2nmu h GLN 33 Cb -0.09 -0.02 -0.06 0.00 -0.05 0.00 0.00 27.48 27.25 2nmu h GLN 33 CO -0.05 0.51 0.55 0.37 -0.95 0.00 0.00 178.83 179.25 2nmu h GLN 34 N 0.00 0.95 -0.36 1.46 4.15 -0.88 -2.32 115.11 118.11 2nmu h GLN 34 Ca 0.04 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.40 2nmu h GLN 34 Cb 0.39 -0.21 0.00 0.00 0.21 0.00 0.00 27.48 27.86 2nmu h GLN 34 CO 0.01 0.63 0.00 0.09 -1.93 0.00 0.00 178.83 177.63 2nmu n ASN 35 N -4.62 3.41 -3.96 -0.69 4.13 -0.80 -4.98 115.26 107.76 2nmu n ASN 35 Ca 0.13 -1.99 -0.27 0.00 1.68 0.00 0.00 54.58 54.13 2nmu n ASN 35 Cb 0.20 -0.23 -0.02 0.00 -1.54 0.00 0.00 39.78 38.19 2nmu n ASN 35 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2nmu n GLN 36 N 1.47 -2.82 -2.39 3.52 1.13 0.64 -4.90 117.38 114.04 2nmu n GLN 36 Ca 0.19 0.38 -0.42 0.00 -1.94 0.00 0.00 57.00 55.21 2nmu n GLN 36 Cb 0.60 -4.35 -0.03 0.00 0.11 0.00 0.00 30.24 26.57 2nmu n GLN 36 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2nmu s LEU 37 N -6.96 4.40 -0.00 1.08 1.43 -0.56 -4.93 118.68 113.13 2nmu s LEU 37 Ca 0.06 2.12 0.08 0.00 -1.03 0.00 0.00 54.13 55.36 2nmu s LEU 37 Cb -0.03 -3.59 -0.10 0.00 0.03 0.00 0.00 46.19 42.50 2nmu s LEU 37 CO 0.90 -0.45 0.31 0.54 0.23 0.00 0.00 176.35 177.88 2nmu n ARG 38 N 3.41 3.14 -2.82 1.70 5.12 -1.26 -1.70 116.66 124.24 2nmu n ARG 38 Ca 0.07 -0.02 -0.08 0.00 -1.93 0.00 0.00 57.85 55.89 2nmu n ARG 38 Cb 0.45 -0.98 0.01 0.00 -1.16 0.00 0.00 32.46 30.79 2nmu n ARG 38 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2nmu n ALA 39 N -1.36 -1.16 -2.53 7.54 0.00 -1.26 -0.02 120.51 121.72 2nmu n ALA 39 Ca 0.01 -1.43 -0.23 0.00 0.00 0.00 0.00 53.44 51.78 2nmu n ALA 39 Cb 0.16 -1.35 -0.07 0.00 0.00 0.00 0.00 19.45 18.18 2nmu n ALA 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2nmu s ALA 40 N 0.64 3.41 0.08 0.00 0.00 -0.55 -0.65 121.76 124.70 2nmu s ALA 40 Ca 0.31 -1.86 -0.17 0.00 0.00 0.00 0.00 51.96 50.24 2nmu s ALA 40 Cb 0.10 -0.63 0.03 0.00 0.00 0.00 0.00 23.12 22.62 2nmu s ALA 40 CO -0.14 0.04 0.40 1.67 0.00 0.00 0.00 175.76 177.74 2nmu s TRP 41 N -2.45 -0.22 -0.47 0.00 -2.14 -0.28 -1.20 118.94 112.17 2nmu s TRP 41 Ca 0.37 0.04 -0.27 0.00 2.66 0.00 0.00 56.10 58.90 2nmu s TRP 41 Cb -0.02 0.23 0.03 0.00 -3.10 0.00 0.00 33.47 30.61 2nmu s TRP 41 CO 0.22 -0.63 1.04 0.42 -2.66 0.00 0.00 176.95 175.34 2nmu s ILE 42 N -3.13 4.32 -0.31 0.66 -1.09 -0.45 -1.37 121.20 119.84 2nmu s ILE 42 Ca -0.01 1.00 0.22 0.00 -2.23 0.00 0.00 60.65 59.63 2nmu s ILE 42 Cb 0.01 -4.53 0.12 0.00 -1.58 0.00 0.00 42.46 36.48 2nmu s ILE 42 CO -0.07 -0.94 1.26 0.00 -1.23 0.00 0.00 174.94 173.96 2nmu h ALA 43 N 9.17 0.69 -1.53 9.38 0.00 -1.35 -3.42 119.26 132.21 2nmu h ALA 43 Ca -0.23 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 54.73 2nmu h ALA 43 Cb 1.07 0.01 -0.25 0.00 0.00 0.00 0.00 17.79 18.61 2nmu h ALA 43 CO 1.08 0.04 0.54 0.20 0.00 0.00 0.00 179.25 181.12 2nmu s GLY 44 N -4.32 -0.17 -0.27 0.00 0.00 -0.92 -4.95 107.32 96.69 2nmu s GLY 44 Ca 0.02 2.40 -0.25 0.00 0.00 0.00 0.00 44.72 46.90 2nmu s GLY 44 CO 0.75 1.40 0.78 0.00 0.00 0.00 0.00 173.10 176.03 2nmu s THR 46 N 0.32 0.03 -4.91 0.00 -1.32 -0.58 -4.73 115.64 104.45 2nmu s THR 46 Ca 0.00 -0.25 0.00 0.00 -1.21 0.00 0.00 61.69 60.23 2nmu s THR 46 Cb -0.05 -0.74 0.00 0.00 -1.51 0.00 0.00 72.50 70.20 2nmu s THR 46 CO -0.00 -0.14 0.00 0.61 -2.21 0.00 0.00 174.62 172.88 2nmu n GLY 47 N 1.41 -0.49 3.10 6.08 0.00 -1.26 0.17 105.19 114.19 2nmu n GLY 47 Ca -0.19 -1.04 -0.09 0.00 0.00 0.00 0.00 46.02 44.69 2nmu n GLY 47 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2nmu s SER 48 N -4.00 0.24 0.09 1.61 1.04 0.06 -0.55 113.70 112.18 2nmu s SER 48 Ca 0.00 -0.61 0.02 0.00 0.48 0.00 0.00 55.95 55.84 2nmu s SER 48 Cb 0.00 0.21 -0.04 0.00 0.10 0.00 0.00 66.02 66.29 2nmu s SER 48 CO 0.00 -0.51 -0.07 -0.76 0.98 0.00 0.00 173.24 172.88 2nmu s LEU 49 N -2.20 2.45 -0.07 2.42 1.43 0.07 -1.20 118.68 121.59 2nmu s LEU 49 Ca -0.04 -0.90 -0.11 0.00 -1.03 0.00 0.00 54.13 52.05 2nmu s LEU 49 Cb -0.01 -0.11 -0.04 0.00 0.03 0.00 0.00 46.19 46.07 2nmu s LEU 49 CO -0.05 -0.40 -0.21 0.41 0.23 0.00 0.00 176.35 176.33 2nmu n THR 50 N 0.29 1.37 -3.62 5.49 -1.04 -0.28 -1.55 114.28 114.93 2nmu n THR 50 Ca -0.14 0.22 -0.37 0.00 -2.04 0.00 0.00 64.05 61.71 2nmu n THR 50 Cb 0.59 -2.03 -0.06 0.00 -1.82 0.00 0.00 70.33 67.02 2nmu n THR 50 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 2nmu s ASP 51 N -5.98 6.63 -0.05 8.00 1.01 -1.25 -0.86 116.67 124.17 2nmu s ASP 51 Ca -0.18 0.74 0.02 0.00 0.71 0.00 0.00 52.55 53.85 2nmu s ASP 51 Cb 0.03 -2.18 0.01 0.00 1.01 0.00 0.00 42.92 41.78 2nmu s ASP 51 CO 0.26 0.32 -0.12 -0.69 0.21 0.00 0.00 175.17 175.15 2nmu s VAL 52 N -0.83 1.08 -0.25 -1.27 1.01 0.96 -1.30 120.40 119.79 2nmu s VAL 52 Ca 0.20 -0.47 0.02 0.00 0.00 0.00 0.00 61.98 61.73 2nmu s VAL 52 Cb -0.15 -0.98 0.06 0.00 0.00 0.00 0.00 36.38 35.32 2nmu s VAL 52 CO 0.09 0.34 -0.08 0.00 0.00 0.00 0.00 175.10 175.45 2nmu s ALA 53 N 0.52 2.24 0.09 5.51 0.00 -1.26 -0.20 121.76 128.66 2nmu s ALA 53 Ca -0.11 -1.56 0.06 0.00 0.00 0.00 0.00 51.96 50.36 2nmu s ALA 53 Cb -0.14 -1.51 -0.03 0.00 0.00 0.00 0.00 23.12 21.44 2nmu s ALA 53 CO 0.03 -1.21 -0.16 -0.51 0.00 0.00 0.00 175.76 173.91 2nmu s LEU 54 N 1.26 2.31 -0.28 0.00 1.43 -0.52 -4.71 118.68 118.18 2nmu s LEU 54 Ca -0.07 -0.68 0.01 0.00 -1.03 0.00 0.00 54.13 52.35 2nmu s LEU 54 Cb -0.19 -0.65 0.05 0.00 0.03 0.00 0.00 46.19 45.43 2nmu s LEU 54 CO -0.06 -0.04 -0.06 -0.60 0.23 0.00 0.00 176.35 175.82 2nmu s ARG 55 N -2.00 2.35 0.80 1.70 3.52 0.57 0.45 118.95 126.33 2nmu s ARG 55 Ca 0.03 -1.30 -0.11 0.00 -0.13 0.00 0.00 55.73 54.23 2nmu s ARG 55 Cb -0.09 -3.03 0.07 0.00 -1.56 0.00 0.00 34.95 30.35 2nmu s ARG 55 CO 0.03 -0.59 1.10 0.71 -0.81 0.00 0.00 175.30 175.74 2nmu s TYR 56 N 1.18 2.47 -0.13 5.12 2.02 -1.26 -1.19 117.35 125.56 2nmu s TYR 56 Ca -0.07 1.55 -0.39 0.00 -0.37 0.00 0.00 57.07 57.79 2nmu s TYR 56 Cb -0.20 -3.08 -0.17 0.00 -0.40 0.00 0.00 41.96 38.12 2nmu s TYR 56 CO -0.03 -1.94 1.54 0.00 -1.57 0.00 0.00 175.55 173.55 2nmu n ALA 57 N -3.62 -0.76 -0.67 3.71 0.00 -1.26 -1.13 120.51 116.78 2nmu n ALA 57 Ca 0.09 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.99 2nmu n ALA 57 Cb 0.53 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.86 2nmu n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2nmu n GLY 58 N 3.36 0.69 3.85 0.00 0.00 -1.26 -4.99 105.19 106.84 2nmu n GLY 58 Ca 0.23 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.93 2nmu n GLY 58 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2nmu s GLN 59 N -0.40 3.96 -0.18 1.61 -1.52 -0.28 -5.00 119.66 117.85 2nmu s GLN 59 Ca 0.00 0.61 0.08 0.00 -1.95 0.00 0.00 55.36 54.10 2nmu s GLN 59 Cb 0.00 -2.44 -0.22 0.00 -0.22 0.00 0.00 33.01 30.13 2nmu s GLN 59 CO 0.00 0.15 0.12 -1.91 -0.25 0.00 0.00 175.29 173.40 2nmu n GLU 60 N -0.46 0.68 -2.98 2.91 4.07 -1.26 -4.78 120.64 118.82 2nmu n GLU 60 Ca 0.03 0.14 -0.31 0.00 -0.06 0.00 0.00 57.16 56.97 2nmu n GLU 60 Cb 0.53 -1.60 -0.04 0.00 -0.06 0.00 0.00 31.44 30.27 2nmu n GLU 60 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2nmu s ALA 61 N -2.53 3.37 0.03 4.31 0.00 -1.26 -5.07 121.76 120.61 2nmu s ALA 61 Ca -0.19 -0.18 -0.14 0.00 0.00 0.00 0.00 51.96 51.44 2nmu s ALA 61 Cb 0.07 -2.67 -0.06 0.00 0.00 0.00 0.00 23.12 20.46 2nmu s ALA 61 CO 0.74 0.10 0.43 0.99 0.00 0.00 0.00 175.76 178.03 2nmu s THR 62 N -2.24 5.00 -0.22 0.00 2.01 -1.26 -4.53 115.64 114.40 2nmu s THR 62 Ca 0.51 0.82 -0.09 0.00 0.31 0.00 0.00 61.69 63.24 2nmu s THR 62 Cb -0.10 -3.72 -0.04 0.00 0.01 0.00 0.00 72.50 68.64 2nmu s THR 62 CO 0.28 0.52 0.11 -0.89 -0.69 0.00 0.00 174.62 173.94 2nmu s THR 63 N -1.15 5.01 -0.17 -0.82 2.01 0.17 -4.96 115.64 115.73 2nmu s THR 63 Ca 0.26 0.05 -0.05 0.00 0.31 0.00 0.00 61.69 62.27 2nmu s THR 63 Cb -0.16 -3.31 -0.03 0.00 0.01 0.00 0.00 72.50 69.01 2nmu s THR 63 CO 0.15 0.39 -0.00 -0.44 -0.69 0.00 0.00 174.62 174.03 2nmu s SER 64 N 0.83 5.02 0.11 3.53 0.01 -1.26 -1.43 113.70 120.50 2nmu s SER 64 Ca 0.06 -0.09 0.07 0.00 1.31 0.00 0.00 55.95 57.30 2nmu s SER 64 Cb -0.13 -1.84 -0.03 0.00 0.21 0.00 0.00 66.02 64.22 2nmu s SER 64 CO 0.02 0.15 -0.19 -0.76 0.41 0.00 0.00 173.24 172.88 2nmu s LEU 65 N 0.51 2.32 -0.02 2.44 1.43 0.72 -4.98 118.68 121.09 2nmu s LEU 65 Ca -0.01 -0.71 0.01 0.00 -1.03 0.00 0.00 54.13 52.39 2nmu s LEU 65 Cb -0.14 -0.77 0.02 0.00 0.03 0.00 0.00 46.19 45.33 2nmu s LEU 65 CO 0.02 -0.00 -0.01 -0.89 0.23 0.00 0.00 176.35 175.70 2nmu s THR 66 N -1.39 0.21 -0.90 5.49 2.01 -1.26 -0.03 115.64 119.78 2nmu s THR 66 Ca 0.06 -0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.05 2nmu s THR 66 Cb -0.09 -0.26 0.00 0.00 0.01 0.00 0.00 72.50 72.16 2nmu s THR 66 CO 0.04 0.12 0.00 0.61 -0.69 0.00 0.00 174.62 174.70 2nmu n GLY 67 N 3.68 -0.76 3.05 4.40 0.00 -0.04 -5.01 105.19 110.51 2nmu n GLY 67 Ca -0.21 -0.28 -0.32 0.00 0.00 0.00 0.00 46.02 45.21 2nmu n GLY 67 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2nmu s THR 68 N -4.00 2.24 0.08 2.61 2.01 -1.26 -4.32 115.64 112.99 2nmu s THR 68 Ca 0.00 -1.95 0.08 0.00 0.31 0.00 0.00 61.69 60.12 2nmu s THR 68 Cb 0.00 -2.47 -0.03 0.00 0.01 0.00 0.00 72.50 70.01 2nmu s THR 68 CO 0.00 -0.29 -0.20 -0.36 -0.69 0.00 0.00 174.62 173.08 2nmu s PHE 69 N 1.01 1.73 -0.08 4.92 0.08 -0.60 -3.82 117.98 121.23 2nmu s PHE 69 Ca -0.00 -0.40 -0.01 0.00 0.12 0.00 0.00 56.93 56.64 2nmu s PHE 69 Cb -0.20 -0.98 -0.03 0.00 -0.57 0.00 0.00 43.02 41.24 2nmu s PHE 69 CO -0.06 0.15 -0.03 -1.21 -0.10 0.00 0.00 175.22 173.97 2nmu s GLU 70 N -1.64 2.90 -0.34 0.44 0.41 -0.39 -0.75 118.70 119.33 2nmu s GLU 70 Ca 0.06 -0.47 -0.25 0.00 -0.41 0.00 0.00 54.97 53.90 2nmu s GLU 70 Cb -0.10 -2.71 0.01 0.00 -1.78 0.00 0.00 34.13 29.56 2nmu s GLU 70 CO 0.03 0.68 0.87 0.08 -0.49 0.00 0.00 175.26 176.43 2nmu s VAL 71 N -0.83 4.67 -0.08 2.63 1.01 0.28 -1.55 120.40 126.53 2nmu s VAL 71 Ca 0.13 1.18 -0.13 0.00 0.00 0.00 0.00 61.98 63.16 2nmu s VAL 71 Cb -0.11 -4.26 -0.28 0.00 0.00 0.00 0.00 36.38 31.72 2nmu s VAL 71 CO 0.02 -0.42 0.57 0.40 0.00 0.00 0.00 175.10 175.67 2nmu h ILE 72 N 5.73 0.92 -2.35 2.22 1.08 -1.34 -3.35 117.51 120.42 2nmu h ILE 72 Ca -0.24 -2.43 -0.08 0.00 -0.39 0.00 0.00 64.86 61.72 2nmu h ILE 72 Cb 1.09 2.70 -0.21 0.00 -3.07 0.00 0.00 36.82 37.32 2nmu h ILE 72 CO 0.94 0.79 -0.02 -0.94 -0.69 0.00 0.00 178.15 178.24 2nmu s SER 73 N -7.15 -0.56 -0.19 1.72 1.04 -1.13 -4.96 113.70 102.47 2nmu s SER 73 Ca -0.19 0.95 -0.04 0.00 0.48 0.00 0.00 55.95 57.15 2nmu s SER 73 Cb 0.05 0.95 0.06 0.00 0.10 0.00 0.00 66.02 67.18 2nmu s SER 73 CO 0.80 -0.31 0.08 -0.22 0.98 0.00 0.00 173.24 174.56 2nmu s LEU 74 N -0.19 0.64 0.18 2.42 2.96 -1.26 -1.15 118.68 122.27 2nmu s LEU 74 Ca -0.04 -0.73 0.09 0.00 -0.22 0.00 0.00 54.13 53.23 2nmu s LEU 74 Cb -0.03 -0.36 -0.04 0.00 0.50 0.00 0.00 46.19 46.25 2nmu s LEU 74 CO 0.03 -0.34 -0.18 0.20 -1.32 0.00 0.00 176.35 174.74 2nmu s ASN 75 N 2.04 2.77 0.00 3.68 0.01 -0.42 -4.73 114.94 118.29 2nmu s ASN 75 Ca 0.02 -0.90 0.00 0.00 -0.71 0.00 0.00 52.86 51.27 2nmu s ASN 75 Cb -0.16 -0.17 0.00 0.00 0.41 0.00 0.00 41.25 41.33 2nmu s ASN 75 CO -0.11 -0.04 0.00 0.61 -1.51 0.00 0.00 177.10 176.05 2nmu n GLY 76 N 0.11 1.17 3.69 0.66 0.00 -1.26 -0.24 105.19 109.32 2nmu n GLY 76 Ca -0.12 -1.94 -0.23 0.00 0.00 0.00 0.00 46.02 43.73 2nmu n GLY 76 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2nmu s THR 77 N -1.07 3.62 0.05 2.61 -4.23 -0.87 -1.34 115.64 114.42 2nmu s THR 77 Ca 0.00 -1.80 -0.25 0.00 -1.18 0.00 0.00 61.69 58.46 2nmu s THR 77 Cb 0.00 -2.97 0.06 0.00 1.34 0.00 0.00 72.50 70.94 2nmu s THR 77 CO 0.00 -0.36 0.59 -1.48 -0.54 0.00 0.00 174.62 172.83 2nmu s LEU 78 N -3.72 -0.39 0.38 4.79 2.34 -0.34 -1.08 118.68 120.66 2nmu s LEU 78 Ca 0.32 0.28 -0.14 0.00 0.06 0.00 0.00 54.13 54.65 2nmu s LEU 78 Cb -0.06 2.38 0.05 0.00 -0.56 0.00 0.00 46.19 47.99 2nmu s LEU 78 CO 0.21 -0.76 0.74 -1.83 -1.06 0.00 0.00 176.35 173.66 2nmu s GLU 79 N -2.46 2.18 0.29 1.48 1.03 0.27 -1.48 118.70 120.00 2nmu s GLU 79 Ca -0.05 -1.47 -0.00 0.00 0.03 0.00 0.00 54.97 53.48 2nmu s GLU 79 Cb -0.01 0.60 0.67 0.00 -0.80 0.00 0.00 34.13 34.60 2nmu s GLU 79 CO -0.02 -1.01 1.61 -0.07 -1.33 0.00 0.00 175.26 174.44 2nmu h LEU 80 N 2.01 -0.31 -3.03 1.83 3.38 -1.62 -2.84 115.31 114.74 2nmu h LEU 80 Ca -0.31 0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 2nmu h LEU 80 Cb 1.25 0.39 -0.01 0.00 0.09 0.00 0.00 40.66 42.38 2nmu h LEU 80 CO 0.40 -0.26 -0.45 0.35 0.09 0.00 0.00 178.44 178.56 2nmu n THR 81 N -5.38 2.23 0.00 0.22 -2.24 -1.26 -4.94 114.28 102.91 2nmu n THR 81 Ca 0.20 -3.19 0.00 0.00 -2.27 0.00 0.00 64.05 58.80 2nmu n THR 81 Cb 0.68 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 2nmu n THR 81 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2nmu n GLY 82 N -1.13 0.08 3.63 3.38 0.00 -1.07 -4.95 105.19 105.13 2nmu n GLY 82 Ca 0.20 -0.91 -0.03 0.00 0.00 0.00 0.00 46.02 45.28 2nmu n GLY 82 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2nmu s GLU 83 N -2.00 0.70 -0.33 1.61 1.03 -1.26 -0.57 118.70 117.88 2nmu s GLU 83 Ca 0.00 -0.34 0.04 0.00 0.03 0.00 0.00 54.97 54.70 2nmu s GLU 83 Cb 0.00 0.27 0.17 0.00 -0.80 0.00 0.00 34.13 33.77 2nmu s GLU 83 CO 0.00 -0.31 0.48 -1.58 -1.33 0.00 0.00 175.26 172.52 2nmu s HIS 84 N -2.82 -1.18 0.01 4.83 2.46 -0.24 -4.97 115.29 113.38 2nmu s HIS 84 Ca 0.11 0.23 0.08 0.00 0.47 0.00 0.00 55.06 55.95 2nmu s HIS 84 Cb 0.01 -0.02 -0.02 0.00 -0.13 0.00 0.00 32.58 32.41 2nmu s HIS 84 CO -0.03 -1.04 -0.25 -0.51 -2.47 0.00 0.00 174.74 170.43 2nmu s LEU 85 N 2.25 2.11 0.03 8.88 1.43 -1.26 -2.06 118.68 130.06 2nmu s LEU 85 Ca 0.12 -0.52 0.08 0.00 -1.03 0.00 0.00 54.13 52.79 2nmu s LEU 85 Cb -0.11 -1.26 -0.03 0.00 0.03 0.00 0.00 46.19 44.82 2nmu s LEU 85 CO -0.20 0.28 -0.24 -1.00 0.23 0.00 0.00 176.35 175.42 2nmu s HIS 86 N -0.70 2.40 0.03 0.29 3.76 0.67 -4.63 115.29 117.10 2nmu s HIS 86 Ca 0.10 -0.37 0.05 0.00 -0.15 0.00 0.00 55.06 54.70 2nmu s HIS 86 Cb -0.10 -1.44 -0.02 0.00 1.11 0.00 0.00 32.58 32.14 2nmu s HIS 86 CO 0.01 0.13 -0.15 -1.17 -0.85 0.00 0.00 174.74 172.71 2nmu s LEU 87 N -1.15 2.14 -0.07 0.89 2.96 -0.58 -1.31 118.68 121.56 2nmu s LEU 87 Ca 0.12 -0.42 0.02 0.00 -0.22 0.00 0.00 54.13 53.63 2nmu s LEU 87 Cb -0.10 -0.67 0.02 0.00 0.50 0.00 0.00 46.19 45.94 2nmu s LEU 87 CO 0.02 0.08 -0.10 0.00 -1.32 0.00 0.00 176.35 175.03 2nmu s ALA 88 N -0.72 1.14 0.15 5.97 0.00 -0.30 -1.91 121.76 126.08 2nmu s ALA 88 Ca 0.03 -0.35 0.06 0.00 0.00 0.00 0.00 51.96 51.71 2nmu s ALA 88 Cb -0.07 -0.57 -0.04 0.00 0.00 0.00 0.00 23.12 22.43 2nmu s ALA 88 CO 0.01 0.03 -0.14 0.14 0.00 0.00 0.00 175.76 175.80 2nmu s VAL 89 N 0.83 1.47 0.03 0.00 -7.23 -0.22 -0.92 120.40 114.35 2nmu s VAL 89 Ca -0.12 -1.91 0.07 0.00 -1.81 0.00 0.00 61.98 58.21 2nmu s VAL 89 Cb -0.15 -1.74 -0.02 0.00 0.56 0.00 0.00 36.38 35.02 2nmu s VAL 89 CO 0.02 -0.49 -0.21 -0.94 -0.31 0.00 0.00 175.10 173.17 2nmu s SER 90 N -2.79 2.50 0.51 4.85 1.04 -0.60 -1.28 113.70 117.94 2nmu s SER 90 Ca 0.14 -0.48 0.04 0.00 0.48 0.00 0.00 55.95 56.13 2nmu s SER 90 Cb -0.03 -0.23 0.08 0.00 0.10 0.00 0.00 66.02 65.94 2nmu s SER 90 CO 0.04 0.20 0.64 -0.90 0.98 0.00 0.00 173.24 174.20 2nmu n ASP 91 N 2.06 1.33 0.00 7.02 5.68 0.00 -1.26 116.55 131.39 2nmu n ASP 91 Ca -0.17 -2.01 0.00 0.00 -0.50 0.00 0.00 54.79 52.11 2nmu n ASP 91 Cb 0.53 -0.37 0.00 0.00 -1.14 0.00 0.00 41.12 40.14 2nmu n ASP 91 CO 0.00 0.00 0.00 -2.65 -1.33 0.00 0.00 177.20 173.22 2nmu n PRO 92 N -2.09 0.00 -0.05 0.11 -0.02 -1.25 -1.55 135.00 130.15 2nmu n PRO 92 Ca 0.12 0.24 0.05 0.00 -2.02 0.00 0.00 63.50 61.89 2nmu n PRO 92 Cb 0.44 -1.51 0.07 0.00 -0.02 0.00 0.00 33.50 32.48 2nmu n PRO 92 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2nmu n TYR 93 N -1.23 0.00 0.00 6.00 4.01 -1.26 -4.98 117.16 119.69 2nmu n TYR 93 Ca 0.00 -0.75 0.00 0.00 -0.16 0.00 0.00 57.90 56.99 2nmu n TYR 93 Cb 0.01 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 38.93 2nmu n TYR 93 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2nmu n GLY 94 N -0.99 2.34 3.37 2.72 0.00 -0.60 -5.22 105.19 106.81 2nmu n GLY 94 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 2nmu n GLY 94 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2nmu n VAL 95 N -2.00 0.00 0.00 1.61 0.31 -1.26 -4.66 118.33 112.32 2nmu n VAL 95 Ca 0.00 -0.31 0.00 0.00 -0.01 0.00 0.00 64.34 64.02 2nmu n VAL 95 Cb 0.00 -1.14 0.00 0.00 -0.91 0.00 0.00 33.84 31.79 2nmu n VAL 95 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2nmu n LEU 97 N 0.00 0.00 -3.70 7.52 4.77 -0.40 -0.82 117.00 124.37 2nmu n LEU 97 Ca 0.15 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.02 2nmu n LEU 97 Cb 0.59 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.62 2nmu n LEU 97 CO 0.40 0.00 0.08 -0.83 -1.33 0.00 0.00 177.39 175.71 2nmu s GLY 98 N 0.00 -0.17 0.00 -0.72 0.00 -1.26 -1.06 107.32 104.11 2nmu s GLY 98 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 44.72 44.55 2nmu s GLY 98 CO 0.00 -0.41 0.00 0.61 0.00 0.00 0.00 173.10 173.30 2nmu n GLY 99 N -0.06 -1.10 0.00 0.20 0.00 -0.80 -4.82 105.19 98.60 2nmu n GLY 99 Ca -0.16 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 44.98 2nmu n GLY 99 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2nmu n HIS 100 N 2.53 0.00 -2.63 1.61 -0.00 -0.33 -1.52 115.22 114.88 2nmu n HIS 100 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 57.72 57.35 2nmu n HIS 100 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 29.94 2nmu n HIS 100 CO 0.00 0.00 0.00 -2.14 -0.00 0.00 0.00 176.34 174.20 2nmu s PRO 103 N 0.00 4.38 0.00 1.57 0.02 -1.26 -0.32 135.00 139.39 2nmu s PRO 103 Ca 0.00 1.47 0.00 0.00 0.02 0.00 0.00 61.00 62.49 2nmu s PRO 103 Cb 0.00 -2.71 0.00 0.00 0.02 0.00 0.00 34.50 31.81 2nmu s PRO 103 CO 0.00 0.06 0.00 0.41 -0.33 0.00 0.00 177.00 177.14 2nmu n GLY 104 N 0.51 0.93 3.69 0.52 0.00 -1.26 -4.77 105.19 104.81 2nmu n GLY 104 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2nmu n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nmu s THR 106 N 1.69 3.06 0.25 0.00 -4.23 -0.42 -0.95 115.64 115.05 2nmu s THR 106 Ca 0.45 -0.71 -0.30 0.00 -1.18 0.00 0.00 61.69 59.96 2nmu s THR 106 Cb -0.18 -2.22 -0.10 0.00 1.34 0.00 0.00 72.50 71.34 2nmu s THR 106 CO 0.19 0.57 1.38 -0.69 -0.54 0.00 0.00 174.62 175.53 2nmu s VAL 107 N -0.45 2.82 -0.00 2.29 1.01 0.08 -1.13 120.40 125.02 2nmu s VAL 107 Ca 0.06 0.71 -0.00 0.00 0.00 0.00 0.00 61.98 62.75 2nmu s VAL 107 Cb -0.12 -3.46 -0.00 0.00 0.00 0.00 0.00 36.38 32.81 2nmu s VAL 107 CO 0.02 0.12 -0.00 -0.09 0.00 0.00 0.00 175.10 175.15 2nmu h ARG 108 N 4.78 0.00 0.00 2.72 2.43 -1.41 -0.06 114.38 122.84 2nmu h ARG 108 Ca -0.46 0.00 -0.20 0.00 -0.81 0.00 0.00 59.98 58.51 2nmu h ARG 108 Cb 1.22 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.73 2nmu h ARG 108 CO 0.75 0.00 -1.74 0.25 -1.51 0.00 0.00 179.97 177.72 2nmu n THR 109 N -2.24 0.74 -3.60 0.20 -2.24 -1.26 -4.42 114.28 101.46 2nmu n THR 109 Ca -0.00 -0.36 -0.03 0.00 -2.27 0.00 0.00 64.05 61.39 2nmu n THR 109 Cb 0.00 -0.86 -0.02 0.00 -2.10 0.00 0.00 70.33 67.36 2nmu n THR 109 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2nmu s THR 110 N -2.26 0.00 -0.19 4.28 -1.32 -1.26 -4.19 115.64 110.70 2nmu s THR 110 Ca -0.12 -0.09 -0.04 0.00 -1.21 0.00 0.00 61.69 60.23 2nmu s THR 110 Cb 0.04 -1.31 0.09 0.00 -1.51 0.00 0.00 72.50 69.81 2nmu s THR 110 CO 0.36 0.00 0.24 -0.22 -2.21 0.00 0.00 174.62 172.79 2nmu s LEU 111 N -2.46 -0.18 -0.18 9.08 2.96 -1.16 -0.76 118.68 125.98 2nmu s LEU 111 Ca 0.10 -0.08 -0.10 0.00 -0.22 0.00 0.00 54.13 53.84 2nmu s LEU 111 Cb 0.00 0.48 -0.05 0.00 0.50 0.00 0.00 46.19 47.13 2nmu s LEU 111 CO -0.05 -0.31 0.15 -1.61 -1.32 0.00 0.00 176.35 173.21 2nmu s GLU 112 N 2.35 4.08 0.02 1.98 2.02 0.13 -0.38 118.70 128.90 2nmu s GLU 112 Ca 0.07 -0.17 0.02 0.00 0.02 0.00 0.00 54.97 54.90 2nmu s GLU 112 Cb -0.15 -3.38 -0.01 0.00 0.10 0.00 0.00 34.13 30.68 2nmu s GLU 112 CO -0.12 0.37 -0.06 -0.51 0.02 0.00 0.00 175.26 174.96 2nmu s LEU 113 N 0.15 2.14 -0.19 1.80 1.43 -0.29 -1.53 118.68 122.18 2nmu s LEU 113 Ca 0.10 -0.33 0.01 0.00 -1.03 0.00 0.00 54.13 52.88 2nmu s LEU 113 Cb -0.11 -0.20 0.04 0.00 0.03 0.00 0.00 46.19 45.94 2nmu s LEU 113 CO -0.00 -0.08 -0.12 -0.69 0.23 0.00 0.00 176.35 175.68 2nmu s VAL 114 N -0.78 1.72 -0.12 -1.59 1.01 -0.26 -1.37 120.40 119.02 2nmu s VAL 114 Ca -0.04 -0.98 -0.01 0.00 0.00 0.00 0.00 61.98 60.95 2nmu s VAL 114 Cb -0.06 -1.73 -0.02 0.00 0.00 0.00 0.00 36.38 34.56 2nmu s VAL 114 CO 0.00 0.25 -0.09 -0.63 0.00 0.00 0.00 175.10 174.63 2nmu s ILE 115 N 1.38 3.45 0.01 2.22 1.01 0.33 -0.88 121.20 128.72 2nmu s ILE 115 Ca 0.00 -0.54 -0.01 0.00 0.00 0.00 0.00 60.65 60.11 2nmu s ILE 115 Cb -0.15 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.82 2nmu s ILE 115 CO -0.09 0.54 0.12 -0.83 0.00 0.00 0.00 174.94 174.68 2nmu s GLY 116 N -0.01 2.08 -0.04 6.18 0.00 -0.47 -0.60 107.32 114.46 2nmu s GLY 116 Ca -0.01 -0.85 0.04 0.00 0.00 0.00 0.00 44.72 43.90 2nmu s GLY 116 CO 0.03 -0.75 -0.15 1.85 0.00 0.00 0.00 173.10 174.08 2nmu s GLU 117 N -1.94 1.54 -0.66 2.90 2.56 0.17 -1.12 118.70 122.16 2nmu s GLU 117 Ca 0.26 -0.53 -0.09 0.00 0.00 0.00 0.00 54.97 54.61 2nmu s GLU 117 Cb -0.12 -1.37 0.17 0.00 2.00 0.00 0.00 34.13 34.81 2nmu s GLU 117 CO 0.18 0.22 0.53 -0.51 -0.56 0.00 0.00 175.26 175.12 2nmu s LEU 118 N 0.03 5.91 0.51 2.70 1.43 0.18 -1.27 118.68 128.18 2nmu s LEU 118 Ca -0.03 -2.53 0.29 0.00 -1.03 0.00 0.00 54.13 50.83 2nmu s LEU 118 Cb -0.10 -2.03 1.41 0.00 0.03 0.00 0.00 46.19 45.50 2nmu s LEU 118 CO 0.01 -0.54 1.88 -0.65 0.23 0.00 0.00 176.35 177.29 2nmu h PRO 119 N 7.70 0.08 -0.00 1.29 0.11 -1.87 -1.62 132.00 137.68 2nmu h PRO 119 Ca -0.03 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.07 2nmu h PRO 119 Cb 1.02 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2nmu h PRO 119 CO 0.77 0.05 -0.15 0.00 -0.21 0.00 0.00 178.00 178.46 2nmu n ALA 120 N -2.67 2.78 -2.57 -0.75 0.00 -1.26 -4.71 120.51 111.32 2nmu n ALA 120 Ca 0.19 -0.23 -0.26 0.00 0.00 0.00 0.00 53.44 53.14 2nmu n ALA 120 Cb 0.91 -1.34 -0.11 0.00 0.00 0.00 0.00 19.45 18.92 2nmu n ALA 120 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2nmu s LEU 121 N -2.72 2.70 -0.04 0.00 1.43 -0.61 -1.16 118.68 118.27 2nmu s LEU 121 Ca 0.21 -1.36 -0.01 0.00 -1.03 0.00 0.00 54.13 51.94 2nmu s LEU 121 Cb 0.19 -0.78 0.03 0.00 0.03 0.00 0.00 46.19 45.67 2nmu s LEU 121 CO 0.53 -0.47 0.07 -0.89 0.23 0.00 0.00 176.35 175.82 2nmu s THR 122 N -2.85 -0.08 -0.08 5.49 2.01 0.25 -4.41 115.64 115.98 2nmu s THR 122 Ca 0.35 0.25 -0.08 0.00 0.31 0.00 0.00 61.69 62.52 2nmu s THR 122 Cb 0.09 -0.14 -0.04 0.00 0.01 0.00 0.00 72.50 72.42 2nmu s THR 122 CO 0.17 0.10 0.20 -0.36 -0.69 0.00 0.00 174.62 174.05 2nmu s PHE 123 N 1.32 3.62 0.16 4.92 0.08 0.98 -2.00 117.98 127.04 2nmu s PHE 123 Ca -0.06 0.60 -0.09 0.00 0.12 0.00 0.00 56.93 57.50 2nmu s PHE 123 Cb -0.12 -2.00 -0.01 0.00 -0.57 0.00 0.00 43.02 40.32 2nmu s PHE 123 CO -0.04 0.70 0.28 -1.54 -0.10 0.00 0.00 175.22 174.52 2nmu s SER 124 N -1.18 0.04 -0.29 1.36 1.04 -0.60 -4.87 113.70 109.19 2nmu s SER 124 Ca 0.19 -0.84 -0.03 0.00 0.48 0.00 0.00 55.95 55.75 2nmu s SER 124 Cb -0.13 0.43 0.03 0.00 0.10 0.00 0.00 66.02 66.45 2nmu s SER 124 CO 0.08 -0.88 0.02 -0.13 0.98 0.00 0.00 173.24 173.31 2nmu s ARG 125 N -3.95 2.69 0.05 4.02 1.81 -1.26 -0.19 118.95 122.11 2nmu s ARG 125 Ca 0.16 -1.10 0.08 0.00 -1.72 0.00 0.00 55.73 53.14 2nmu s ARG 125 Cb 0.03 -3.22 -0.03 0.00 -0.45 0.00 0.00 34.95 31.29 2nmu s ARG 125 CO -0.01 -0.54 -0.22 -0.65 -0.68 0.00 0.00 175.30 173.20 2nmu s GLN 126 N 1.34 1.94 0.19 3.54 -1.52 -0.11 -4.76 119.66 120.28 2nmu s GLN 126 Ca -0.02 -1.05 -0.33 0.00 -1.95 0.00 0.00 55.36 52.02 2nmu s GLN 126 Cb -0.18 -2.10 -0.13 0.00 -0.22 0.00 0.00 33.01 30.38 2nmu s GLN 126 CO -0.01 0.53 1.63 -0.35 -0.25 0.00 0.00 175.29 176.84 2nmu n PRO 127 N 1.60 2.43 -3.72 2.91 -0.04 -1.26 -0.52 135.00 136.40 2nmu n PRO 127 Ca -0.16 0.87 -0.37 0.00 -0.04 0.00 0.00 63.50 63.80 2nmu n PRO 127 Cb 0.52 -2.67 -0.12 0.00 -0.04 0.00 0.00 33.50 31.19 2nmu n PRO 127 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2nmu h ALA 129 N 8.27 1.00 0.00 0.00 0.00 -1.93 0.51 119.26 127.11 2nmu h ALA 129 Ca -0.36 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 2nmu h ALA 129 Cb 1.16 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 2nmu h ALA 129 CO 0.59 0.00 -0.14 0.82 0.00 0.00 0.00 179.25 180.51 2nmu h ILE 130 N 0.00 0.81 0.00 0.00 2.04 -1.95 -3.39 117.51 115.03 2nmu h ILE 130 Ca 0.00 -1.65 -0.22 0.00 1.00 0.00 0.00 64.86 64.00 2nmu h ILE 130 Cb 0.28 1.57 -0.03 0.00 -0.74 0.00 0.00 36.82 37.90 2nmu h ILE 130 CO 0.00 0.27 -1.09 0.77 0.00 0.00 0.00 178.15 178.10 2nmu h SER 131 N -1.00 0.00 0.00 1.72 4.64 -1.99 -3.48 113.55 113.45 2nmu h SER 131 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2nmu h SER 131 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 2nmu h SER 131 CO -0.02 0.96 0.00 0.61 -0.87 0.00 0.00 176.83 177.51 2nmu n GLY 132 N 1.38 0.76 3.50 -0.77 0.00 0.17 -5.06 105.19 105.17 2nmu n GLY 132 Ca -0.03 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 2nmu n GLY 132 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2nmu s TYR 133 N -2.17 2.09 -0.22 1.61 2.02 -1.25 -4.89 117.35 114.55 2nmu s TYR 133 Ca 0.00 -0.90 -0.28 0.00 -0.37 0.00 0.00 57.07 55.52 2nmu s TYR 133 Cb 0.00 -1.41 0.00 0.00 -0.40 0.00 0.00 41.96 40.15 2nmu s TYR 133 CO 0.00 0.11 0.98 -0.51 -1.57 0.00 0.00 175.55 174.56 2nmu s ASP 134 N -3.55 7.05 0.37 2.29 1.01 -1.26 -0.94 116.67 121.63 2nmu s ASP 134 Ca 0.35 1.31 0.08 0.00 0.71 0.00 0.00 52.55 55.00 2nmu s ASP 134 Cb 0.09 -2.51 -0.05 0.00 1.01 0.00 0.00 42.92 41.45 2nmu s ASP 134 CO 0.16 -0.60 0.09 -1.61 0.21 0.00 0.00 175.17 173.42 2nmu s GLU 135 N 2.95 2.16 0.14 8.23 0.41 0.32 -4.74 118.70 128.18 2nmu s GLU 135 Ca 0.42 -1.79 -0.31 0.00 -0.41 0.00 0.00 54.97 52.88 2nmu s GLU 135 Cb -0.15 -1.95 -0.11 0.00 -1.78 0.00 0.00 34.13 30.14 2nmu s GLU 135 CO 0.08 0.02 1.82 -1.17 -0.49 0.00 0.00 175.26 175.52 2nmu s LEU 136 N -3.80 4.40 -0.11 1.80 2.96 -1.26 -0.93 118.68 121.73 2nmu s LEU 136 Ca 0.37 2.79 0.03 0.00 -0.22 0.00 0.00 54.13 57.11 2nmu s LEU 136 Cb 0.02 -3.57 0.01 0.00 0.50 0.00 0.00 46.19 43.14 2nmu s LEU 136 CO 0.21 -1.00 -0.21 -2.28 -1.32 0.00 0.00 176.35 171.75 2nmu s HIS 137 N 2.45 2.40 -0.19 5.38 5.65 0.73 -4.87 115.29 126.84 2nmu s HIS 137 Ca 0.80 -1.09 -0.03 0.00 0.25 0.00 0.00 55.06 55.00 2nmu s HIS 137 Cb -0.47 -1.64 -0.01 0.00 -1.18 0.00 0.00 32.58 29.28 2nmu s HIS 137 CO 0.36 -0.48 -0.07 0.42 -0.65 0.00 0.00 174.74 174.31 2nmu s ILE 138 N 0.65 3.28 0.19 0.89 1.01 -1.26 -1.56 121.20 124.39 2nmu s ILE 138 Ca -0.12 -0.54 0.02 0.00 0.00 0.00 0.00 60.65 60.00 2nmu s ILE 138 Cb -0.16 -2.46 -0.05 0.00 0.01 0.00 0.00 42.46 39.80 2nmu s ILE 138 CO 0.03 0.46 0.02 -0.94 0.00 0.00 0.00 174.94 174.51 2nmu s SER 139 N 1.10 1.19 0.37 3.58 1.04 -0.85 -4.98 113.70 115.15 2nmu s SER 139 Ca 0.01 -1.21 -0.27 0.00 0.48 0.00 0.00 55.95 54.96 2nmu s SER 139 Cb -0.15 0.13 -0.09 0.00 0.10 0.00 0.00 66.02 66.01 2nmu s SER 139 CO -0.01 -0.60 1.23 -0.55 0.98 0.00 0.00 173.24 174.29 2nmu s SER 140 N -3.19 6.60 0.02 7.02 0.15 -1.26 -0.58 113.70 122.45 2nmu s SER 140 Ca 0.26 2.50 -0.25 0.00 0.70 0.00 0.00 55.95 59.16 2nmu s SER 140 Cb 0.06 -2.63 -0.18 0.00 -1.71 0.00 0.00 66.02 61.56 2nmu s SER 140 CO 0.06 -0.64 1.43 -0.09 1.20 0.00 0.00 173.24 175.20 2nmu h ARG 141 N 2.94 -0.08 0.00 5.44 9.65 -1.36 -3.42 114.38 127.55 2nmu h ARG 141 Ca -0.49 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.40 2nmu h ARG 141 Cb 1.23 0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.83 2nmu h ARG 141 CO 0.64 0.22 0.00 1.47 2.80 0.00 0.00 179.97 185.09