#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mk5 h ILE 17 N 0.00 1.35 -2.69 -0.61 2.04 -1.97 -3.44 117.51 112.20 1mk5 h ILE 17 Ca 0.00 -2.00 -0.53 0.00 1.00 0.00 0.00 64.86 63.33 1mk5 h ILE 17 Cb 0.00 1.98 0.06 0.00 -0.74 0.00 0.00 36.82 38.12 1mk5 h ILE 17 CO 0.00 0.61 0.95 0.41 0.00 0.00 0.00 178.15 180.12 1mk5 n THR 18 N -3.89 0.17 -2.59 -0.27 -1.04 -1.26 -4.82 114.28 100.58 1mk5 n THR 18 Ca -0.04 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 1mk5 n THR 18 Cb 0.67 -1.91 0.00 0.00 -1.82 0.00 0.00 70.33 67.27 1mk5 n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1mk5 n GLY 19 N 3.59 -0.65 3.38 3.41 0.00 -0.31 -5.00 105.19 109.62 1mk5 n GLY 19 Ca 0.15 -1.46 -0.35 0.00 0.00 0.00 0.00 46.02 44.36 1mk5 n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mk5 s THR 20 N -2.63 3.73 0.21 2.61 2.01 -1.26 -1.19 115.64 119.12 1mk5 s THR 20 Ca 0.00 -0.37 0.11 0.00 0.31 0.00 0.00 61.69 61.73 1mk5 s THR 20 Cb 0.00 -2.71 -0.04 0.00 0.01 0.00 0.00 72.50 69.76 1mk5 s THR 20 CO 0.00 0.41 -0.20 0.26 -0.69 0.00 0.00 174.62 174.40 1mk5 s TRP 21 N 1.38 2.38 -0.00 4.92 0.52 0.10 -4.48 118.94 123.76 1mk5 s TRP 21 Ca 0.05 -0.32 0.02 0.00 0.02 0.00 0.00 56.10 55.86 1mk5 s TRP 21 Cb -0.15 -1.14 -0.00 0.00 -1.15 0.00 0.00 33.47 31.03 1mk5 s TRP 21 CO -0.00 0.54 -0.05 0.71 0.02 0.00 0.00 176.95 178.17 1mk5 s TYR 22 N -1.84 0.44 0.03 -1.98 1.51 0.39 -0.30 117.35 115.60 1mk5 s TYR 22 Ca 0.23 -0.10 0.00 0.00 -1.01 0.00 0.00 57.07 56.20 1mk5 s TYR 22 Cb -0.08 -0.28 0.00 0.00 -0.11 0.00 0.00 41.96 41.50 1mk5 s TYR 22 CO 0.12 -0.01 0.04 0.27 -1.11 0.00 0.00 175.55 174.86 1mk5 n ASN 23 N 2.88 0.30 0.18 2.29 2.04 -0.84 -1.28 115.26 120.84 1mk5 n ASN 23 Ca -0.13 -1.08 0.14 0.00 -0.44 0.00 0.00 54.58 53.06 1mk5 n ASN 23 Cb 0.58 -0.02 0.51 0.00 -2.53 0.00 0.00 39.78 38.32 1mk5 n ASN 23 CO 0.00 0.00 0.00 0.06 -0.44 0.00 0.00 177.26 176.88 1mk5 h GLN 24 N 0.00 0.00 -0.00 -3.83 -0.00 -1.90 -1.73 115.11 107.65 1mk5 h GLN 24 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.64 1mk5 h GLN 24 Cb 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.54 1mk5 h GLN 24 CO 0.02 0.00 -0.43 1.28 -0.00 0.00 0.00 178.83 179.70 1mk5 n LEU 25 N -2.59 0.49 0.00 0.06 4.77 -1.26 -4.96 117.00 113.50 1mk5 n LEU 25 Ca 0.02 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 1mk5 n LEU 25 Cb 0.31 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1mk5 n LEU 25 CO 0.25 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.04 1mk5 n GLY 26 N 1.49 0.65 3.78 -0.72 0.00 -0.65 -4.70 105.19 105.04 1mk5 n GLY 26 Ca 0.06 -0.31 -0.36 0.00 0.00 0.00 0.00 46.02 45.41 1mk5 n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mk5 s SER 27 N -2.28 6.06 -0.17 1.61 0.01 -1.26 -4.60 113.70 113.06 1mk5 s SER 27 Ca 0.00 2.20 -0.01 0.00 1.31 0.00 0.00 55.95 59.45 1mk5 s SER 27 Cb 0.00 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.64 1mk5 s SER 27 CO 0.00 -0.99 -0.11 -0.89 0.41 0.00 0.00 173.24 171.66 1mk5 s THR 28 N -1.68 2.97 -0.26 1.44 2.01 0.19 -1.99 115.64 118.32 1mk5 s THR 28 Ca 0.67 -0.66 0.02 0.00 0.31 0.00 0.00 61.69 62.04 1mk5 s THR 28 Cb -0.25 -2.29 0.06 0.00 0.01 0.00 0.00 72.50 70.04 1mk5 s THR 28 CO 0.30 0.49 -0.08 0.12 -0.69 0.00 0.00 174.62 174.75 1mk5 s PHE 29 N 0.93 3.08 -0.23 4.92 5.36 0.59 -0.88 117.98 131.75 1mk5 s PHE 29 Ca -0.02 -2.24 -0.04 0.00 -0.96 0.00 0.00 56.93 53.67 1mk5 s PHE 29 Cb -0.15 -1.91 -0.01 0.00 -0.34 0.00 0.00 43.02 40.61 1mk5 s PHE 29 CO -0.01 -0.86 -0.03 0.42 -1.46 0.00 0.00 175.22 173.29 1mk5 s ILE 30 N 1.16 3.47 0.01 3.12 1.01 -0.31 0.02 121.20 129.68 1mk5 s ILE 30 Ca -0.07 -0.50 -0.03 0.00 0.00 0.00 0.00 60.65 60.05 1mk5 s ILE 30 Cb -0.20 -2.61 -0.01 0.00 0.01 0.00 0.00 42.46 39.66 1mk5 s ILE 30 CO -0.06 0.38 0.05 0.54 0.00 0.00 0.00 174.94 175.85 1mk5 s VAL 31 N 1.49 0.10 -0.12 2.92 0.11 -0.33 -0.61 120.40 123.96 1mk5 s VAL 31 Ca 0.05 -0.85 0.03 0.00 -2.93 0.00 0.00 61.98 58.28 1mk5 s VAL 31 Cb -0.15 -0.39 -0.00 0.00 -1.53 0.00 0.00 36.38 34.31 1mk5 s VAL 31 CO -0.02 -0.47 -0.21 -0.89 -3.33 0.00 0.00 175.10 170.18 1mk5 s THR 32 N -1.54 2.30 -0.38 5.04 2.01 0.14 -1.16 115.64 122.06 1mk5 s THR 32 Ca -0.15 -0.92 -0.15 0.00 0.31 0.00 0.00 61.69 60.79 1mk5 s THR 32 Cb -0.08 -1.92 0.00 0.00 0.01 0.00 0.00 72.50 70.51 1mk5 s THR 32 CO -0.00 0.55 0.32 0.00 -0.69 0.00 0.00 174.62 174.79 1mk5 s ALA 33 N 0.50 3.48 0.60 7.40 0.00 -1.26 -1.72 121.76 130.76 1mk5 s ALA 33 Ca -0.13 -1.48 -0.16 0.00 0.00 0.00 0.00 51.96 50.19 1mk5 s ALA 33 Cb -0.17 -2.84 -0.03 0.00 0.00 0.00 0.00 23.12 20.08 1mk5 s ALA 33 CO 0.05 -1.25 1.06 0.20 0.00 0.00 0.00 175.76 175.81 1mk5 s GLY 34 N 1.73 2.11 0.53 0.00 0.00 0.66 -4.88 107.32 107.47 1mk5 s GLY 34 Ca 0.08 0.39 0.22 0.00 0.00 0.00 0.00 44.72 45.40 1mk5 s GLY 34 CO 0.11 0.71 2.14 0.00 0.00 0.00 0.00 173.10 176.05 1mk5 h ALA 35 N 0.40 1.66 -0.52 3.20 0.00 -1.98 -2.64 119.26 119.38 1mk5 h ALA 35 Ca -0.47 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1mk5 h ALA 35 Cb 1.22 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1mk5 h ALA 35 CO 0.57 0.08 0.00 -0.25 0.00 0.00 0.00 179.25 179.65 1mk5 n ASP 36 N -4.12 4.32 0.00 0.00 10.43 -1.26 -4.87 116.55 121.04 1mk5 n ASP 36 Ca -0.03 -2.49 0.00 0.00 2.57 0.00 0.00 54.79 54.84 1mk5 n ASP 36 Cb 0.15 -0.51 0.00 0.00 1.84 0.00 0.00 41.12 42.59 1mk5 n ASP 36 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1mk5 n GLY 37 N 0.69 1.28 3.79 0.44 0.00 -0.99 -4.84 105.19 105.55 1mk5 n GLY 37 Ca 0.23 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.89 1mk5 n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mk5 s ALA 38 N -1.97 3.18 -0.12 4.61 0.00 -1.25 -1.01 121.76 125.19 1mk5 s ALA 38 Ca 0.00 0.48 0.03 0.00 0.00 0.00 0.00 51.96 52.47 1mk5 s ALA 38 Cb 0.00 -3.16 -0.00 0.00 0.00 0.00 0.00 23.12 19.96 1mk5 s ALA 38 CO 0.00 0.17 -0.21 -0.51 0.00 0.00 0.00 175.76 175.21 1mk5 s LEU 39 N -2.33 2.24 -0.04 0.00 1.43 -0.24 -0.25 118.68 119.49 1mk5 s LEU 39 Ca 0.53 -0.52 -0.02 0.00 -1.03 0.00 0.00 54.13 53.09 1mk5 s LEU 39 Cb -0.16 -1.46 0.02 0.00 0.03 0.00 0.00 46.19 44.62 1mk5 s LEU 39 CO 0.21 0.14 0.09 -0.89 0.23 0.00 0.00 176.35 176.13 1mk5 s THR 40 N 0.46 -0.03 -1.02 5.49 2.01 -0.70 -0.69 115.64 121.17 1mk5 s THR 40 Ca -0.14 0.11 0.00 0.00 0.31 0.00 0.00 61.69 61.97 1mk5 s THR 40 Cb -0.17 -0.15 0.00 0.00 0.01 0.00 0.00 72.50 72.19 1mk5 s THR 40 CO 0.06 0.05 0.00 0.61 -0.69 0.00 0.00 174.62 174.64 1mk5 n GLY 41 N 3.71 -0.66 3.19 4.40 0.00 -0.95 -0.69 105.19 114.19 1mk5 n GLY 41 Ca -0.21 -0.51 -0.14 0.00 0.00 0.00 0.00 46.02 45.16 1mk5 n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1mk5 s THR 42 N -3.54 0.97 -0.03 2.61 -4.23 0.22 -1.23 115.64 110.41 1mk5 s THR 42 Ca 0.00 -1.71 0.02 0.00 -1.18 0.00 0.00 61.69 58.82 1mk5 s THR 42 Cb 0.00 -1.44 0.01 0.00 1.34 0.00 0.00 72.50 72.41 1mk5 s THR 42 CO 0.00 -0.59 -0.07 -0.47 -0.54 0.00 0.00 174.62 172.95 1mk5 s TYR 43 N -2.60 0.83 -0.21 3.99 6.14 0.49 -1.17 117.35 124.81 1mk5 s TYR 43 Ca 0.07 -0.22 0.01 0.00 0.64 0.00 0.00 57.07 57.58 1mk5 s TYR 43 Cb -0.02 -0.64 0.05 0.00 0.42 0.00 0.00 41.96 41.77 1mk5 s TYR 43 CO -0.00 -0.13 -0.10 -2.00 0.64 0.00 0.00 175.55 173.96 1mk5 s GLU 44 N 0.43 2.04 0.02 4.97 2.12 -0.06 -0.39 118.70 127.82 1mk5 s GLU 44 Ca -0.06 -0.94 -0.18 0.00 0.36 0.00 0.00 54.97 54.14 1mk5 s GLU 44 Cb -0.10 -2.52 -0.06 0.00 0.26 0.00 0.00 34.13 31.71 1mk5 s GLU 44 CO 0.00 -0.47 0.52 0.45 -0.54 0.00 0.00 175.26 175.23 1mk5 s SER 45 N 1.35 6.93 0.11 -1.70 0.15 -1.26 -0.64 113.70 118.64 1mk5 s SER 45 Ca -0.03 1.11 0.26 0.00 0.70 0.00 0.00 55.95 58.00 1mk5 s SER 45 Cb -0.17 -2.32 0.99 0.00 -1.71 0.00 0.00 66.02 62.81 1mk5 s SER 45 CO -0.08 0.22 1.82 0.00 1.20 0.00 0.00 173.24 176.40 1mk5 n ALA 46 N 2.19 2.22 -2.27 5.45 0.00 -1.26 -4.80 120.51 122.04 1mk5 n ALA 46 Ca -0.10 -0.05 -0.15 0.00 0.00 0.00 0.00 53.44 53.14 1mk5 n ALA 46 Cb 0.51 -1.45 -0.10 0.00 0.00 0.00 0.00 19.45 18.41 1mk5 n ALA 46 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1mk5 s VAL 47 N -3.07 0.96 0.00 0.00 -7.23 -1.26 -5.02 120.40 104.79 1mk5 s VAL 47 Ca 0.11 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.26 1mk5 s VAL 47 Cb 0.15 -2.08 0.00 0.00 0.56 0.00 0.00 36.38 35.00 1mk5 s VAL 47 CO 0.53 -0.53 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 1mk5 n GLY 48 N -0.28 -2.00 3.31 2.32 0.00 -1.26 -4.53 105.19 102.76 1mk5 n GLY 48 Ca -0.08 -1.68 -0.43 0.00 0.00 0.00 0.00 46.02 43.84 1mk5 n GLY 48 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1mk5 n ASN 49 N 0.56 4.92 -3.66 1.61 5.15 -1.26 -4.85 115.26 117.73 1mk5 n ASN 49 Ca 0.00 -2.96 -0.14 0.00 -0.60 0.00 0.00 54.58 50.88 1mk5 n ASN 49 Cb 0.00 -1.63 -0.08 0.00 -0.53 0.00 0.00 39.78 37.54 1mk5 n ASN 49 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1mk5 s ALA 50 N 2.50 -1.51 -0.07 5.20 0.00 -1.26 -4.56 121.76 122.06 1mk5 s ALA 50 Ca 0.47 1.65 -0.10 0.00 0.00 0.00 0.00 51.96 53.98 1mk5 s ALA 50 Cb 0.04 -0.89 0.02 0.00 0.00 0.00 0.00 23.12 22.29 1mk5 s ALA 50 CO 0.02 -0.29 0.25 -1.83 0.00 0.00 0.00 175.76 173.91 1mk5 s GLU 51 N 0.15 0.40 2.80 0.00 -1.05 -1.26 -4.93 118.70 114.81 1mk5 s GLU 51 Ca -0.01 0.16 0.00 0.00 -0.15 0.00 0.00 54.97 54.97 1mk5 s GLU 51 Cb -0.04 0.18 0.00 0.00 -0.44 0.00 0.00 34.13 33.83 1mk5 s GLU 51 CO 0.02 -0.07 0.00 0.45 0.95 0.00 0.00 175.26 176.60 1mk5 n SER 52 N 2.44 -2.72 -4.87 0.83 2.88 -1.26 -4.83 113.62 106.08 1mk5 n SER 52 Ca -0.16 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.05 1mk5 n SER 52 Cb 0.57 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.98 1mk5 n SER 52 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1mk5 s ARG 53 N 0.00 3.77 0.05 -1.46 0.52 -1.26 -4.40 118.95 116.17 1mk5 s ARG 53 Ca 0.00 0.18 0.08 0.00 -0.52 0.00 0.00 55.73 55.47 1mk5 s ARG 53 Cb 0.00 -2.89 -0.03 0.00 0.52 0.00 0.00 34.95 32.55 1mk5 s ARG 53 CO 0.00 0.48 -0.23 0.71 0.02 0.00 0.00 175.30 176.29 1mk5 s TYR 54 N -1.54 1.97 0.33 -0.53 1.51 0.47 -4.88 117.35 114.68 1mk5 s TYR 54 Ca 0.38 -0.39 -0.29 0.00 -1.01 0.00 0.00 57.07 55.76 1mk5 s TYR 54 Cb -0.13 -1.16 -0.10 0.00 -0.11 0.00 0.00 41.96 40.45 1mk5 s TYR 54 CO 0.20 0.12 1.32 0.08 -1.11 0.00 0.00 175.55 176.16 1mk5 s VAL 55 N -0.85 2.70 0.12 0.71 1.01 -1.26 -0.38 120.40 122.45 1mk5 s VAL 55 Ca 0.09 0.70 0.05 0.00 0.00 0.00 0.00 61.98 62.82 1mk5 s VAL 55 Cb -0.09 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 1mk5 s VAL 55 CO 0.02 0.16 -0.13 -1.48 0.00 0.00 0.00 175.10 173.68 1mk5 s LEU 56 N -1.68 2.41 0.03 3.92 0.05 -0.36 -4.32 118.68 118.72 1mk5 s LEU 56 Ca 0.50 -0.82 -0.08 0.00 0.05 0.00 0.00 54.13 53.78 1mk5 s LEU 56 Cb -0.40 -0.49 0.00 0.00 -2.05 0.00 0.00 46.19 43.25 1mk5 s LEU 56 CO 0.52 -0.17 0.16 0.28 -0.55 0.00 0.00 176.35 176.59 1mk5 s THR 57 N -2.23 0.10 0.00 5.48 -1.32 -1.04 -2.24 115.64 114.39 1mk5 s THR 57 Ca 0.08 -0.86 0.00 0.00 -1.21 0.00 0.00 61.69 59.70 1mk5 s THR 57 Cb -0.04 -0.76 0.00 0.00 -1.51 0.00 0.00 72.50 70.19 1mk5 s THR 57 CO 0.02 -0.47 0.00 0.61 -2.21 0.00 0.00 174.62 172.57 1mk5 n GLY 58 N 0.95 1.97 3.09 6.08 0.00 0.14 -0.94 105.19 116.47 1mk5 n GLY 58 Ca -0.20 -0.83 -0.09 0.00 0.00 0.00 0.00 46.02 44.89 1mk5 n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1mk5 s ARG 59 N -0.50 0.53 0.09 1.61 1.81 -0.47 -1.08 118.95 120.95 1mk5 s ARG 59 Ca 0.00 -0.75 -0.06 0.00 -1.72 0.00 0.00 55.73 53.20 1mk5 s ARG 59 Cb 0.00 0.20 -0.02 0.00 -0.45 0.00 0.00 34.95 34.68 1mk5 s ARG 59 CO 0.00 -0.12 0.12 1.52 -0.68 0.00 0.00 175.30 176.14 1mk5 s TYR 60 N -2.45 0.36 -0.46 -0.53 1.13 -0.18 -1.00 117.35 114.23 1mk5 s TYR 60 Ca -0.06 -0.82 -0.28 0.00 -1.41 0.00 0.00 57.07 54.49 1mk5 s TYR 60 Cb -0.02 -0.20 0.00 0.00 -1.10 0.00 0.00 41.96 40.64 1mk5 s TYR 60 CO -0.04 -0.51 1.54 0.34 -2.51 0.00 0.00 175.55 174.37 1mk5 s ASP 61 N -2.91 6.07 0.00 -0.18 2.15 -0.25 -4.46 116.67 117.08 1mk5 s ASP 61 Ca 0.09 0.73 0.15 0.00 0.43 0.00 0.00 52.55 53.95 1mk5 s ASP 61 Cb 0.06 -2.54 0.67 0.00 -0.30 0.00 0.00 42.92 40.81 1mk5 s ASP 61 CO -0.08 -1.67 1.47 -1.54 -0.17 0.00 0.00 175.17 173.18 1mk5 n SER 62 N 9.76 1.00 -3.06 -0.34 3.41 -1.26 -3.92 113.62 119.22 1mk5 n SER 62 Ca 0.17 -1.72 -0.18 0.00 -0.26 0.00 0.00 58.87 56.88 1mk5 n SER 62 Cb 0.48 -0.08 -0.02 0.00 -0.26 0.00 0.00 64.21 64.33 1mk5 n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mk5 n ALA 63 N -0.07 1.23 -0.85 7.33 0.00 -1.26 -4.97 120.51 121.92 1mk5 n ALA 63 Ca 0.12 -2.80 -0.30 0.00 0.00 0.00 0.00 53.44 50.47 1mk5 n ALA 63 Cb 0.20 -0.98 0.19 0.00 0.00 0.00 0.00 19.45 18.86 1mk5 n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1mk5 s PRO 64 N -0.92 0.42 0.75 0.00 0.04 -1.25 -4.97 135.00 129.08 1mk5 s PRO 64 Ca 0.34 1.00 -0.13 0.00 0.04 0.00 0.00 61.00 62.25 1mk5 s PRO 64 Cb 0.23 -1.70 0.05 0.00 0.04 0.00 0.00 34.50 33.13 1mk5 s PRO 64 CO -0.13 -2.87 1.14 0.00 0.04 0.00 0.00 177.00 175.19 1mk5 s ALA 65 N -2.70 2.13 -0.32 8.56 0.00 -1.26 -4.94 121.76 123.23 1mk5 s ALA 65 Ca 0.66 0.58 0.08 0.00 0.00 0.00 0.00 51.96 53.27 1mk5 s ALA 65 Cb -0.22 -3.37 0.51 0.00 0.00 0.00 0.00 23.12 20.04 1mk5 s ALA 65 CO 0.60 -1.84 1.49 0.25 0.00 0.00 0.00 175.76 176.26 1mk5 n THR 66 N -3.11 2.64 -0.92 0.00 -2.24 -1.26 -4.46 114.28 104.93 1mk5 n THR 66 Ca 0.11 -2.88 0.08 0.00 -2.27 0.00 0.00 64.05 59.10 1mk5 n THR 66 Cb 0.52 -0.44 0.31 0.00 -2.10 0.00 0.00 70.33 68.62 1mk5 n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1mk5 n ASP 67 N -1.09 4.50 0.00 3.42 5.75 -1.26 -4.92 116.55 122.96 1mk5 n ASP 67 Ca 0.37 -2.93 0.00 0.00 -0.01 0.00 0.00 54.79 52.22 1mk5 n ASP 67 Cb 1.04 -0.58 0.00 0.00 -1.03 0.00 0.00 41.12 40.55 1mk5 n ASP 67 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1mk5 n GLY 68 N -0.04 0.23 3.81 6.12 0.00 -1.26 -5.05 105.19 108.99 1mk5 n GLY 68 Ca 0.23 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.93 1mk5 n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mk5 s SER 69 N -2.38 6.03 1.16 1.61 0.01 -1.26 -5.04 113.70 113.83 1mk5 s SER 69 Ca 0.00 1.78 -0.20 0.00 1.31 0.00 0.00 55.95 58.85 1mk5 s SER 69 Cb 0.00 -2.53 0.28 0.00 0.21 0.00 0.00 66.02 63.98 1mk5 s SER 69 CO 0.00 -0.99 1.20 -0.83 0.41 0.00 0.00 173.24 173.02 1mk5 s GLY 70 N -2.73 1.67 -0.34 3.44 0.00 -1.26 -4.78 107.32 103.32 1mk5 s GLY 70 Ca 0.63 -1.17 -0.09 0.00 0.00 0.00 0.00 44.72 44.09 1mk5 s GLY 70 CO 0.33 -0.26 0.15 -1.59 0.00 0.00 0.00 173.10 171.73 1mk5 s THR 71 N -3.34 4.33 0.47 0.90 2.01 0.39 -4.74 115.64 115.67 1mk5 s THR 71 Ca 0.74 -0.76 -0.23 0.00 0.31 0.00 0.00 61.69 61.75 1mk5 s THR 71 Cb -0.06 -3.33 -0.07 0.00 0.01 0.00 0.00 72.50 69.05 1mk5 s THR 71 CO 0.55 -0.09 1.24 0.00 -0.69 0.00 0.00 174.62 175.63 1mk5 s ALA 72 N 1.53 2.98 0.29 7.40 0.00 -1.26 -0.65 121.76 132.06 1mk5 s ALA 72 Ca 0.02 1.09 -0.19 0.00 0.00 0.00 0.00 51.96 52.89 1mk5 s ALA 72 Cb -0.18 -3.45 0.02 0.00 0.00 0.00 0.00 23.12 19.51 1mk5 s ALA 72 CO 0.05 -0.87 0.69 -0.48 0.00 0.00 0.00 175.76 175.15 1mk5 s LEU 73 N -3.04 -0.12 0.03 0.00 0.05 -0.42 -1.10 118.68 114.08 1mk5 s LEU 73 Ca 0.64 -0.75 -0.27 0.00 0.05 0.00 0.00 54.13 53.80 1mk5 s LEU 73 Cb -0.33 2.60 0.09 0.00 -2.05 0.00 0.00 46.19 46.50 1mk5 s LEU 73 CO 0.41 -1.37 0.78 -0.83 -0.55 0.00 0.00 176.35 174.78 1mk5 s GLY 74 N -2.96 -0.51 0.21 -3.48 0.00 -0.17 -1.12 107.32 99.29 1mk5 s GLY 74 Ca 0.13 0.94 -0.14 0.00 0.00 0.00 0.00 44.72 45.65 1mk5 s GLY 74 CO 0.08 0.39 0.47 0.66 0.00 0.00 0.00 173.10 174.70 1mk5 s TRP 75 N -3.01 0.13 0.01 1.90 -2.14 -0.25 -1.36 118.94 114.22 1mk5 s TRP 75 Ca 0.02 -0.49 0.05 0.00 2.66 0.00 0.00 56.10 58.34 1mk5 s TRP 75 Cb -0.01 0.25 -0.02 0.00 -3.10 0.00 0.00 33.47 30.60 1mk5 s TRP 75 CO -0.08 -0.91 -0.15 0.99 -2.66 0.00 0.00 176.95 174.13 1mk5 s THR 76 N -3.94 1.22 -0.12 0.66 2.01 -0.12 -0.75 115.64 114.61 1mk5 s THR 76 Ca 0.15 -0.82 0.02 0.00 0.31 0.00 0.00 61.69 61.35 1mk5 s THR 76 Cb -0.00 -1.05 0.01 0.00 0.01 0.00 0.00 72.50 71.47 1mk5 s THR 76 CO 0.02 0.22 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.29 1mk5 s VAL 77 N -0.56 1.77 -0.15 3.82 1.01 -0.16 -2.50 120.40 123.63 1mk5 s VAL 77 Ca 0.05 -0.81 -0.16 0.00 0.00 0.00 0.00 61.98 61.06 1mk5 s VAL 77 Cb -0.07 -1.58 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 1mk5 s VAL 77 CO 0.00 0.49 0.37 0.00 0.00 0.00 0.00 175.10 175.97 1mk5 s ALA 78 N 0.84 3.54 -0.94 5.51 0.00 -1.26 -0.49 121.76 128.96 1mk5 s ALA 78 Ca -0.08 -0.35 -0.06 0.00 0.00 0.00 0.00 51.96 51.46 1mk5 s ALA 78 Cb -0.15 -2.51 0.01 0.00 0.00 0.00 0.00 23.12 20.47 1mk5 s ALA 78 CO -0.00 0.03 2.77 0.91 0.00 0.00 0.00 175.76 179.47 1mk5 n TRP 79 N 3.68 1.91 -4.75 0.00 7.02 0.08 -4.76 117.44 120.62 1mk5 n TRP 79 Ca -0.10 -2.43 -0.27 0.00 -1.02 0.00 0.00 57.50 53.68 1mk5 n TRP 79 Cb 0.52 -1.78 -0.17 0.00 -2.42 0.00 0.00 31.31 27.46 1mk5 n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1mk5 s LYS 80 N -0.45 2.17 0.00 -0.99 2.20 -1.26 -1.19 119.74 120.21 1mk5 s LYS 80 Ca 0.60 -0.57 0.00 0.00 -0.36 0.00 0.00 55.97 55.64 1mk5 s LYS 80 Cb 0.26 -1.74 0.00 0.00 -1.51 0.00 0.00 37.83 34.84 1mk5 s LYS 80 CO -0.11 0.06 0.00 0.27 -0.36 0.00 0.00 175.35 175.20 1mk5 n ASN 81 N 3.79 0.00 0.07 1.43 0.23 -0.31 -4.76 115.26 115.71 1mk5 n ASN 81 Ca -0.21 -0.54 0.10 0.00 -0.53 0.00 0.00 54.58 53.40 1mk5 n ASN 81 Cb 0.52 0.00 0.43 0.00 -2.08 0.00 0.00 39.78 38.65 1mk5 n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1mk5 n ASN 82 N -1.29 0.38 -0.08 0.53 3.02 -1.26 -3.57 115.26 112.99 1mk5 n ASN 82 Ca 0.00 0.58 -0.09 0.00 -0.03 0.00 0.00 54.58 55.04 1mk5 n ASN 82 Cb 0.00 -0.67 -0.12 0.00 -0.61 0.00 0.00 39.78 38.39 1mk5 n ASN 82 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1mk5 n TYR 83 N -1.91 0.00 -3.59 3.10 4.01 -1.26 -5.06 117.16 112.44 1mk5 n TYR 83 Ca 0.03 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.64 1mk5 n TYR 83 Cb 0.24 -0.78 -0.06 0.00 -0.31 0.00 0.00 39.34 38.43 1mk5 n TYR 83 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1mk5 s ARG 84 N -2.39 1.00 -0.14 -0.72 0.52 -1.23 -5.06 118.95 110.93 1mk5 s ARG 84 Ca -0.13 -0.24 -0.03 0.00 -0.52 0.00 0.00 55.73 54.82 1mk5 s ARG 84 Cb 0.05 0.46 0.05 0.00 0.52 0.00 0.00 34.95 36.03 1mk5 s ARG 84 CO 0.60 -0.35 0.04 1.21 0.02 0.00 0.00 175.30 176.81 1mk5 s ASN 85 N -1.92 2.22 0.00 0.23 3.84 -1.26 -1.17 114.94 116.88 1mk5 s ASN 85 Ca -0.06 -0.47 0.26 0.00 0.21 0.00 0.00 52.86 52.81 1mk5 s ASN 85 Cb -0.01 -0.44 0.76 0.00 -0.55 0.00 0.00 41.25 41.02 1mk5 s ASN 85 CO -0.01 -0.27 1.57 0.00 -2.79 0.00 0.00 177.10 175.60 1mk5 n ALA 86 N 5.15 3.05 -3.61 1.71 0.00 -0.33 -4.96 120.51 121.51 1mk5 n ALA 86 Ca -0.07 -0.41 -0.26 0.00 0.00 0.00 0.00 53.44 52.70 1mk5 n ALA 86 Cb 0.49 -1.13 0.04 0.00 0.00 0.00 0.00 19.45 18.85 1mk5 n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1mk5 n HIS 87 N -0.57 -2.00 -3.58 0.00 8.25 -1.26 -4.85 115.22 111.20 1mk5 n HIS 87 Ca 0.13 0.63 -0.10 0.00 -0.26 0.00 0.00 57.72 58.11 1mk5 n HIS 87 Cb 0.35 -3.79 -0.02 0.00 1.12 0.00 0.00 29.99 27.65 1mk5 n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1mk5 s SER 88 N -3.69 -0.45 -0.13 0.41 1.04 -1.26 -1.06 113.70 108.56 1mk5 s SER 88 Ca 0.35 -0.22 -0.13 0.00 0.48 0.00 0.00 55.95 56.43 1mk5 s SER 88 Cb -0.10 0.64 0.03 0.00 0.10 0.00 0.00 66.02 66.69 1mk5 s SER 88 CO 0.83 -1.10 0.36 0.00 0.98 0.00 0.00 173.24 174.31 1mk5 s ALA 89 N -3.80 -0.89 -0.05 5.32 0.00 -0.17 -0.74 121.76 121.43 1mk5 s ALA 89 Ca 0.05 0.99 0.04 0.00 0.00 0.00 0.00 51.96 53.04 1mk5 s ALA 89 Cb -0.03 -0.56 -0.02 0.00 0.00 0.00 0.00 23.12 22.50 1mk5 s ALA 89 CO -0.06 -0.17 -0.17 0.99 0.00 0.00 0.00 175.76 176.35 1mk5 s THR 90 N 0.13 2.84 -0.05 0.00 2.01 0.35 -0.65 115.64 120.27 1mk5 s THR 90 Ca -0.01 -0.80 0.04 0.00 0.31 0.00 0.00 61.69 61.23 1mk5 s THR 90 Cb -0.03 -2.09 -0.02 0.00 0.01 0.00 0.00 72.50 70.37 1mk5 s THR 90 CO 0.01 0.59 -0.17 0.42 -0.69 0.00 0.00 174.62 174.77 1mk5 s THR 91 N -0.65 2.77 -0.13 -0.82 -4.23 -0.15 -0.99 115.64 111.44 1mk5 s THR 91 Ca 0.10 -0.83 -0.01 0.00 -1.18 0.00 0.00 61.69 59.77 1mk5 s THR 91 Cb -0.11 -2.07 -0.02 0.00 1.34 0.00 0.00 72.50 71.65 1mk5 s THR 91 CO 0.00 0.58 -0.10 0.26 -0.54 0.00 0.00 174.62 174.83 1mk5 s TRP 92 N -0.55 2.88 -0.10 3.99 0.51 0.07 -1.02 118.94 124.72 1mk5 s TRP 92 Ca 0.08 -0.47 0.03 0.00 -2.12 0.00 0.00 56.10 53.62 1mk5 s TRP 92 Cb -0.11 -1.86 0.01 0.00 -0.81 0.00 0.00 33.47 30.69 1mk5 s TRP 92 CO 0.01 -0.10 -0.19 0.45 -0.51 0.00 0.00 176.95 176.61 1mk5 s SER 93 N 0.23 2.62 0.00 2.95 0.15 0.44 -1.09 113.70 119.00 1mk5 s SER 93 Ca -0.06 -0.47 0.00 0.00 0.70 0.00 0.00 55.95 56.12 1mk5 s SER 93 Cb -0.15 -1.20 0.00 0.00 -1.71 0.00 0.00 66.02 62.96 1mk5 s SER 93 CO 0.04 0.09 0.00 0.61 1.20 0.00 0.00 173.24 175.19 1mk5 n GLY 94 N 3.77 1.71 3.19 9.45 0.00 -0.27 -0.84 105.19 122.20 1mk5 n GLY 94 Ca -0.20 -0.46 -0.13 0.00 0.00 0.00 0.00 46.02 45.23 1mk5 n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1mk5 s GLN 95 N 1.59 0.52 0.03 1.61 -2.07 -0.53 -1.30 119.66 119.52 1mk5 s GLN 95 Ca 0.00 -0.02 -0.22 0.00 -1.82 0.00 0.00 55.36 53.30 1mk5 s GLN 95 Cb 0.00 0.23 -0.06 0.00 -1.09 0.00 0.00 33.01 32.10 1mk5 s GLN 95 CO 0.00 -0.12 0.65 -0.47 -1.32 0.00 0.00 175.29 174.03 1mk5 s TYR 96 N -0.83 3.73 -0.24 9.60 5.04 0.17 -1.24 117.35 133.59 1mk5 s TYR 96 Ca -0.09 1.31 0.01 0.00 -2.44 0.00 0.00 57.07 55.86 1mk5 s TYR 96 Cb -0.05 -2.66 0.06 0.00 0.35 0.00 0.00 41.96 39.66 1mk5 s TYR 96 CO 0.02 0.37 -0.07 0.08 -1.34 0.00 0.00 175.55 174.62 1mk5 s VAL 97 N -0.34 1.66 0.00 3.14 1.01 0.71 -0.46 120.40 126.11 1mk5 s VAL 97 Ca 0.33 -1.28 0.00 0.00 0.00 0.00 0.00 61.98 61.03 1mk5 s VAL 97 Cb -0.19 -1.88 0.00 0.00 0.00 0.00 0.00 36.38 34.31 1mk5 s VAL 97 CO 0.20 -0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.84 1mk5 n GLY 98 N 4.63 -0.45 0.00 4.51 0.00 -1.26 -0.96 105.19 111.66 1mk5 n GLY 98 Ca -0.13 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.15 1mk5 n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mk5 n GLY 99 N 5.00 -0.37 0.19 -0.02 0.00 -1.26 -4.66 105.19 104.07 1mk5 n GLY 99 Ca 0.00 -2.22 0.05 0.00 0.00 0.00 0.00 46.02 43.86 1mk5 n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mk5 h ALA 100 N 0.00 1.06 -2.29 4.61 0.00 -2.06 -3.22 119.26 117.36 1mk5 h ALA 100 Ca 0.00 -0.33 -0.59 0.00 0.00 0.00 0.00 54.91 53.98 1mk5 h ALA 100 Cb 0.00 -0.06 -0.41 0.00 0.00 0.00 0.00 17.79 17.32 1mk5 h ALA 100 CO 0.00 0.46 -0.70 -1.91 0.00 0.00 0.00 179.25 177.09 1mk5 n GLU 101 N -3.62 1.98 -1.71 0.00 0.00 -1.26 -5.10 120.64 110.94 1mk5 n GLU 101 Ca -0.01 -4.31 -0.39 0.00 0.00 0.00 0.00 57.16 52.45 1mk5 n GLU 101 Cb 0.48 -2.04 0.03 0.00 0.00 0.00 0.00 31.44 29.91 1mk5 n GLU 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1mk5 n ALA 102 N 1.20 1.22 -3.01 4.31 0.00 -1.22 -4.93 120.51 118.09 1mk5 n ALA 102 Ca 0.27 0.15 -0.11 0.00 0.00 0.00 0.00 53.44 53.75 1mk5 n ALA 102 Cb 0.43 -2.28 -0.11 0.00 0.00 0.00 0.00 19.45 17.48 1mk5 n ALA 102 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1mk5 s ARG 103 N -2.64 0.30 -0.22 0.00 3.52 -0.13 -4.35 118.95 115.42 1mk5 s ARG 103 Ca 0.69 -0.35 -0.01 0.00 -0.13 0.00 0.00 55.73 55.93 1mk5 s ARG 103 Cb -0.45 0.12 0.02 0.00 -1.56 0.00 0.00 34.95 33.08 1mk5 s ARG 103 CO 0.52 -0.06 -0.11 0.42 -0.81 0.00 0.00 175.30 175.26 1mk5 s ILE 104 N -1.02 2.63 -0.22 4.11 1.01 -0.39 -0.21 121.20 127.11 1mk5 s ILE 104 Ca -0.11 -0.97 -0.07 0.00 0.00 0.00 0.00 60.65 59.49 1mk5 s ILE 104 Cb -0.07 -2.26 -0.04 0.00 0.01 0.00 0.00 42.46 40.11 1mk5 s ILE 104 CO 0.00 0.32 0.07 0.20 0.00 0.00 0.00 174.94 175.53 1mk5 s ASN 105 N 1.32 5.40 0.13 3.58 0.01 -0.37 -0.45 114.94 124.55 1mk5 s ASN 105 Ca 0.02 -0.06 0.04 0.00 -0.71 0.00 0.00 52.86 52.14 1mk5 s ASN 105 Cb -0.15 -1.95 -0.04 0.00 0.41 0.00 0.00 41.25 39.52 1mk5 s ASN 105 CO -0.07 0.07 -0.09 0.42 -1.51 0.00 0.00 177.10 175.91 1mk5 s THR 106 N 1.01 1.02 0.12 1.60 -4.23 0.18 -1.45 115.64 113.89 1mk5 s THR 106 Ca 0.04 -1.98 0.10 0.00 -1.18 0.00 0.00 61.69 58.68 1mk5 s THR 106 Cb -0.14 -1.75 -0.04 0.00 1.34 0.00 0.00 72.50 71.92 1mk5 s THR 106 CO 0.03 -0.75 -0.26 -1.10 -0.54 0.00 0.00 174.62 172.00 1mk5 s GLN 107 N -3.65 1.40 0.08 3.99 -0.21 -0.02 -2.25 119.66 119.00 1mk5 s GLN 107 Ca 0.14 -1.29 0.02 0.00 0.02 0.00 0.00 55.36 54.25 1mk5 s GLN 107 Cb 0.03 -1.83 -0.04 0.00 1.00 0.00 0.00 33.01 32.17 1mk5 s GLN 107 CO -0.01 0.44 -0.07 1.67 -2.12 0.00 0.00 175.29 175.19 1mk5 s TRP 108 N -1.04 0.85 -0.13 0.91 1.48 0.34 -0.42 118.94 120.92 1mk5 s TRP 108 Ca 0.13 -0.75 0.00 0.00 -1.06 0.00 0.00 56.10 54.42 1mk5 s TRP 108 Cb -0.10 -0.49 0.02 0.00 -1.16 0.00 0.00 33.47 31.74 1mk5 s TRP 108 CO 0.05 -0.11 -0.12 -0.51 -4.06 0.00 0.00 176.95 172.20 1mk5 s LEU 109 N -2.52 1.54 -0.34 -4.66 1.43 -0.19 -1.82 118.68 112.12 1mk5 s LEU 109 Ca 0.04 -0.42 -0.03 0.00 -1.03 0.00 0.00 54.13 52.69 1mk5 s LEU 109 Cb -0.00 -1.07 0.07 0.00 0.03 0.00 0.00 46.19 45.22 1mk5 s LEU 109 CO -0.03 -0.07 0.09 -0.22 0.23 0.00 0.00 176.35 176.36 1mk5 s LEU 110 N 1.50 4.44 -0.23 1.79 2.96 0.33 -0.98 118.68 128.49 1mk5 s LEU 110 Ca 0.04 -1.51 -0.10 0.00 -0.22 0.00 0.00 54.13 52.34 1mk5 s LEU 110 Cb -0.13 -1.78 -0.05 0.00 0.50 0.00 0.00 46.19 44.73 1mk5 s LEU 110 CO -0.09 -0.37 0.14 -0.89 -1.32 0.00 0.00 176.35 173.82 1mk5 s THR 111 N 1.24 5.28 0.01 3.68 2.01 0.17 -0.60 115.64 127.42 1mk5 s THR 111 Ca 0.00 0.15 -0.08 0.00 0.31 0.00 0.00 61.69 62.07 1mk5 s THR 111 Cb -0.21 -3.44 -0.05 0.00 0.01 0.00 0.00 72.50 68.81 1mk5 s THR 111 CO -0.01 0.38 0.29 -0.44 -0.69 0.00 0.00 174.62 174.14 1mk5 s SER 112 N 0.87 6.54 0.20 3.53 0.01 0.07 -1.00 113.70 123.92 1mk5 s SER 112 Ca 0.07 0.63 -0.31 0.00 1.31 0.00 0.00 55.95 57.65 1mk5 s SER 112 Cb -0.13 -2.12 -0.10 0.00 0.21 0.00 0.00 66.02 63.88 1mk5 s SER 112 CO 0.03 0.26 1.56 -0.83 0.41 0.00 0.00 173.24 174.67 1mk5 s GLY 113 N -1.58 1.75 0.16 3.44 0.00 -0.22 -4.82 107.32 106.05 1mk5 s GLY 113 Ca 0.27 1.41 -0.01 0.00 0.00 0.00 0.00 44.72 46.39 1mk5 s GLY 113 CO 0.15 2.57 0.07 -0.51 0.00 0.00 0.00 173.10 175.38 1mk5 s THR 114 N 0.77 0.15 0.81 0.90 -4.23 -1.26 -5.01 115.64 107.77 1mk5 s THR 114 Ca 0.67 -1.95 -0.11 0.00 -1.18 0.00 0.00 61.69 59.13 1mk5 s THR 114 Cb -0.44 -2.20 0.08 0.00 1.34 0.00 0.00 72.50 71.27 1mk5 s THR 114 CO 0.36 -0.32 1.10 0.42 -0.54 0.00 0.00 174.62 175.64 1mk5 s THR 115 N -4.03 3.10 0.37 3.99 -4.23 -1.26 -4.87 115.64 108.71 1mk5 s THR 115 Ca 0.29 0.36 0.10 0.00 -1.18 0.00 0.00 61.69 61.26 1mk5 s THR 115 Cb 0.07 -2.79 0.33 0.00 1.34 0.00 0.00 72.50 71.45 1mk5 s THR 115 CO 0.05 -0.47 1.89 -0.08 -0.54 0.00 0.00 174.62 175.48 1mk5 h GLU 116 N -1.28 0.61 0.00 3.99 4.81 -2.01 -1.59 114.58 119.12 1mk5 h GLU 116 Ca -0.44 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 58.69 1mk5 h GLU 116 Cb 1.24 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.48 1mk5 h GLU 116 CO 0.51 0.41 -0.25 0.00 -0.73 0.00 0.00 179.01 178.94 1mk5 h ALA 117 N 1.61 0.93 -0.64 2.92 0.00 -2.06 -2.23 119.26 119.79 1mk5 h ALA 117 Ca 0.42 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1mk5 h ALA 117 Cb 0.72 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1mk5 h ALA 117 CO -0.18 0.32 0.00 0.09 0.00 0.00 0.00 179.25 179.48 1mk5 n ASN 118 N -3.30 3.83 0.25 0.00 3.02 -0.66 -4.34 115.26 114.06 1mk5 n ASN 118 Ca 0.01 -2.00 0.11 0.00 -0.03 0.00 0.00 54.58 52.67 1mk5 n ASN 118 Cb 0.51 -0.42 0.73 0.00 -0.61 0.00 0.00 39.78 39.98 1mk5 n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1mk5 h ALA 119 N 4.38 1.91 -0.07 5.41 0.00 -0.74 -1.35 119.26 128.79 1mk5 h ALA 119 Ca 0.00 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.93 1mk5 h ALA 119 Cb 0.99 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 1mk5 h ALA 119 CO 0.00 -0.07 0.08 0.11 0.00 0.00 0.00 179.25 179.37 1mk5 h TRP 120 N 0.00 0.00 -0.29 0.00 5.08 -1.80 -1.70 115.95 117.24 1mk5 h TRP 120 Ca 0.02 0.00 -0.14 0.00 1.08 0.00 0.00 58.89 59.86 1mk5 h TRP 120 Cb 0.11 0.00 -0.08 0.00 -3.00 0.00 0.00 29.16 26.19 1mk5 h TRP 120 CO 0.00 0.00 -0.13 0.36 -1.28 0.00 0.00 178.44 177.39 1mk5 n LYS 121 N -3.85 1.87 0.16 0.12 2.85 -0.52 -4.67 118.16 114.13 1mk5 n LYS 121 Ca -0.01 -3.16 0.08 0.00 -1.05 0.00 0.00 58.31 54.17 1mk5 n LYS 121 Cb 0.18 -1.78 0.08 0.00 -0.65 0.00 0.00 35.03 32.86 1mk5 n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1mk5 h SER 122 N 1.03 0.00 -3.24 -5.58 4.64 -1.26 -3.46 113.55 105.67 1mk5 h SER 122 Ca 0.17 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.91 1mk5 h SER 122 Cb 1.53 0.00 -0.37 0.00 -0.31 0.00 0.00 62.40 63.26 1mk5 h SER 122 CO 0.31 0.20 -0.81 -0.89 -0.87 0.00 0.00 176.83 174.77 1mk5 s THR 123 N -3.13 1.39 0.25 2.95 2.01 -1.26 -0.76 115.64 117.10 1mk5 s THR 123 Ca 0.04 -0.65 -0.11 0.00 0.31 0.00 0.00 61.69 61.28 1mk5 s THR 123 Cb 0.07 -1.41 -0.08 0.00 0.01 0.00 0.00 72.50 71.09 1mk5 s THR 123 CO 0.72 0.31 0.59 -0.76 -0.69 0.00 0.00 174.62 174.79 1mk5 s LEU 124 N 1.54 4.14 0.02 4.42 1.43 0.23 -4.90 118.68 125.56 1mk5 s LEU 124 Ca 0.03 0.99 0.05 0.00 -1.03 0.00 0.00 54.13 54.17 1mk5 s LEU 124 Cb -0.14 -3.77 -0.02 0.00 0.03 0.00 0.00 46.19 42.30 1mk5 s LEU 124 CO -0.09 -0.10 -0.14 0.54 0.23 0.00 0.00 176.35 176.79 1mk5 s VAL 125 N -1.86 1.09 0.00 -1.59 0.11 -1.26 -0.51 120.40 116.38 1mk5 s VAL 125 Ca 0.49 -0.83 0.00 0.00 -2.93 0.00 0.00 61.98 58.71 1mk5 s VAL 125 Cb -0.11 -0.96 0.00 0.00 -1.53 0.00 0.00 36.38 33.78 1mk5 s VAL 125 CO 0.21 0.12 0.00 0.61 -3.33 0.00 0.00 175.10 172.71 1mk5 n GLY 126 N 2.25 1.94 3.00 6.54 0.00 -0.75 -4.98 105.19 113.18 1mk5 n GLY 126 Ca -0.16 -0.97 -0.13 0.00 0.00 0.00 0.00 46.02 44.75 1mk5 n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1mk5 s HIS 127 N -8.01 -0.21 -0.06 1.61 -3.43 -1.26 -0.51 115.29 103.41 1mk5 s HIS 127 Ca 0.00 0.55 0.04 0.00 -0.80 0.00 0.00 55.06 54.85 1mk5 s HIS 127 Cb 0.00 -0.00 -0.00 0.00 -1.43 0.00 0.00 32.58 31.14 1mk5 s HIS 127 CO 0.00 -0.16 -0.20 -0.51 -2.00 0.00 0.00 174.74 171.87 1mk5 s ASP 128 N 0.86 2.51 -0.12 7.38 1.01 -0.95 -5.00 116.67 122.35 1mk5 s ASP 128 Ca -0.06 -0.43 0.00 0.00 0.71 0.00 0.00 52.55 52.77 1mk5 s ASP 128 Cb -0.08 -0.88 -0.02 0.00 1.01 0.00 0.00 42.92 42.95 1mk5 s ASP 128 CO -0.05 0.15 -0.13 0.28 0.21 0.00 0.00 175.17 175.63 1mk5 s THR 129 N 0.17 3.05 -0.07 -1.27 -1.32 -1.26 -0.65 115.64 114.30 1mk5 s THR 129 Ca -0.09 -0.67 0.01 0.00 -1.21 0.00 0.00 61.69 59.73 1mk5 s THR 129 Cb -0.14 -2.27 -0.03 0.00 -1.51 0.00 0.00 72.50 68.55 1mk5 s THR 129 CO 0.04 0.53 -0.07 -0.36 -2.21 0.00 0.00 174.62 172.55 1mk5 s PHE 130 N 0.22 2.92 0.28 9.09 0.08 0.40 -3.20 117.98 127.78 1mk5 s PHE 130 Ca -0.08 -0.00 0.02 0.00 0.12 0.00 0.00 56.93 56.98 1mk5 s PHE 130 Cb -0.15 -1.71 -0.05 0.00 -0.57 0.00 0.00 43.02 40.54 1mk5 s PHE 130 CO 0.05 0.31 0.12 0.95 -0.10 0.00 0.00 175.22 176.55 1mk5 s THR 131 N -0.76 0.50 -2.27 0.64 -4.23 -0.41 -1.26 115.64 107.84 1mk5 s THR 131 Ca 0.12 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 58.82 1mk5 s THR 131 Cb -0.11 -2.58 0.43 0.00 1.34 0.00 0.00 72.50 71.58 1mk5 s THR 131 CO 0.01 0.00 1.48 0.29 -0.54 0.00 0.00 174.62 175.86 1mk5 n LYS 132 N -0.53 1.91 -2.50 3.99 5.02 -1.26 -0.46 118.16 124.33 1mk5 n LYS 132 Ca 0.00 -1.38 -0.43 0.00 -2.02 0.00 0.00 58.31 54.48 1mk5 n LYS 132 Cb 0.66 -1.40 -0.02 0.00 -0.02 0.00 0.00 35.03 34.24 1mk5 n LYS 132 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1mk5 s VAL 133 N -1.68 4.26 0.02 -0.18 1.01 -1.26 -4.88 120.40 117.69 1mk5 s VAL 133 Ca 0.33 1.43 -0.30 0.00 0.00 0.00 0.00 61.98 63.43 1mk5 s VAL 133 Cb 0.18 -4.26 -0.07 0.00 0.00 0.00 0.00 36.38 32.23 1mk5 s VAL 133 CO 0.26 -0.50 1.56 -0.75 0.00 0.00 0.00 175.10 175.67 1mk5 s LYS 134 N 4.01 4.23 0.00 2.72 2.20 -1.26 -4.68 119.74 126.95 1mk5 s LYS 134 Ca 0.52 2.17 0.00 0.00 -0.36 0.00 0.00 55.97 58.30 1mk5 s LYS 134 Cb -0.15 -3.65 0.00 0.00 -1.51 0.00 0.00 37.83 32.52 1mk5 s LYS 134 CO 0.21 -0.69 0.28 -2.30 -0.36 0.00 0.00 175.35 172.49