#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pts n GLU 14 N 0.00 0.00 0.00 0.00 2.13 -1.26 0.29 120.64 121.80 1pts n GLU 14 Ca 0.00 0.60 0.00 0.00 0.66 0.00 0.00 57.16 58.42 1pts n GLU 14 Cb 0.00 -1.02 0.01 0.00 0.27 0.00 0.00 31.44 30.70 1pts n GLU 14 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1pts n ALA 15 N -1.74 2.10 0.11 4.31 0.00 -1.26 -1.07 120.51 122.96 1pts n ALA 15 Ca 0.00 -0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 1pts n ALA 15 Cb 0.00 -1.01 -0.15 0.00 0.00 0.00 0.00 19.45 18.29 1pts n ALA 15 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1pts h GLY 16 N 3.58 0.52 1.58 0.00 0.00 0.40 -3.33 103.07 105.83 1pts h GLY 16 Ca 0.00 -1.34 -0.17 0.00 0.00 0.00 0.00 47.33 45.82 1pts h GLY 16 CO 0.00 1.17 -0.68 -2.22 0.00 0.00 0.00 176.54 174.81 1pts h ILE 17 N 0.12 1.37 -2.87 2.60 2.04 0.23 -3.45 117.51 117.54 1pts h ILE 17 Ca -0.30 -2.05 -0.52 0.00 1.00 0.00 0.00 64.86 62.98 1pts h ILE 17 Cb 2.13 2.03 0.07 0.00 -0.74 0.00 0.00 36.82 40.31 1pts h ILE 17 CO 0.22 0.62 0.97 -0.89 0.00 0.00 0.00 178.15 179.07 1pts s THR 18 N -3.71 2.06 -5.00 -0.27 2.01 -0.92 -4.80 115.64 105.02 1pts s THR 18 Ca -0.06 0.05 0.00 0.00 0.31 0.00 0.00 61.69 61.99 1pts s THR 18 Cb 0.11 -3.03 0.00 0.00 0.01 0.00 0.00 72.50 69.59 1pts s THR 18 CO 0.84 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 175.38 1pts n GLY 19 N 3.43 0.45 3.52 4.40 0.00 -0.47 -4.94 105.19 111.58 1pts n GLY 19 Ca 0.13 -1.77 -0.34 0.00 0.00 0.00 0.00 46.02 44.05 1pts n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pts s THR 20 N -2.13 3.95 0.13 2.61 2.01 -1.26 -0.49 115.64 120.46 1pts s THR 20 Ca 0.00 -0.34 0.05 0.00 0.31 0.00 0.00 61.69 61.70 1pts s THR 20 Cb 0.00 -2.72 -0.04 0.00 0.01 0.00 0.00 72.50 69.75 1pts s THR 20 CO 0.00 0.51 -0.11 0.26 -0.69 0.00 0.00 174.62 174.59 1pts s TRP 21 N 0.20 1.26 0.04 4.92 0.52 0.37 -4.61 118.94 121.64 1pts s TRP 21 Ca -0.02 -0.69 0.03 0.00 0.02 0.00 0.00 56.10 55.44 1pts s TRP 21 Cb -0.14 -0.65 -0.02 0.00 -1.15 0.00 0.00 33.47 31.51 1pts s TRP 21 CO 0.03 0.08 -0.10 0.71 0.02 0.00 0.00 176.95 177.69 1pts s TYR 22 N -2.91 0.89 0.41 -1.98 1.51 0.12 -0.33 117.35 115.07 1pts s TYR 22 Ca 0.13 -0.38 0.06 0.00 -1.01 0.00 0.00 57.07 55.87 1pts s TYR 22 Cb -0.00 -0.53 0.06 0.00 -0.11 0.00 0.00 41.96 41.38 1pts s TYR 22 CO 0.01 -0.01 0.50 0.27 -1.11 0.00 0.00 175.55 175.20 1pts n ASN 23 N 1.82 1.75 0.26 2.29 0.23 -0.92 0.03 115.26 120.71 1pts n ASN 23 Ca -0.19 -2.19 0.14 0.00 -0.53 0.00 0.00 54.58 51.81 1pts n ASN 23 Cb 0.55 -0.23 0.83 0.00 -2.08 0.00 0.00 39.78 38.86 1pts n ASN 23 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 1pts h GLN 24 N 0.00 0.00 -0.56 -3.83 -0.00 -1.89 -2.66 115.11 106.17 1pts h GLN 24 Ca -0.21 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.44 1pts h GLN 24 Cb 0.91 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.39 1pts h GLN 24 CO 0.31 0.00 0.00 1.28 -0.00 0.00 0.00 178.83 180.42 1pts n LEU 25 N -4.00 3.67 0.00 0.06 4.77 -1.26 -4.99 117.00 115.24 1pts n LEU 25 Ca -0.01 -1.78 0.00 0.00 -0.03 0.00 0.00 56.01 54.19 1pts n LEU 25 Cb 0.16 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 1pts n LEU 25 CO 0.29 0.86 0.00 0.61 -1.33 0.00 0.00 177.39 177.82 1pts n GLY 26 N 1.51 0.71 3.76 -0.72 0.00 -1.00 -5.06 105.19 104.38 1pts n GLY 26 Ca 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.88 1pts n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1pts s SER 27 N -2.95 5.16 -0.06 1.61 0.01 -1.26 -4.84 113.70 111.36 1pts s SER 27 Ca 0.00 2.28 0.04 0.00 1.31 0.00 0.00 55.95 59.58 1pts s SER 27 Cb 0.00 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.65 1pts s SER 27 CO 0.00 -1.61 -0.17 -0.89 0.41 0.00 0.00 173.24 170.98 1pts s THR 28 N -1.79 1.43 -0.22 1.44 2.01 0.11 -2.17 115.64 116.45 1pts s THR 28 Ca 0.74 -0.69 0.02 0.00 0.31 0.00 0.00 61.69 62.08 1pts s THR 28 Cb -0.27 -1.25 0.04 0.00 0.01 0.00 0.00 72.50 71.02 1pts s THR 28 CO 0.35 0.42 -0.15 0.12 -0.69 0.00 0.00 174.62 174.67 1pts s PHE 29 N 0.29 2.99 -0.33 4.92 5.36 0.56 -1.30 117.98 130.47 1pts s PHE 29 Ca -0.10 -1.98 -0.14 0.00 -0.96 0.00 0.00 56.93 53.75 1pts s PHE 29 Cb -0.14 -1.90 -0.02 0.00 -0.34 0.00 0.00 43.02 40.62 1pts s PHE 29 CO 0.04 -0.84 0.29 0.42 -1.46 0.00 0.00 175.22 173.66 1pts s ILE 30 N 1.20 5.24 0.04 3.12 1.01 -0.10 -0.47 121.20 131.24 1pts s ILE 30 Ca -0.03 -0.04 0.04 0.00 0.00 0.00 0.00 60.65 60.63 1pts s ILE 30 Cb -0.17 -3.73 -0.02 0.00 0.01 0.00 0.00 42.46 38.55 1pts s ILE 30 CO -0.09 -0.00 -0.13 -0.69 0.00 0.00 0.00 174.94 174.03 1pts s VAL 31 N 1.85 1.02 -0.12 2.92 1.01 0.36 -1.23 120.40 126.20 1pts s VAL 31 Ca 0.09 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 61.12 1pts s VAL 31 Cb -0.17 -0.93 -0.01 0.00 0.00 0.00 0.00 36.38 35.27 1pts s VAL 31 CO 0.11 -0.03 -0.18 -0.89 0.00 0.00 0.00 175.10 174.11 1pts s THR 32 N -0.86 2.58 -0.28 3.92 2.01 0.68 -1.37 115.64 122.32 1pts s THR 32 Ca 0.00 -0.83 -0.11 0.00 0.31 0.00 0.00 61.69 61.07 1pts s THR 32 Cb -0.08 -2.05 -0.04 0.00 0.01 0.00 0.00 72.50 70.34 1pts s THR 32 CO 0.01 0.54 0.17 0.00 -0.69 0.00 0.00 174.62 174.65 1pts s ALA 33 N 0.40 3.46 0.52 7.40 0.00 -1.26 -2.17 121.76 130.12 1pts s ALA 33 Ca -0.14 -1.13 -0.15 0.00 0.00 0.00 0.00 51.96 50.55 1pts s ALA 33 Cb -0.17 -2.43 -0.07 0.00 0.00 0.00 0.00 23.12 20.45 1pts s ALA 33 CO 0.06 -0.58 0.97 0.20 0.00 0.00 0.00 175.76 176.42 1pts s GLY 34 N 1.73 1.98 0.27 0.00 0.00 0.08 -4.63 107.32 106.75 1pts s GLY 34 Ca 0.07 0.09 -0.00 0.00 0.00 0.00 0.00 44.72 44.88 1pts s GLY 34 CO 0.10 0.36 1.81 0.00 0.00 0.00 0.00 173.10 175.37 1pts h ALA 35 N 0.72 1.39 -0.07 3.20 0.00 -1.98 -2.92 119.26 119.59 1pts h ALA 35 Ca -0.46 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1pts h ALA 35 Cb 1.19 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1pts h ALA 35 CO 0.62 0.11 0.00 -0.25 0.00 0.00 0.00 179.25 179.73 1pts n ASP 36 N -4.71 1.00 0.00 0.00 9.92 -1.26 -4.89 116.55 116.62 1pts n ASP 36 Ca 0.17 -1.51 0.00 0.00 -0.53 0.00 0.00 54.79 52.93 1pts n ASP 36 Cb 0.36 -0.04 0.00 0.00 -0.64 0.00 0.00 41.12 40.80 1pts n ASP 36 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1pts n GLY 37 N 1.04 1.05 3.81 0.44 0.00 -1.10 -4.87 105.19 105.56 1pts n GLY 37 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1pts n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pts s ALA 38 N -2.00 3.48 -0.09 4.61 0.00 -1.26 -1.07 121.76 125.43 1pts s ALA 38 Ca 0.00 0.12 0.04 0.00 0.00 0.00 0.00 51.96 52.11 1pts s ALA 38 Cb 0.00 -2.75 -0.01 0.00 0.00 0.00 0.00 23.12 20.36 1pts s ALA 38 CO 0.00 0.36 -0.21 -0.51 0.00 0.00 0.00 175.76 175.39 1pts s LEU 39 N -1.71 2.25 0.05 0.00 1.02 -0.39 -0.74 118.68 119.16 1pts s LEU 39 Ca 0.39 -0.48 -0.01 0.00 0.02 0.00 0.00 54.13 54.05 1pts s LEU 39 Cb -0.18 -1.45 -0.04 0.00 0.02 0.00 0.00 46.19 44.55 1pts s LEU 39 CO 0.21 0.20 -0.03 0.42 0.02 0.00 0.00 176.35 177.17 1pts s THR 40 N 0.14 0.21 -5.00 5.49 -4.23 -0.92 -1.27 115.64 110.05 1pts s THR 40 Ca -0.11 -1.70 0.00 0.00 -1.18 0.00 0.00 61.69 58.69 1pts s THR 40 Cb -0.16 -1.37 0.00 0.00 1.34 0.00 0.00 72.50 72.31 1pts s THR 40 CO 0.06 -0.94 0.00 0.61 -0.54 0.00 0.00 174.62 173.81 1pts n GLY 41 N 0.29 -0.39 3.03 3.99 0.00 -1.16 -0.23 105.19 110.73 1pts n GLY 41 Ca -0.15 -1.14 -0.09 0.00 0.00 0.00 0.00 46.02 44.65 1pts n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1pts s THR 42 N -3.11 0.20 -0.04 2.61 -4.23 -0.37 -1.59 115.64 109.11 1pts s THR 42 Ca 0.00 -1.30 0.06 0.00 -1.18 0.00 0.00 61.69 59.27 1pts s THR 42 Cb 0.00 -0.81 -0.01 0.00 1.34 0.00 0.00 72.50 73.02 1pts s THR 42 CO 0.00 -0.70 -0.23 -0.47 -0.54 0.00 0.00 174.62 172.68 1pts s TYR 43 N -2.47 2.20 -0.03 3.99 6.14 0.25 -0.93 117.35 126.51 1pts s TYR 43 Ca -0.06 -0.59 -0.02 0.00 0.64 0.00 0.00 57.07 57.05 1pts s TYR 43 Cb -0.03 -1.44 0.01 0.00 0.42 0.00 0.00 41.96 40.93 1pts s TYR 43 CO -0.04 -0.16 0.06 -1.83 0.64 0.00 0.00 175.55 174.22 1pts s GLU 44 N -0.23 0.05 -0.10 4.97 -1.05 -0.42 -0.59 118.70 121.32 1pts s GLU 44 Ca -0.00 0.14 0.07 0.00 -0.15 0.00 0.00 54.97 55.02 1pts s GLU 44 Cb -0.12 -0.05 -0.11 0.00 -0.44 0.00 0.00 34.13 33.41 1pts s GLU 44 CO 0.02 -0.06 0.00 -1.13 0.95 0.00 0.00 175.26 175.04 1pts n SER 45 N 3.43 2.71 -3.24 0.83 3.41 -1.26 0.10 113.62 119.59 1pts n SER 45 Ca -0.17 -0.01 -0.22 0.00 -0.26 0.00 0.00 58.87 58.20 1pts n SER 45 Cb 0.57 0.54 0.20 0.00 -0.26 0.00 0.00 64.21 65.25 1pts n SER 45 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1pts n SER 52 N -2.47 -2.46 -4.83 4.04 3.41 -1.26 -4.81 113.62 105.24 1pts n SER 52 Ca -0.17 -0.87 -0.37 0.00 -0.26 0.00 0.00 58.87 57.19 1pts n SER 52 Cb 0.80 -0.74 -0.06 0.00 -0.26 0.00 0.00 64.21 63.94 1pts n SER 52 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1pts s ARG 53 N -4.74 3.83 0.06 4.33 3.52 -1.26 -4.95 118.95 119.74 1pts s ARG 53 Ca 0.52 0.21 0.04 0.00 -0.13 0.00 0.00 55.73 56.36 1pts s ARG 53 Cb -0.06 -3.24 -0.03 0.00 -1.56 0.00 0.00 34.95 30.06 1pts s ARG 53 CO 0.41 0.65 -0.11 0.71 -0.81 0.00 0.00 175.30 176.15 1pts s TYR 54 N -0.83 0.96 0.20 5.12 1.51 0.25 -4.81 117.35 119.74 1pts s TYR 54 Ca 0.20 -0.50 -0.29 0.00 -1.01 0.00 0.00 57.07 55.47 1pts s TYR 54 Cb -0.15 -0.55 -0.08 0.00 -0.11 0.00 0.00 41.96 41.07 1pts s TYR 54 CO 0.09 -0.01 0.91 0.08 -1.11 0.00 0.00 175.55 175.51 1pts s VAL 55 N -1.43 4.22 0.12 0.71 1.01 -1.26 -0.59 120.40 123.17 1pts s VAL 55 Ca -0.05 2.01 0.08 0.00 0.00 0.00 0.00 61.98 64.02 1pts s VAL 55 Cb -0.09 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.96 1pts s VAL 55 CO 0.01 0.47 -0.19 -1.48 0.00 0.00 0.00 175.10 173.91 1pts s LEU 56 N -0.93 2.34 -0.00 3.92 0.05 -0.62 -4.34 118.68 119.10 1pts s LEU 56 Ca 0.41 -0.73 -0.04 0.00 0.05 0.00 0.00 54.13 53.82 1pts s LEU 56 Cb -0.25 -0.81 -0.00 0.00 -2.05 0.00 0.00 46.19 43.07 1pts s LEU 56 CO 0.30 0.01 0.07 0.28 -0.55 0.00 0.00 176.35 176.47 1pts s THR 57 N -1.45 0.07 0.00 5.48 -1.32 -1.12 -2.97 115.64 114.34 1pts s THR 57 Ca 0.08 -0.61 0.00 0.00 -1.21 0.00 0.00 61.69 59.95 1pts s THR 57 Cb -0.09 -0.31 0.00 0.00 -1.51 0.00 0.00 72.50 70.59 1pts s THR 57 CO 0.05 -0.33 0.00 0.61 -2.21 0.00 0.00 174.62 172.73 1pts n GLY 58 N 1.85 1.95 3.14 6.08 0.00 -0.40 -0.97 105.19 116.85 1pts n GLY 58 Ca -0.21 -0.85 -0.09 0.00 0.00 0.00 0.00 46.02 44.88 1pts n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pts s ARG 59 N -0.67 0.68 0.09 1.61 1.81 -1.01 -1.26 118.95 120.20 1pts s ARG 59 Ca 0.00 -0.94 -0.07 0.00 -1.72 0.00 0.00 55.73 53.00 1pts s ARG 59 Cb 0.00 0.26 -0.01 0.00 -0.45 0.00 0.00 34.95 34.76 1pts s ARG 59 CO 0.00 -0.18 0.16 1.52 -0.68 0.00 0.00 175.30 176.12 1pts s TYR 60 N -3.36 0.24 -0.36 -0.53 1.13 -0.23 -1.57 117.35 112.67 1pts s TYR 60 Ca 0.01 -0.68 -0.29 0.00 -1.41 0.00 0.00 57.07 54.70 1pts s TYR 60 Cb 0.03 -0.12 -0.00 0.00 -1.10 0.00 0.00 41.96 40.77 1pts s TYR 60 CO -0.08 -0.53 1.56 0.34 -2.51 0.00 0.00 175.55 174.33 1pts s ASP 61 N -2.88 6.20 -0.00 -0.18 2.15 -0.67 -4.59 116.67 116.69 1pts s ASP 61 Ca 0.07 1.08 0.04 0.00 0.43 0.00 0.00 52.55 54.17 1pts s ASP 61 Cb 0.05 -2.53 0.12 0.00 -0.30 0.00 0.00 42.92 40.26 1pts s ASP 61 CO -0.10 -1.50 1.07 -1.54 -0.17 0.00 0.00 175.17 172.93 1pts n SER 62 N 9.26 0.81 -3.02 -0.34 3.41 -1.26 -4.12 113.62 118.35 1pts n SER 62 Ca 0.19 -2.01 -0.16 0.00 -0.26 0.00 0.00 58.87 56.63 1pts n SER 62 Cb 0.47 -0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.30 1pts n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pts n ALA 63 N -0.09 1.00 -0.81 7.33 0.00 -1.26 -4.98 120.51 121.70 1pts n ALA 63 Ca 0.05 -2.69 -0.29 0.00 0.00 0.00 0.00 53.44 50.50 1pts n ALA 63 Cb 0.14 -1.01 0.19 0.00 0.00 0.00 0.00 19.45 18.77 1pts n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1pts s PRO 64 N -1.19 0.30 0.00 0.00 0.04 -1.26 -5.17 135.00 127.73 1pts s PRO 64 Ca 0.34 1.01 0.00 0.00 0.04 0.00 0.00 61.00 62.39 1pts s PRO 64 Cb 0.29 -1.68 0.00 0.00 0.04 0.00 0.00 34.50 33.15 1pts s PRO 64 CO -0.09 -2.96 0.00 0.00 0.04 0.00 0.00 177.00 173.99 1pts n ALA 65 N -4.40 0.00 0.00 8.56 0.00 -1.26 -5.16 120.51 118.25 1pts n ALA 65 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1pts n ALA 65 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1pts n ALA 65 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1pts n SER 69 N 0.00 -0.07 -4.30 0.00 7.64 -1.26 -5.21 113.62 110.42 1pts n SER 69 Ca 0.00 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.58 1pts n SER 69 Cb 0.00 0.80 0.18 0.00 -1.01 0.00 0.00 64.21 64.18 1pts n SER 69 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1pts s GLY 70 N -2.33 1.67 -0.29 0.23 0.00 -1.26 -5.01 107.32 100.32 1pts s GLY 70 Ca 0.00 -0.92 -0.13 0.00 0.00 0.00 0.00 44.72 43.67 1pts s GLY 70 CO 0.00 -0.21 0.26 -1.59 0.00 0.00 0.00 173.10 171.56 1pts s THR 71 N -3.51 5.26 0.60 0.90 2.01 -0.08 -4.87 115.64 115.94 1pts s THR 71 Ca 0.70 0.19 -0.17 0.00 0.31 0.00 0.00 61.69 62.72 1pts s THR 71 Cb -0.08 -3.63 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 1pts s THR 71 CO 0.53 0.15 1.09 0.00 -0.69 0.00 0.00 174.62 175.70 1pts s ALA 72 N 1.86 2.64 0.02 7.40 0.00 -1.26 -0.64 121.76 131.78 1pts s ALA 72 Ca 0.09 0.58 -0.28 0.00 0.00 0.00 0.00 51.96 52.35 1pts s ALA 72 Cb -0.16 -3.30 0.10 0.00 0.00 0.00 0.00 23.12 19.76 1pts s ALA 72 CO 0.11 -0.93 0.97 -0.48 0.00 0.00 0.00 175.76 175.43 1pts s LEU 73 N -4.37 -0.26 0.17 0.00 0.05 -0.51 -1.66 118.68 112.10 1pts s LEU 73 Ca 0.67 -0.13 -0.24 0.00 0.05 0.00 0.00 54.13 54.48 1pts s LEU 73 Cb -0.20 1.96 0.06 0.00 -2.05 0.00 0.00 46.19 45.96 1pts s LEU 73 CO 0.35 -0.65 0.75 -0.83 -0.55 0.00 0.00 176.35 175.42 1pts s GLY 74 N -2.63 -0.36 0.19 -3.48 0.00 -0.61 -1.71 107.32 98.73 1pts s GLY 74 Ca 0.08 0.26 -0.21 0.00 0.00 0.00 0.00 44.72 44.86 1pts s GLY 74 CO -0.05 0.08 0.59 0.66 0.00 0.00 0.00 173.10 174.39 1pts s TRP 75 N -3.61 -0.32 0.13 1.90 -2.14 -0.57 -2.41 118.94 111.92 1pts s TRP 75 Ca 0.07 0.01 0.06 0.00 2.66 0.00 0.00 56.10 58.90 1pts s TRP 75 Cb -0.03 0.53 -0.04 0.00 -3.10 0.00 0.00 33.47 30.83 1pts s TRP 75 CO -0.03 -0.95 -0.14 0.99 -2.66 0.00 0.00 176.95 174.17 1pts s THR 76 N -3.83 1.34 -0.04 0.66 2.01 -0.14 -1.12 115.64 114.51 1pts s THR 76 Ca 0.06 -1.79 -0.01 0.00 0.31 0.00 0.00 61.69 60.25 1pts s THR 76 Cb -0.02 -1.61 0.03 0.00 0.01 0.00 0.00 72.50 70.91 1pts s THR 76 CO -0.06 -0.47 0.03 -0.69 -0.69 0.00 0.00 174.62 172.74 1pts s VAL 77 N -2.34 0.10 -0.07 3.82 1.01 -0.21 -2.79 120.40 119.92 1pts s VAL 77 Ca 0.11 0.24 -0.20 0.00 0.00 0.00 0.00 61.98 62.13 1pts s VAL 77 Cb -0.04 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 36.02 1pts s VAL 77 CO 0.03 0.19 0.56 0.00 0.00 0.00 0.00 175.10 175.88 1pts s ALA 78 N 1.73 3.45 -1.44 5.51 0.00 -1.26 -0.57 121.76 129.17 1pts s ALA 78 Ca -0.00 -0.05 -0.08 0.00 0.00 0.00 0.00 51.96 51.83 1pts s ALA 78 Cb -0.13 -2.74 -0.04 0.00 0.00 0.00 0.00 23.12 20.21 1pts s ALA 78 CO -0.03 0.03 2.84 0.91 0.00 0.00 0.00 175.76 179.51 1pts n TRP 79 N 3.39 2.33 -3.88 0.00 7.02 0.11 -4.79 117.44 121.62 1pts n TRP 79 Ca -0.06 -2.92 -0.15 0.00 -1.02 0.00 0.00 57.50 53.35 1pts n TRP 79 Cb 0.51 -2.25 -0.16 0.00 -2.42 0.00 0.00 31.31 27.00 1pts n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1pts s LYS 80 N 1.13 0.14 0.00 -0.99 2.20 -1.26 -1.12 119.74 119.84 1pts s LYS 80 Ca 0.65 0.08 0.00 0.00 -0.36 0.00 0.00 55.97 56.34 1pts s LYS 80 Cb 0.19 -0.30 0.00 0.00 -1.51 0.00 0.00 37.83 36.21 1pts s LYS 80 CO -0.07 -0.10 0.00 0.27 -0.36 0.00 0.00 175.35 175.09 1pts n ASN 81 N 3.84 0.00 0.12 1.43 0.23 -0.88 -4.80 115.26 115.21 1pts n ASN 81 Ca -0.23 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 53.94 1pts n ASN 81 Cb 0.53 0.00 0.47 0.00 -2.08 0.00 0.00 39.78 38.69 1pts n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1pts n ASN 82 N 0.00 0.70 -0.04 0.53 3.02 -1.26 -3.94 115.26 114.27 1pts n ASN 82 Ca 0.00 0.64 -0.03 0.00 -0.03 0.00 0.00 54.58 55.16 1pts n ASN 82 Cb 0.00 -0.80 -0.09 0.00 -0.61 0.00 0.00 39.78 38.28 1pts n ASN 82 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1pts n TYR 83 N -2.23 0.00 -3.78 3.10 4.01 -1.26 -5.08 117.16 111.92 1pts n TYR 83 Ca 0.03 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.68 1pts n TYR 83 Cb 0.29 -0.49 -0.06 0.00 -0.31 0.00 0.00 39.34 38.77 1pts n TYR 83 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1pts s ARG 84 N -2.41 0.98 -0.22 -0.72 0.52 -1.25 -5.14 118.95 110.70 1pts s ARG 84 Ca -0.05 -0.88 -0.03 0.00 -0.52 0.00 0.00 55.73 54.24 1pts s ARG 84 Cb 0.04 0.40 0.11 0.00 0.52 0.00 0.00 34.95 36.03 1pts s ARG 84 CO 0.47 -0.35 0.29 1.21 0.02 0.00 0.00 175.30 176.94 1pts s ASN 85 N -2.85 0.95 0.00 0.23 3.84 -1.26 -2.06 114.94 113.78 1pts s ASN 85 Ca 0.06 -0.08 0.23 0.00 0.21 0.00 0.00 52.86 53.27 1pts s ASN 85 Cb 0.03 0.68 0.64 0.00 -0.55 0.00 0.00 41.25 42.05 1pts s ASN 85 CO -0.10 -0.32 1.50 0.00 -2.79 0.00 0.00 177.10 175.39 1pts n ALA 86 N 5.34 2.49 -4.10 1.71 0.00 -0.27 -4.97 120.51 120.70 1pts n ALA 86 Ca -0.05 -0.66 -0.39 0.00 0.00 0.00 0.00 53.44 52.35 1pts n ALA 86 Cb 0.50 -1.01 -0.02 0.00 0.00 0.00 0.00 19.45 18.92 1pts n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1pts n HIS 87 N 0.75 -1.42 -3.88 0.00 8.25 -1.26 -4.85 115.22 112.81 1pts n HIS 87 Ca 0.17 0.31 -0.09 0.00 -0.26 0.00 0.00 57.72 57.86 1pts n HIS 87 Cb 0.44 -2.93 -0.01 0.00 1.12 0.00 0.00 29.99 28.62 1pts n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1pts s SER 88 N -3.85 -0.01 -0.27 0.41 1.04 -1.26 -1.13 113.70 108.64 1pts s SER 88 Ca 0.31 -0.97 -0.22 0.00 0.48 0.00 0.00 55.95 55.56 1pts s SER 88 Cb -0.16 0.76 0.07 0.00 0.10 0.00 0.00 66.02 66.79 1pts s SER 88 CO 0.96 -1.47 0.70 0.00 0.98 0.00 0.00 173.24 174.41 1pts s ALA 89 N -3.15 -1.78 0.00 5.32 0.00 -0.76 -0.72 121.76 120.67 1pts s ALA 89 Ca 0.16 2.12 0.05 0.00 0.00 0.00 0.00 51.96 54.29 1pts s ALA 89 Cb -0.04 -1.24 -0.03 0.00 0.00 0.00 0.00 23.12 21.81 1pts s ALA 89 CO 0.10 -0.35 -0.14 0.99 0.00 0.00 0.00 175.76 176.37 1pts s THR 90 N 0.79 3.08 -0.04 0.00 2.01 0.27 -1.38 115.64 120.38 1pts s THR 90 Ca -0.03 -0.94 0.06 0.00 0.31 0.00 0.00 61.69 61.09 1pts s THR 90 Cb -0.05 -2.28 -0.01 0.00 0.01 0.00 0.00 72.50 70.16 1pts s THR 90 CO -0.06 0.43 -0.23 0.42 -0.69 0.00 0.00 174.62 174.49 1pts s THR 91 N -0.88 1.87 -0.10 -0.82 -4.23 -0.74 -1.05 115.64 109.69 1pts s THR 91 Ca 0.14 -0.99 0.02 0.00 -1.18 0.00 0.00 61.69 59.69 1pts s THR 91 Cb -0.11 -1.57 -0.02 0.00 1.34 0.00 0.00 72.50 72.15 1pts s THR 91 CO 0.04 0.53 -0.15 0.26 -0.54 0.00 0.00 174.62 174.76 1pts s TRP 92 N -0.33 2.74 -0.04 3.99 0.51 -0.28 -1.82 118.94 123.71 1pts s TRP 92 Ca 0.03 -0.50 0.02 0.00 -2.12 0.00 0.00 56.10 53.53 1pts s TRP 92 Cb -0.11 -1.75 0.01 0.00 -0.81 0.00 0.00 33.47 30.82 1pts s TRP 92 CO 0.01 -0.08 -0.08 0.45 -0.51 0.00 0.00 176.95 176.74 1pts s SER 93 N -0.06 1.27 0.00 2.95 0.15 -0.50 -1.51 113.70 115.99 1pts s SER 93 Ca -0.03 -0.20 0.00 0.00 0.70 0.00 0.00 55.95 56.42 1pts s SER 93 Cb -0.14 -0.52 0.00 0.00 -1.71 0.00 0.00 66.02 63.65 1pts s SER 93 CO 0.04 0.01 0.00 0.61 1.20 0.00 0.00 173.24 175.10 1pts n GLY 94 N 3.72 1.19 3.17 9.45 0.00 -0.69 -1.72 105.19 120.30 1pts n GLY 94 Ca -0.22 -0.50 -0.10 0.00 0.00 0.00 0.00 46.02 45.20 1pts n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1pts s GLN 95 N 1.37 0.66 -0.17 1.61 -2.07 -0.89 -1.42 119.66 118.74 1pts s GLN 95 Ca 0.00 -0.61 -0.10 0.00 -1.82 0.00 0.00 55.36 52.83 1pts s GLN 95 Cb 0.00 0.27 -0.05 0.00 -1.09 0.00 0.00 33.01 32.15 1pts s GLN 95 CO 0.00 -0.19 0.17 -0.47 -1.32 0.00 0.00 175.29 173.49 1pts s TYR 96 N -2.42 3.47 -0.17 9.60 5.04 0.19 -2.13 117.35 130.92 1pts s TYR 96 Ca -0.06 0.44 0.01 0.00 -2.44 0.00 0.00 57.07 55.01 1pts s TYR 96 Cb -0.02 -2.16 0.02 0.00 0.35 0.00 0.00 41.96 40.16 1pts s TYR 96 CO -0.03 0.37 -0.17 0.08 -1.34 0.00 0.00 175.55 174.47 1pts s VAL 97 N 0.08 1.84 0.41 3.14 1.01 0.60 -0.90 120.40 126.58 1pts s VAL 97 Ca 0.11 -0.86 -0.00 0.00 0.00 0.00 0.00 61.98 61.23 1pts s VAL 97 Cb -0.12 -1.72 0.08 0.00 0.00 0.00 0.00 36.38 34.62 1pts s VAL 97 CO 0.01 0.45 0.56 0.61 0.00 0.00 0.00 175.10 176.73 1pts n GLY 98 N 4.68 0.64 0.00 4.51 0.00 -1.26 -0.77 105.19 112.98 1pts n GLY 98 Ca -0.19 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 43.85 1pts n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pts n GLY 99 N 0.75 0.81 0.24 -0.02 0.00 -1.26 -4.73 105.19 100.98 1pts n GLY 99 Ca 0.09 -2.01 -0.05 0.00 0.00 0.00 0.00 46.02 44.05 1pts n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pts h ALA 100 N 0.00 0.77 -3.26 4.61 0.00 -2.07 -3.31 119.26 116.01 1pts h ALA 100 Ca 0.00 -0.02 -0.63 0.00 0.00 0.00 0.00 54.91 54.25 1pts h ALA 100 Cb 0.00 -0.20 -0.41 0.00 0.00 0.00 0.00 17.79 17.18 1pts h ALA 100 CO 0.00 0.12 -0.60 -1.83 0.00 0.00 0.00 179.25 176.94 1pts s GLU 101 N -6.13 2.19 0.38 0.00 -1.05 -1.26 -5.09 118.70 107.74 1pts s GLU 101 Ca -0.13 -2.92 -0.27 0.00 -0.15 0.00 0.00 54.97 51.50 1pts s GLU 101 Cb 0.14 -3.37 -0.10 0.00 -0.44 0.00 0.00 34.13 30.36 1pts s GLU 101 CO 0.75 -1.18 1.35 0.00 0.95 0.00 0.00 175.26 177.13 1pts s ALA 102 N -0.77 3.39 0.10 -0.84 0.00 -1.25 -4.93 121.76 117.46 1pts s ALA 102 Ca 0.20 1.33 -0.09 0.00 0.00 0.00 0.00 51.96 53.40 1pts s ALA 102 Cb -0.17 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.43 1pts s ALA 102 CO -0.07 -0.86 0.21 -0.98 0.00 0.00 0.00 175.76 174.07 1pts s ARG 103 N -2.10 0.88 -0.27 0.00 1.04 0.05 -4.31 118.95 114.24 1pts s ARG 103 Ca 0.54 -0.95 0.02 0.00 -1.04 0.00 0.00 55.73 54.31 1pts s ARG 103 Cb -0.41 0.36 0.07 0.00 -2.04 0.00 0.00 34.95 32.93 1pts s ARG 103 CO 0.54 -0.29 -0.05 0.42 -0.04 0.00 0.00 175.30 175.88 1pts s ILE 104 N -3.86 1.88 -0.16 4.99 1.01 -0.72 -0.29 121.20 124.05 1pts s ILE 104 Ca 0.05 -1.61 -0.19 0.00 0.00 0.00 0.00 60.65 58.90 1pts s ILE 104 Cb 0.04 -2.15 -0.04 0.00 0.01 0.00 0.00 42.46 40.33 1pts s ILE 104 CO -0.11 -0.21 0.52 0.20 0.00 0.00 0.00 174.94 175.34 1pts s ASN 105 N 1.20 6.64 0.13 3.58 0.01 -0.90 -1.30 114.94 124.29 1pts s ASN 105 Ca -0.03 0.76 0.03 0.00 -0.71 0.00 0.00 52.86 52.91 1pts s ASN 105 Cb -0.19 -2.30 -0.04 0.00 0.41 0.00 0.00 41.25 39.13 1pts s ASN 105 CO -0.07 -0.11 -0.06 0.42 -1.51 0.00 0.00 177.10 175.77 1pts s THR 106 N 1.21 0.85 0.11 1.60 -4.23 0.69 -2.09 115.64 113.77 1pts s THR 106 Ca 0.26 -1.99 0.09 0.00 -1.18 0.00 0.00 61.69 58.87 1pts s THR 106 Cb -0.15 -1.84 -0.04 0.00 1.34 0.00 0.00 72.50 71.81 1pts s THR 106 CO 0.10 -0.74 -0.23 -1.10 -0.54 0.00 0.00 174.62 172.11 1pts s GLN 107 N -3.82 1.22 0.07 3.99 -1.52 -0.70 -0.45 119.66 118.45 1pts s GLN 107 Ca 0.16 -1.21 0.02 0.00 -1.95 0.00 0.00 55.36 52.38 1pts s GLN 107 Cb 0.05 -1.55 -0.03 0.00 -0.22 0.00 0.00 33.01 31.25 1pts s GLN 107 CO -0.01 0.36 -0.07 1.67 -0.25 0.00 0.00 175.29 176.99 1pts s TRP 108 N -1.12 0.79 -0.13 0.91 1.48 -0.35 -1.41 118.94 119.11 1pts s TRP 108 Ca 0.09 -0.69 0.01 0.00 -1.06 0.00 0.00 56.10 54.44 1pts s TRP 108 Cb -0.10 -0.46 0.02 0.00 -1.16 0.00 0.00 33.47 31.76 1pts s TRP 108 CO 0.05 -0.11 -0.15 -0.51 -4.06 0.00 0.00 176.95 172.17 1pts s LEU 109 N -2.27 1.71 -0.28 -4.66 1.43 -0.75 -1.38 118.68 112.47 1pts s LEU 109 Ca 0.01 -0.46 -0.06 0.00 -1.03 0.00 0.00 54.13 52.58 1pts s LEU 109 Cb -0.03 -1.15 0.01 0.00 0.03 0.00 0.00 46.19 45.05 1pts s LEU 109 CO -0.02 -0.02 0.04 -0.22 0.23 0.00 0.00 176.35 176.36 1pts s LEU 110 N 1.26 3.60 -0.12 1.79 2.96 -0.28 -1.80 118.68 126.09 1pts s LEU 110 Ca -0.00 -0.66 -0.00 0.00 -0.22 0.00 0.00 54.13 53.24 1pts s LEU 110 Cb -0.14 -1.83 -0.02 0.00 0.50 0.00 0.00 46.19 44.70 1pts s LEU 110 CO -0.07 -0.15 -0.10 -0.89 -1.32 0.00 0.00 176.35 173.82 1pts s THR 111 N 1.47 3.32 -0.03 3.68 2.01 -0.48 -0.54 115.64 125.08 1pts s THR 111 Ca 0.03 -0.58 -0.03 0.00 0.31 0.00 0.00 61.69 61.42 1pts s THR 111 Cb -0.17 -2.40 -0.04 0.00 0.01 0.00 0.00 72.50 69.91 1pts s THR 111 CO 0.01 0.53 0.14 -0.44 -0.69 0.00 0.00 174.62 174.17 1pts s SER 112 N 0.09 6.17 0.02 3.53 0.01 -0.67 -1.83 113.70 121.01 1pts s SER 112 Ca -0.04 0.32 -0.30 0.00 1.31 0.00 0.00 55.95 57.23 1pts s SER 112 Cb -0.14 -1.91 -0.06 0.00 0.21 0.00 0.00 66.02 64.12 1pts s SER 112 CO 0.04 0.30 1.50 -0.83 0.41 0.00 0.00 173.24 174.66 1pts s GLY 113 N -1.67 1.73 0.27 3.44 0.00 -0.28 -4.88 107.32 105.94 1pts s GLY 113 Ca 0.23 0.99 0.02 0.00 0.00 0.00 0.00 44.72 45.96 1pts s GLY 113 CO 0.14 2.67 0.07 -0.51 0.00 0.00 0.00 173.10 175.47 1pts s THR 114 N 2.58 0.76 0.72 0.90 -4.23 -1.26 -5.01 115.64 110.11 1pts s THR 114 Ca 0.68 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 59.07 1pts s THR 114 Cb -0.34 -2.63 0.03 0.00 1.34 0.00 0.00 72.50 70.90 1pts s THR 114 CO 0.28 -0.05 1.11 0.42 -0.54 0.00 0.00 174.62 175.84 1pts s THR 115 N -3.61 3.30 0.34 3.99 -4.23 -1.26 -4.89 115.64 109.27 1pts s THR 115 Ca 0.36 0.42 0.05 0.00 -1.18 0.00 0.00 61.69 61.35 1pts s THR 115 Cb 0.08 -3.39 0.30 0.00 1.34 0.00 0.00 72.50 70.82 1pts s THR 115 CO 0.13 -0.55 1.89 -0.33 -0.54 0.00 0.00 174.62 175.23 1pts h GLU 116 N -0.73 0.80 -0.83 3.99 3.07 -2.01 -2.24 114.58 116.62 1pts h GLU 116 Ca -0.45 -0.05 0.15 0.00 -0.50 0.00 0.00 59.36 58.51 1pts h GLU 116 Cb 1.26 -0.18 -0.06 0.00 -0.84 0.00 0.00 28.75 28.93 1pts h GLU 116 CO 0.64 0.53 0.55 0.00 -1.40 0.00 0.00 179.01 179.32 1pts h ALA 117 N 1.57 1.98 -0.26 3.43 0.00 -2.07 -2.46 119.26 121.45 1pts h ALA 117 Ca 0.41 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1pts h ALA 117 Cb 0.47 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1pts h ALA 117 CO -0.18 -0.21 0.00 0.09 0.00 0.00 0.00 179.25 178.95 1pts n ASN 118 N -4.52 2.84 0.03 0.00 3.02 -0.89 -4.58 115.26 111.16 1pts n ASN 118 Ca 0.16 -1.84 0.19 0.00 -0.03 0.00 0.00 54.58 53.07 1pts n ASN 118 Cb 0.51 -0.17 0.70 0.00 -0.61 0.00 0.00 39.78 40.21 1pts n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pts h ALA 119 N 3.02 2.40 0.00 5.41 0.00 -0.92 -1.97 119.26 127.21 1pts h ALA 119 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1pts h ALA 119 Cb 0.75 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1pts h ALA 119 CO 0.00 -0.60 0.00 0.11 0.00 0.00 0.00 179.25 178.76 1pts h TRP 120 N 0.00 0.00 -0.21 0.00 5.08 -1.80 -2.88 115.95 116.13 1pts h TRP 120 Ca 0.22 0.00 -0.11 0.00 1.08 0.00 0.00 58.89 60.09 1pts h TRP 120 Cb 0.93 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 27.03 1pts h TRP 120 CO 0.00 0.00 -0.23 0.36 -1.28 0.00 0.00 178.44 177.29 1pts n LYS 121 N -3.02 1.76 0.23 0.12 2.85 -0.74 -4.75 118.16 114.60 1pts n LYS 121 Ca 0.00 -3.21 0.13 0.00 -1.05 0.00 0.00 58.31 54.18 1pts n LYS 121 Cb 0.27 -1.74 0.28 0.00 -0.65 0.00 0.00 35.03 33.19 1pts n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1pts h SER 122 N 0.99 0.00 -3.34 -5.58 4.64 -1.52 -3.47 113.55 105.28 1pts h SER 122 Ca 0.13 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.86 1pts h SER 122 Cb 1.40 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 63.16 1pts h SER 122 CO 0.24 0.02 -0.84 -0.89 -0.87 0.00 0.00 176.83 174.49 1pts s THR 123 N -3.31 1.54 -0.00 2.95 2.01 -1.26 -1.67 115.64 115.91 1pts s THR 123 Ca 0.06 -0.70 -0.03 0.00 0.31 0.00 0.00 61.69 61.33 1pts s THR 123 Cb 0.06 -1.38 -0.04 0.00 0.01 0.00 0.00 72.50 71.15 1pts s THR 123 CO 0.65 0.45 0.19 -0.76 -0.69 0.00 0.00 174.62 174.45 1pts s LEU 124 N 0.69 4.37 0.05 4.42 1.43 0.30 -4.94 118.68 125.00 1pts s LEU 124 Ca -0.13 0.34 0.08 0.00 -1.03 0.00 0.00 54.13 53.39 1pts s LEU 124 Cb -0.16 -2.64 -0.03 0.00 0.03 0.00 0.00 46.19 43.39 1pts s LEU 124 CO 0.03 0.26 -0.21 0.54 0.23 0.00 0.00 176.35 177.19 1pts s VAL 125 N -1.34 1.73 0.03 -1.59 0.11 -1.26 -1.13 120.40 116.95 1pts s VAL 125 Ca 0.28 -1.26 -0.01 0.00 -2.93 0.00 0.00 61.98 58.05 1pts s VAL 125 Cb -0.13 -1.51 0.01 0.00 -1.53 0.00 0.00 36.38 33.22 1pts s VAL 125 CO 0.19 0.19 0.08 0.61 -3.33 0.00 0.00 175.10 172.84 1pts n GLY 126 N 1.74 1.74 3.11 6.54 0.00 -0.48 -5.00 105.19 112.84 1pts n GLY 126 Ca -0.17 -1.01 -0.15 0.00 0.00 0.00 0.00 46.02 44.68 1pts n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1pts s HIS 127 N -7.73 0.89 0.01 1.61 -3.43 -1.26 -1.21 115.29 104.16 1pts s HIS 127 Ca 0.02 -0.49 0.01 0.00 -0.80 0.00 0.00 55.06 53.80 1pts s HIS 127 Cb -0.00 -0.52 -0.01 0.00 -1.43 0.00 0.00 32.58 30.62 1pts s HIS 127 CO 0.01 -0.03 -0.04 -0.51 -2.00 0.00 0.00 174.74 172.17 1pts s ASP 128 N -1.67 0.51 -0.21 7.38 1.01 0.41 -4.96 116.67 119.14 1pts s ASP 128 Ca -0.06 -0.17 -0.02 0.00 0.71 0.00 0.00 52.55 53.01 1pts s ASP 128 Cb -0.10 -0.03 0.01 0.00 1.01 0.00 0.00 42.92 43.81 1pts s ASP 128 CO 0.01 -0.01 -0.11 -0.89 0.21 0.00 0.00 175.17 174.38 1pts s THR 129 N -0.37 2.80 0.01 -1.27 2.01 -1.26 -0.23 115.64 117.33 1pts s THR 129 Ca -0.01 -0.71 0.01 0.00 0.31 0.00 0.00 61.69 61.28 1pts s THR 129 Cb -0.03 -2.25 -0.04 0.00 0.01 0.00 0.00 72.50 70.19 1pts s THR 129 CO -0.00 0.46 0.05 -0.36 -0.69 0.00 0.00 174.62 174.08 1pts s PHE 130 N 1.39 3.21 0.24 4.92 0.08 -0.42 -3.12 117.98 124.28 1pts s PHE 130 Ca 0.05 0.15 -0.03 0.00 0.12 0.00 0.00 56.93 57.23 1pts s PHE 130 Cb -0.14 -1.70 -0.03 0.00 -0.57 0.00 0.00 43.02 40.58 1pts s PHE 130 CO -0.07 0.52 0.25 0.95 -0.10 0.00 0.00 175.22 176.77 1pts s THR 131 N -1.18 0.00 -2.00 0.64 -4.23 0.10 -1.76 115.64 107.22 1pts s THR 131 Ca 0.22 -1.83 0.28 0.00 -1.18 0.00 0.00 61.69 59.18 1pts s THR 131 Cb -0.12 -2.45 0.79 0.00 1.34 0.00 0.00 72.50 72.06 1pts s THR 131 CO 0.13 0.00 2.06 0.29 -0.54 0.00 0.00 174.62 176.56 1pts n LYS 132 N -0.36 0.99 0.00 3.99 5.02 -1.26 0.12 118.16 126.66 1pts n LYS 132 Ca 0.02 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.36 1pts n LYS 132 Cb 0.64 -1.43 0.04 0.00 -0.02 0.00 0.00 35.03 34.26 1pts n LYS 132 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16