#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k86 s GLU 15 N 0.00 4.34 0.55 -1.08 0.41 -1.26 -5.07 118.70 116.59 3k86 s GLU 15 Ca 0.00 1.03 -0.15 0.00 -0.41 0.00 0.00 54.97 55.44 3k86 s GLU 15 Cb 0.00 -2.75 -0.07 0.00 -1.78 0.00 0.00 34.13 29.54 3k86 s GLU 15 CO 0.00 0.29 1.00 0.95 -0.49 0.00 0.00 175.26 177.02 3k86 s THR 16 N -1.66 4.51 0.73 3.63 -4.23 -1.26 -5.01 115.64 112.35 3k86 s THR 16 Ca 0.48 1.10 -0.15 0.00 -1.18 0.00 0.00 61.69 61.95 3k86 s THR 16 Cb -0.16 -3.72 0.04 0.00 1.34 0.00 0.00 72.50 70.00 3k86 s THR 16 CO 0.21 -0.78 1.21 0.68 -0.54 0.00 0.00 174.62 175.39 3k86 s VAL 17 N -2.74 2.30 0.47 2.29 -7.23 -1.26 -4.95 120.40 109.28 3k86 s VAL 17 Ca 0.58 0.15 -0.24 0.00 -1.81 0.00 0.00 61.98 60.67 3k86 s VAL 17 Cb -0.11 -2.71 -0.08 0.00 0.56 0.00 0.00 36.38 34.04 3k86 s VAL 17 CO 0.37 -0.08 1.21 0.00 -0.31 0.00 0.00 175.10 176.29 3k86 n ALA 18 N -2.75 1.05 -0.22 1.32 0.00 -1.26 -4.83 120.51 113.82 3k86 n ALA 18 Ca 0.13 0.19 0.04 0.00 0.00 0.00 0.00 53.44 53.80 3k86 n ALA 18 Cb 0.50 -2.24 0.29 0.00 0.00 0.00 0.00 19.45 18.00 3k86 n ALA 18 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3k86 h SER 19 N 1.65 0.80 -0.64 0.00 4.64 -2.00 -1.62 113.55 116.38 3k86 h SER 19 Ca -0.48 -0.01 0.02 0.00 -0.47 0.00 0.00 61.79 60.85 3k86 h SER 19 Cb 1.31 -0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 63.18 3k86 h SER 19 CO 0.58 0.54 0.41 0.15 -0.87 0.00 0.00 176.83 177.63 3k86 h PHE 20 N 0.92 0.77 -0.51 4.77 3.57 -2.00 -1.46 116.94 123.00 3k86 h PHE 20 Ca 0.31 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.84 3k86 h PHE 20 Cb 0.10 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 38.56 3k86 h PHE 20 CO -0.00 0.45 0.34 -0.44 -2.23 0.00 0.00 178.31 176.43 3k86 h ASP 21 N 0.81 0.59 -0.23 0.41 3.32 -1.68 -1.37 116.42 118.26 3k86 h ASP 21 Ca 0.25 -0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.31 3k86 h ASP 21 Cb -0.02 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.36 3k86 h ASP 21 CO -0.08 0.43 0.07 0.15 -1.72 0.00 0.00 179.24 178.09 3k86 h PHE 22 N 0.69 0.13 -0.68 4.55 3.04 -1.11 -0.59 116.94 122.97 3k86 h PHE 22 Ca 0.19 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 62.11 3k86 h PHE 22 Cb -0.08 -0.03 -0.03 0.00 2.56 0.00 0.00 35.95 38.38 3k86 h PHE 22 CO -0.04 0.06 0.29 0.00 -2.02 0.00 0.00 178.31 176.60 3k86 h ARG 23 N 0.18 1.01 -0.28 1.11 3.08 -1.06 -1.53 114.38 116.88 3k86 h ARG 23 Ca 0.10 -0.18 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 3k86 h ARG 23 Cb 0.07 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 3k86 h ARG 23 CO -0.11 0.83 0.17 0.22 -1.07 0.00 0.00 179.97 180.01 3k86 h ASP 24 N 0.96 0.34 -0.57 7.04 -0.00 -0.92 -2.59 116.42 120.68 3k86 h ASP 24 Ca 0.23 -0.06 0.05 0.00 -0.00 0.00 0.00 57.03 57.25 3k86 h ASP 24 Cb 0.19 -0.09 -0.05 0.00 -0.00 0.00 0.00 39.33 39.38 3k86 h ASP 24 CO -0.02 0.30 0.31 0.00 -0.00 0.00 0.00 179.24 179.82 3k86 h ALA 25 N 1.06 0.75 -0.29 -0.78 0.00 -0.84 -1.78 119.26 117.36 3k86 h ALA 25 Ca 0.10 0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.07 3k86 h ALA 25 Cb 0.02 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3k86 h ALA 25 CO -0.02 -0.03 0.20 -0.07 0.00 0.00 0.00 179.25 179.34 3k86 h LEU 26 N 0.58 0.19 -1.91 0.00 3.38 -0.91 -1.13 115.31 115.51 3k86 h LEU 26 Ca 0.25 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 3k86 h LEU 26 Cb 0.15 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 3k86 h LEU 26 CO -0.16 0.13 -0.03 0.77 0.09 0.00 0.00 178.44 179.24 3k86 h SER 27 N 0.22 0.00 0.41 -0.43 4.64 -1.00 -1.39 113.55 116.01 3k86 h SER 27 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3k86 h SER 27 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 3k86 h SER 27 CO -0.02 0.03 -0.36 0.29 -0.87 0.00 0.00 176.83 175.90 3k86 n LYS 28 N -3.17 0.36 -2.36 4.77 5.02 -0.43 -0.81 118.16 121.54 3k86 n LYS 28 Ca -0.01 -0.20 -0.24 0.00 -2.02 0.00 0.00 58.31 55.84 3k86 n LYS 28 Cb 0.24 -1.50 0.08 0.00 -0.02 0.00 0.00 35.03 33.83 3k86 n LYS 28 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3k86 s ALA 29 N -2.78 3.37 0.23 7.82 0.00 -0.52 -4.88 121.76 125.01 3k86 s ALA 29 Ca 0.17 -1.18 0.10 0.00 0.00 0.00 0.00 51.96 51.05 3k86 s ALA 29 Cb 0.18 -2.38 -0.05 0.00 0.00 0.00 0.00 23.12 20.88 3k86 s ALA 29 CO 0.61 -1.27 -0.18 -1.54 0.00 0.00 0.00 175.76 173.38 3k86 s SER 30 N -4.56 3.11 0.02 0.00 1.04 -1.26 -4.37 113.70 107.68 3k86 s SER 30 Ca 0.61 -1.00 -0.05 0.00 0.48 0.00 0.00 55.95 56.00 3k86 s SER 30 Cb -0.09 -0.22 -0.01 0.00 0.10 0.00 0.00 66.02 65.80 3k86 s SER 30 CO 0.44 -0.04 0.08 0.42 0.98 0.00 0.00 173.24 175.12 3k86 s THR 31 N -2.57 0.11 0.61 2.02 -4.23 -0.63 -4.99 115.64 105.95 3k86 s THR 31 Ca 0.25 -0.93 -0.16 0.00 -1.18 0.00 0.00 61.69 59.67 3k86 s THR 31 Cb -0.04 -0.62 -0.03 0.00 1.34 0.00 0.00 72.50 73.16 3k86 s THR 31 CO 0.11 -0.51 1.09 -2.16 -0.54 0.00 0.00 174.62 172.61 3k86 s PRO 32 N -1.97 3.12 -0.21 3.99 0.04 -1.26 -0.41 135.00 138.30 3k86 s PRO 32 Ca -0.10 1.37 -0.15 0.00 0.04 0.00 0.00 61.00 62.16 3k86 s PRO 32 Cb -0.05 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 3k86 s PRO 32 CO -0.02 -0.99 0.34 0.08 0.04 0.00 0.00 177.00 176.45 3k86 s VAL 33 N -2.25 5.23 0.25 -0.36 1.01 -0.05 -4.71 120.40 119.53 3k86 s VAL 33 Ca 0.67 0.58 0.10 0.00 0.00 0.00 0.00 61.98 63.32 3k86 s VAL 33 Cb -0.19 -3.67 -0.05 0.00 0.00 0.00 0.00 36.38 32.46 3k86 s VAL 33 CO 0.36 0.27 -0.16 0.42 0.00 0.00 0.00 175.10 175.98 3k86 s THR 34 N 1.30 2.13 -0.09 3.92 -4.23 -1.15 -1.60 115.64 115.91 3k86 s THR 34 Ca 0.16 -2.31 0.03 0.00 -1.18 0.00 0.00 61.69 58.40 3k86 s THR 34 Cb -0.14 -2.22 -0.01 0.00 1.34 0.00 0.00 72.50 71.46 3k86 s THR 34 CO 0.07 -0.46 -0.20 -0.69 -0.54 0.00 0.00 174.62 172.80 3k86 s VAL 35 N -2.73 2.42 -0.20 2.29 1.01 -0.33 -1.08 120.40 121.78 3k86 s VAL 35 Ca 0.27 -0.91 -0.07 0.00 0.00 0.00 0.00 61.98 61.28 3k86 s VAL 35 Cb -0.02 -1.95 -0.03 0.00 0.00 0.00 0.00 36.38 34.38 3k86 s VAL 35 CO 0.12 0.56 0.05 -0.69 0.00 0.00 0.00 175.10 175.13 3k86 s VAL 36 N 0.12 4.45 0.17 2.92 1.01 0.12 -1.20 120.40 127.98 3k86 s VAL 36 Ca -0.10 -0.15 0.06 0.00 0.00 0.00 0.00 61.98 61.79 3k86 s VAL 36 Cb -0.16 -3.02 -0.05 0.00 0.00 0.00 0.00 36.38 33.16 3k86 s VAL 36 CO 0.06 0.42 -0.12 0.00 0.00 0.00 0.00 175.10 175.47 3k86 s ALA 37 N 0.80 1.67 0.16 5.51 0.00 -0.71 -0.98 121.76 128.21 3k86 s ALA 37 Ca 0.03 -1.56 -0.10 0.00 0.00 0.00 0.00 51.96 50.32 3k86 s ALA 37 Cb -0.14 0.00 -0.00 0.00 0.00 0.00 0.00 23.12 22.99 3k86 s ALA 37 CO 0.02 -0.04 0.31 -0.08 0.00 0.00 0.00 175.76 175.97 3k86 s THR 38 N -3.20 0.07 0.15 0.00 -1.32 0.49 -0.47 115.64 111.37 3k86 s THR 38 Ca 0.19 -1.24 -0.19 0.00 -1.21 0.00 0.00 61.69 59.24 3k86 s THR 38 Cb 0.01 -1.71 0.05 0.00 -1.51 0.00 0.00 72.50 69.34 3k86 s THR 38 CO 0.03 -0.32 0.51 0.21 -2.21 0.00 0.00 174.62 172.85 3k86 s ASN 39 N -2.93 -0.39 0.00 8.08 3.04 -1.26 -2.48 114.94 119.00 3k86 s ASN 39 Ca 0.14 -0.21 0.00 0.00 0.04 0.00 0.00 52.86 52.83 3k86 s ASN 39 Cb 0.03 0.55 0.00 0.00 -1.54 0.00 0.00 41.25 40.29 3k86 s ASN 39 CO -0.02 -0.95 0.00 0.61 -3.04 0.00 0.00 177.10 173.70 3k86 n GLY 40 N -0.32 -0.35 0.31 1.21 0.00 -1.23 -4.47 105.19 100.34 3k86 n GLY 40 Ca -0.15 -1.26 0.17 0.00 0.00 0.00 0.00 46.02 44.77 3k86 n GLY 40 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3k86 h PRO 41 N 0.19 0.00 -0.10 1.61 0.11 -1.93 0.22 132.00 132.09 3k86 h PRO 41 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3k86 h PRO 41 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3k86 h PRO 41 CO 0.00 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 178.98 3k86 n PHE 42 N -3.71 0.11 0.00 0.65 3.01 -1.26 -5.05 117.46 111.21 3k86 n PHE 42 Ca -0.02 -0.05 0.00 0.00 1.01 0.00 0.00 57.45 58.38 3k86 n PHE 42 Cb 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.60 3k86 n PHE 42 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3k86 n GLY 43 N 1.25 -2.19 3.85 1.37 0.00 0.06 -4.93 105.19 104.61 3k86 n GLY 43 Ca 0.17 -2.17 -0.37 0.00 0.00 0.00 0.00 46.02 43.66 3k86 n GLY 43 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3k86 s LEU 44 N 0.00 4.42 -0.08 0.99 2.96 -1.26 -3.58 118.68 122.13 3k86 s LEU 44 Ca 0.00 0.81 -0.30 0.00 -0.22 0.00 0.00 54.13 54.42 3k86 s LEU 44 Cb 0.00 -2.60 0.12 0.00 0.50 0.00 0.00 46.19 44.20 3k86 s LEU 44 CO 0.00 0.30 0.96 0.00 -1.32 0.00 0.00 176.35 176.29 3k86 s ALA 45 N -1.17 -1.89 0.19 5.97 0.00 -1.04 -4.74 121.76 119.08 3k86 s ALA 45 Ca 0.25 1.29 -0.23 0.00 0.00 0.00 0.00 51.96 53.27 3k86 s ALA 45 Cb -0.15 -0.05 0.05 0.00 0.00 0.00 0.00 23.12 22.97 3k86 s ALA 45 CO 0.13 -0.54 0.74 0.20 0.00 0.00 0.00 175.76 176.29 3k86 s GLY 46 N -1.95 -0.32 0.13 0.00 0.00 -1.26 -0.38 107.32 103.54 3k86 s GLY 46 Ca 0.03 0.16 -0.22 0.00 0.00 0.00 0.00 44.72 44.68 3k86 s GLY 46 CO -0.05 0.05 0.56 0.48 0.00 0.00 0.00 173.10 174.14 3k86 s LEU 47 N -2.82 -0.34 0.36 0.66 2.34 -0.15 -4.84 118.68 113.88 3k86 s LEU 47 Ca 0.07 0.01 -0.26 0.00 0.06 0.00 0.00 54.13 54.02 3k86 s LEU 47 Cb -0.03 2.40 -0.09 0.00 -0.56 0.00 0.00 46.19 47.91 3k86 s LEU 47 CO -0.02 -0.90 1.07 0.28 -1.06 0.00 0.00 176.35 175.72 3k86 s THR 48 N -3.43 3.63 -0.08 5.48 -1.32 -0.72 -0.70 115.64 118.49 3k86 s THR 48 Ca -0.00 1.36 -0.03 0.00 -1.21 0.00 0.00 61.69 61.81 3k86 s THR 48 Cb -0.00 -3.76 0.04 0.00 -1.51 0.00 0.00 72.50 67.27 3k86 s THR 48 CO -0.10 0.12 0.15 0.00 -2.21 0.00 0.00 174.62 172.57 3k86 n SER 50 N 5.13 4.26 -3.60 0.00 3.41 -1.26 -2.93 113.62 118.63 3k86 n SER 50 Ca -0.08 -2.44 -0.28 0.00 -0.26 0.00 0.00 58.87 55.81 3k86 n SER 50 Cb 0.50 -0.51 -0.12 0.00 -0.26 0.00 0.00 64.21 63.83 3k86 n SER 50 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k86 s ALA 51 N -1.81 2.09 0.02 7.33 0.00 -1.26 -4.87 121.76 123.26 3k86 s ALA 51 Ca 0.44 -2.73 0.01 0.00 0.00 0.00 0.00 51.96 49.69 3k86 s ALA 51 Cb 0.29 -1.81 -0.01 0.00 0.00 0.00 0.00 23.12 21.59 3k86 s ALA 51 CO 0.21 -2.04 -0.05 0.14 0.00 0.00 0.00 175.76 174.02 3k86 s VAL 52 N -0.07 0.30 0.21 0.00 -7.23 -1.26 -1.32 120.40 111.03 3k86 s VAL 52 Ca 0.25 -0.60 -0.19 0.00 -1.81 0.00 0.00 61.98 59.63 3k86 s VAL 52 Cb -0.09 -0.34 0.03 0.00 0.56 0.00 0.00 36.38 36.53 3k86 s VAL 52 CO -0.11 -0.20 0.58 0.00 -0.31 0.00 0.00 175.10 175.06 3k86 s SER 54 N -2.87 6.89 -0.04 0.00 1.04 -1.26 -0.95 113.70 116.51 3k86 s SER 54 Ca 0.09 1.30 -0.09 0.00 0.48 0.00 0.00 55.95 57.74 3k86 s SER 54 Cb -0.02 -2.38 -0.03 0.00 0.10 0.00 0.00 66.02 63.69 3k86 s SER 54 CO -0.01 -0.07 -0.17 0.52 0.98 0.00 0.00 173.24 174.48 3k86 n VAL 55 N 0.22 1.36 -3.74 5.02 0.31 0.86 -4.87 118.33 117.50 3k86 n VAL 55 Ca 0.00 0.28 -0.10 0.00 -0.01 0.00 0.00 64.34 64.51 3k86 n VAL 55 Cb 0.52 -1.96 -0.04 0.00 -0.91 0.00 0.00 33.84 31.45 3k86 n VAL 55 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3k86 n ASP 57 N -0.34 2.51 -3.40 0.00 5.68 -1.26 -1.49 116.55 118.26 3k86 n ASP 57 Ca -0.10 -1.75 -0.15 0.00 -0.50 0.00 0.00 54.79 52.29 3k86 n ASP 57 Cb 0.62 -0.01 -0.10 0.00 -1.14 0.00 0.00 41.12 40.50 3k86 n ASP 57 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 3k86 s ARG 58 N -1.49 0.31 0.56 0.11 3.00 -1.26 -2.38 118.95 117.80 3k86 s ARG 58 Ca 0.21 0.11 -0.20 0.00 -1.00 0.00 0.00 55.73 54.86 3k86 s ARG 58 Cb 0.15 -0.70 -0.05 0.00 0.00 0.00 0.00 34.95 34.35 3k86 s ARG 58 CO 0.23 -0.86 1.19 -1.25 0.00 0.00 0.00 175.30 174.60 3k86 s PRO 59 N 2.42 3.18 -0.08 5.12 0.04 -1.26 -5.03 135.00 139.38 3k86 s PRO 59 Ca 0.10 1.77 -0.29 0.00 0.04 0.00 0.00 61.00 62.61 3k86 s PRO 59 Cb -0.14 -2.01 -0.06 0.00 0.04 0.00 0.00 34.50 32.33 3k86 s PRO 59 CO -0.24 -1.03 1.76 -1.25 0.04 0.00 0.00 177.00 176.27 3k86 s PRO 60 N -3.24 4.02 -0.02 0.56 0.04 -1.00 -4.67 135.00 130.69 3k86 s PRO 60 Ca 0.74 2.17 0.01 0.00 0.04 0.00 0.00 61.00 63.96 3k86 s PRO 60 Cb -0.29 -4.06 0.01 0.00 0.04 0.00 0.00 34.50 30.20 3k86 s PRO 60 CO 0.32 -1.05 -0.05 0.99 0.04 0.00 0.00 177.00 177.25 3k86 s THR 61 N 4.68 0.47 0.35 1.26 2.01 -0.55 -0.69 115.64 123.16 3k86 s THR 61 Ca 0.78 -0.18 0.09 0.00 0.31 0.00 0.00 61.69 62.69 3k86 s THR 61 Cb -0.34 -0.44 -0.06 0.00 0.01 0.00 0.00 72.50 71.67 3k86 s THR 61 CO 0.32 0.16 -0.05 0.68 -0.69 0.00 0.00 174.62 175.05 3k86 s VAL 62 N 0.30 2.32 0.12 3.82 -7.23 -0.30 -0.09 120.40 119.33 3k86 s VAL 62 Ca -0.03 -2.11 0.05 0.00 -1.81 0.00 0.00 61.98 58.07 3k86 s VAL 62 Cb -0.07 -2.73 -0.04 0.00 0.56 0.00 0.00 36.38 34.09 3k86 s VAL 62 CO -0.00 -0.17 -0.12 -1.48 -0.31 0.00 0.00 175.10 173.02 3k86 s LEU 63 N -3.66 2.44 -0.02 1.32 0.05 -0.12 -0.56 118.68 118.14 3k86 s LEU 63 Ca 0.34 -0.87 -0.07 0.00 0.05 0.00 0.00 54.13 53.57 3k86 s LEU 63 Cb 0.03 -0.41 0.01 0.00 -2.05 0.00 0.00 46.19 43.76 3k86 s LEU 63 CO 0.18 -0.24 0.15 -1.48 -0.55 0.00 0.00 176.35 174.41 3k86 s LEU 64 N -2.68 1.48 -0.16 1.48 0.05 -0.39 -1.74 118.68 116.73 3k86 s LEU 64 Ca 0.10 -0.06 0.00 0.00 0.05 0.00 0.00 54.13 54.23 3k86 s LEU 64 Cb -0.02 0.67 0.00 0.00 -2.05 0.00 0.00 46.19 44.79 3k86 s LEU 64 CO 0.01 -0.29 -0.15 0.00 -0.55 0.00 0.00 176.35 175.37 3k86 s ILE 66 N 0.91 0.62 0.07 0.00 -4.36 -0.61 -4.61 121.20 113.21 3k86 s ILE 66 Ca -0.04 -0.78 -0.31 0.00 -0.26 0.00 0.00 60.65 59.27 3k86 s ILE 66 Cb -0.15 -0.61 -0.08 0.00 1.25 0.00 0.00 42.46 42.87 3k86 s ILE 66 CO -0.02 -0.13 1.57 0.21 0.24 0.00 0.00 174.94 176.81 3k86 s ASN 67 N -1.00 6.67 0.58 4.36 3.84 -1.26 -0.58 114.94 127.54 3k86 s ASN 67 Ca -0.04 2.41 0.28 0.00 0.21 0.00 0.00 52.86 55.72 3k86 s ASN 67 Cb -0.07 -2.57 1.67 0.00 -0.55 0.00 0.00 41.25 39.73 3k86 s ASN 67 CO 0.00 -0.83 2.16 0.03 -2.79 0.00 0.00 177.10 175.68 3k86 h ARG 68 N 7.90 0.00 0.00 0.43 3.08 -1.62 -1.59 114.38 122.59 3k86 h ARG 68 Ca -0.42 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.63 3k86 h ARG 68 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.25 3k86 h ARG 68 CO 0.92 0.00 0.00 1.63 -1.07 0.00 0.00 179.97 181.45 3k86 n LYS 69 N -3.93 0.01 -2.02 0.04 4.01 -1.26 -4.65 118.16 110.37 3k86 n LYS 69 Ca -0.00 0.18 -0.39 0.00 -0.51 0.00 0.00 58.31 57.59 3k86 n LYS 69 Cb 0.21 -1.52 -0.00 0.00 -0.51 0.00 0.00 35.03 33.21 3k86 n LYS 69 CO 0.00 0.00 0.00 -1.12 -1.11 0.00 0.00 177.40 175.17 3k86 s SER 70 N -3.08 6.24 0.23 4.39 0.01 -0.60 -4.90 113.70 115.99 3k86 s SER 70 Ca 0.09 2.69 -0.07 0.00 1.31 0.00 0.00 55.95 59.96 3k86 s SER 70 Cb 0.12 -2.64 0.27 0.00 0.21 0.00 0.00 66.02 63.99 3k86 s SER 70 CO 0.35 -0.90 1.85 0.22 0.41 0.00 0.00 173.24 175.17 3k86 h TYR 71 N 2.61 0.90 0.00 2.43 3.20 -1.90 -2.22 116.97 121.99 3k86 h TYR 71 Ca -0.50 0.03 -0.08 0.00 3.14 0.00 0.00 58.73 61.32 3k86 h TYR 71 Cb 1.25 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 39.22 3k86 h TYR 71 CO 0.53 0.47 -0.36 0.00 -1.64 0.00 0.00 178.16 177.16 3k86 h ALA 72 N 1.36 1.33 -0.38 1.82 0.00 -1.90 -3.30 119.26 118.19 3k86 h ALA 72 Ca 0.34 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3k86 h ALA 72 Cb 0.12 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 3k86 h ALA 72 CO -0.15 0.45 0.07 0.00 0.00 0.00 0.00 179.25 179.61 3k86 h ALA 73 N 1.64 0.51 -0.65 0.00 0.00 -1.68 -0.25 119.26 118.83 3k86 h ALA 73 Ca -0.00 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 3k86 h ALA 73 Cb 0.67 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 3k86 h ALA 73 CO 0.05 0.21 0.06 0.78 0.00 0.00 0.00 179.25 180.35 3k86 h GLY 74 N 0.48 1.19 0.89 0.00 0.00 -1.65 -1.33 103.07 102.64 3k86 h GLY 74 Ca 0.12 -0.83 -0.02 0.00 0.00 0.00 0.00 47.33 46.60 3k86 h GLY 74 CO 0.01 0.77 0.08 -2.22 0.00 0.00 0.00 176.54 175.17 3k86 h ILE 75 N 1.02 1.18 -0.29 2.60 1.08 -1.57 -0.23 117.51 121.30 3k86 h ILE 75 Ca 0.19 -0.56 0.06 0.00 -0.39 0.00 0.00 64.86 64.16 3k86 h ILE 75 Cb 0.50 1.13 -0.06 0.00 -3.07 0.00 0.00 36.82 35.32 3k86 h ILE 75 CO 0.02 0.18 -0.08 0.40 -0.69 0.00 0.00 178.15 177.98 3k86 h ILE 76 N 0.20 0.69 -0.31 -0.67 2.04 -0.95 -0.38 117.51 118.14 3k86 h ILE 76 Ca 0.07 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.79 3k86 h ILE 76 Cb 0.21 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 3k86 h ILE 76 CO -0.00 0.00 -0.38 0.11 0.00 0.00 0.00 178.15 177.87 3k86 h LYS 77 N -0.02 0.73 -0.12 2.37 1.57 -1.01 -1.56 116.57 118.54 3k86 h LYS 77 Ca 0.14 -0.37 -0.15 0.00 -1.87 0.00 0.00 60.65 58.40 3k86 h LYS 77 Cb 0.23 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 3k86 h LYS 77 CO -0.30 0.99 -0.58 0.77 -0.57 0.00 0.00 179.45 179.75 3k86 h SER 78 N 0.60 0.42 0.05 0.86 0.02 -0.96 -3.04 113.55 111.50 3k86 h SER 78 Ca 0.05 -0.23 -0.11 0.00 -0.84 0.00 0.00 61.79 60.66 3k86 h SER 78 Cb 0.92 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.33 3k86 h SER 78 CO 0.08 0.91 -0.35 0.78 -1.14 0.00 0.00 176.83 177.12 3k86 h ASN 79 N 0.28 0.43 0.00 3.07 2.35 -0.91 -3.47 115.58 117.32 3k86 h ASN 79 Ca -0.00 -0.17 0.00 0.00 -0.55 0.00 0.00 56.30 55.58 3k86 h ASN 79 Cb 1.10 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 39.35 3k86 h ASN 79 CO 0.10 0.75 0.00 0.61 -1.65 0.00 0.00 177.43 177.23 3k86 n GLY 80 N -0.22 0.92 3.09 2.83 0.00 -0.60 -4.92 105.19 106.28 3k86 n GLY 80 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 3k86 n GLY 80 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k86 s VAL 81 N -3.69 0.44 0.08 1.61 -7.23 -1.26 -1.11 120.40 109.24 3k86 s VAL 81 Ca 0.00 -1.46 -0.26 0.00 -1.81 0.00 0.00 61.98 58.45 3k86 s VAL 81 Cb 0.00 -1.06 0.08 0.00 0.56 0.00 0.00 36.38 35.96 3k86 s VAL 81 CO 0.00 -0.68 0.82 -1.48 -0.31 0.00 0.00 175.10 173.45 3k86 s LEU 82 N -2.28 -0.38 0.14 1.32 0.05 -0.44 -4.55 118.68 112.54 3k86 s LEU 82 Ca -0.01 -0.10 0.10 0.00 0.05 0.00 0.00 54.13 54.17 3k86 s LEU 82 Cb -0.02 2.22 -0.04 0.00 -2.05 0.00 0.00 46.19 46.31 3k86 s LEU 82 CO -0.04 -0.79 -0.20 -0.94 -0.55 0.00 0.00 176.35 173.83 3k86 s SER 83 N -2.65 3.73 -0.16 1.48 1.04 0.38 -0.54 113.70 116.98 3k86 s SER 83 Ca 0.06 -0.66 0.00 0.00 0.48 0.00 0.00 55.95 55.82 3k86 s SER 83 Cb -0.01 -0.44 0.00 0.00 0.10 0.00 0.00 66.02 65.66 3k86 s SER 83 CO -0.07 0.16 -0.16 -0.69 0.98 0.00 0.00 173.24 173.46 3k86 s VAL 84 N -1.31 2.61 -0.25 5.02 1.01 -0.26 -1.73 120.40 125.49 3k86 s VAL 84 Ca 0.19 -0.78 0.02 0.00 0.00 0.00 0.00 61.98 61.40 3k86 s VAL 84 Cb -0.10 -2.10 0.06 0.00 0.00 0.00 0.00 36.38 34.24 3k86 s VAL 84 CO 0.10 0.51 -0.06 0.20 0.00 0.00 0.00 175.10 175.85 3k86 s ASN 85 N 0.88 4.15 -0.33 3.32 0.01 -0.34 -1.11 114.94 121.51 3k86 s ASN 85 Ca -0.04 -1.35 -0.27 0.00 -0.71 0.00 0.00 52.86 50.49 3k86 s ASN 85 Cb -0.15 -1.34 0.01 0.00 0.41 0.00 0.00 41.25 40.18 3k86 s ASN 85 CO -0.01 -0.23 0.99 0.26 -1.51 0.00 0.00 177.10 176.59 3k86 s TRP 86 N 1.25 3.13 0.50 2.20 0.51 0.14 -1.19 118.94 125.49 3k86 s TRP 86 Ca -0.05 1.02 -0.18 0.00 -2.12 0.00 0.00 56.10 54.76 3k86 s TRP 86 Cb -0.19 -3.62 -0.08 0.00 -0.81 0.00 0.00 33.47 28.77 3k86 s TRP 86 CO -0.06 -0.76 1.00 -0.51 -0.51 0.00 0.00 176.95 176.11 3k86 s LEU 87 N 3.51 3.74 0.48 2.99 1.43 -0.63 -0.80 118.68 129.39 3k86 s LEU 87 Ca 0.41 1.73 0.01 0.00 -1.03 0.00 0.00 54.13 55.25 3k86 s LEU 87 Cb -0.12 -4.53 0.01 0.00 0.03 0.00 0.00 46.19 41.57 3k86 s LEU 87 CO 0.16 -0.68 0.70 0.00 0.23 0.00 0.00 176.35 176.76 3k86 s ALA 88 N -2.32 3.79 0.44 4.21 0.00 -1.26 -1.63 121.76 124.99 3k86 s ALA 88 Ca 0.63 -1.13 0.19 0.00 0.00 0.00 0.00 51.96 51.65 3k86 s ALA 88 Cb -0.12 -2.12 1.13 0.00 0.00 0.00 0.00 23.12 22.01 3k86 s ALA 88 CO 0.25 -0.47 1.89 0.00 0.00 0.00 0.00 175.76 177.43 3k86 h ALA 89 N 0.31 2.26 -0.07 0.00 0.00 -0.92 -0.35 119.26 120.49 3k86 h ALA 89 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3k86 h ALA 89 Cb 1.26 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3k86 h ALA 89 CO 0.56 -0.50 0.00 0.41 0.00 0.00 0.00 179.25 179.72 3k86 n GLY 90 N -1.55 -0.60 1.04 0.00 0.00 -1.26 -4.23 105.19 98.59 3k86 n GLY 90 Ca 0.17 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3k86 n GLY 90 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3k86 n GLN 91 N -0.34 2.15 0.01 1.61 6.02 -0.14 -4.62 117.38 122.06 3k86 n GLN 91 Ca 0.08 -3.05 0.16 0.00 -0.01 0.00 0.00 57.00 54.18 3k86 n GLN 91 Cb 0.10 -1.81 0.62 0.00 1.02 0.00 0.00 30.24 30.16 3k86 n GLN 91 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3k86 h ALA 92 N 1.19 2.26 -0.22 -1.58 0.00 -1.78 -1.34 119.26 117.79 3k86 h ALA 92 Ca 0.15 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 3k86 h ALA 92 Cb 1.58 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.34 3k86 h ALA 92 CO 0.33 -0.39 -0.18 -0.39 0.00 0.00 0.00 179.25 178.62 3k86 h VAL 93 N 0.14 1.23 -0.27 0.00 -1.51 -1.96 0.19 116.25 114.07 3k86 h VAL 93 Ca 0.23 -1.04 -0.02 0.00 -1.23 0.00 0.00 66.70 64.63 3k86 h VAL 93 Cb 0.71 1.26 -0.01 0.00 -2.13 0.00 0.00 31.29 31.12 3k86 h VAL 93 CO -0.03 0.33 0.08 0.40 -1.23 0.00 0.00 177.57 177.12 3k86 h ILE 94 N 0.35 1.20 -0.05 7.19 2.04 -1.61 -0.83 117.51 125.81 3k86 h ILE 94 Ca 0.06 -0.66 0.03 0.00 1.00 0.00 0.00 64.86 65.30 3k86 h ILE 94 Cb 0.52 1.12 -0.04 0.00 -0.74 0.00 0.00 36.82 37.68 3k86 h ILE 94 CO 0.03 0.22 -0.20 -1.28 0.00 0.00 0.00 178.15 176.92 3k86 h SER 95 N 0.27 -0.60 -0.13 1.72 0.87 -1.26 -1.18 113.55 113.24 3k86 h SER 95 Ca 0.09 0.09 0.05 0.00 -1.23 0.00 0.00 61.79 60.79 3k86 h SER 95 Cb 0.25 0.26 -0.06 0.00 -0.44 0.00 0.00 62.40 62.41 3k86 h SER 95 CO -0.00 -0.26 -0.32 1.56 -0.53 0.00 0.00 176.83 177.28 3k86 h GLN 96 N -0.30 -0.38 -0.84 2.24 1.08 -0.87 -0.99 115.11 115.05 3k86 h GLN 96 Ca 0.07 0.03 0.17 0.00 -1.45 0.00 0.00 58.65 57.47 3k86 h GLN 96 Cb 0.40 0.09 -0.10 0.00 -0.05 0.00 0.00 27.48 27.81 3k86 h GLN 96 CO -0.22 -0.25 0.39 1.15 -0.95 0.00 0.00 178.83 178.95 3k86 h THR 97 N -0.39 0.63 -0.01 -0.54 2.02 -0.87 -1.18 112.91 112.57 3k86 h THR 97 Ca 0.10 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.10 3k86 h THR 97 Cb 0.54 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.03 3k86 h THR 97 CO -0.35 0.09 -0.03 0.49 0.37 0.00 0.00 175.52 176.09 3k86 n PHE 98 N -4.96 0.00 0.70 3.16 3.72 -0.47 -2.17 117.46 117.44 3k86 n PHE 98 Ca 0.18 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.70 3k86 n PHE 98 Cb 0.50 -0.03 0.21 0.00 -0.94 0.00 0.00 39.48 39.22 3k86 n PHE 98 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3k86 n ALA 99 N -0.22 2.45 -0.31 4.37 0.00 -0.43 -1.76 120.51 124.61 3k86 n ALA 99 Ca 0.19 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.81 3k86 n ALA 99 Cb 0.30 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.86 3k86 n ALA 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k86 n GLY 100 N 1.40 0.76 3.67 0.00 0.00 -0.92 -5.03 105.19 105.08 3k86 n GLY 100 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3k86 n GLY 100 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k86 s VAL 101 N -2.28 3.16 0.00 1.61 1.01 -0.50 -1.96 120.40 121.45 3k86 s VAL 101 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 61.98 62.39 3k86 s VAL 101 Cb 0.00 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 33.11 3k86 s VAL 101 CO 0.00 -0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.69 3k86 n GLY 102 N 4.18 0.73 3.81 4.51 0.00 -1.26 -4.34 105.19 112.82 3k86 n GLY 102 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 3k86 n GLY 102 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3k86 n SER 103 N 0.00 -3.41 -4.71 1.61 7.64 -0.83 -4.86 113.62 109.07 3k86 n SER 103 Ca 0.00 -0.70 -0.42 0.00 1.01 0.00 0.00 58.87 58.76 3k86 n SER 103 Cb 0.00 -2.81 -0.03 0.00 -1.01 0.00 0.00 64.21 60.36 3k86 n SER 103 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3k86 s VAL 104 N -3.08 2.75 0.48 0.44 1.01 -1.26 -4.92 120.40 115.82 3k86 s VAL 104 Ca 0.58 0.49 -0.24 0.00 0.00 0.00 0.00 61.98 62.82 3k86 s VAL 104 Cb -0.31 -3.31 -0.08 0.00 0.00 0.00 0.00 36.38 32.67 3k86 s VAL 104 CO 0.71 0.03 1.28 -2.65 0.00 0.00 0.00 175.10 174.48 3k86 n PRO 105 N 4.28 1.79 0.08 2.72 -0.02 -1.26 -4.78 135.00 137.81 3k86 n PRO 105 Ca 0.14 0.65 -0.12 0.00 -2.02 0.00 0.00 63.50 62.15 3k86 n PRO 105 Cb 0.39 -2.45 -0.05 0.00 -0.02 0.00 0.00 33.50 31.37 3k86 n PRO 105 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 3k86 h MET 106 N 1.75 -0.43 -0.96 -0.52 4.05 -1.93 -1.73 114.93 115.15 3k86 h MET 106 Ca -0.49 0.03 0.07 0.00 -0.28 0.00 0.00 59.70 59.03 3k86 h MET 106 Cb 1.30 0.10 -0.06 0.00 -0.80 0.00 0.00 31.60 32.14 3k86 h MET 106 CO 0.58 -0.29 0.62 0.93 0.23 0.00 0.00 176.91 178.99 3k86 h GLU 107 N -0.45 1.08 -0.02 0.39 5.08 -1.90 -1.83 114.58 116.93 3k86 h GLU 107 Ca 0.05 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 3k86 h GLU 107 Cb 0.51 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 3k86 h GLU 107 CO -0.21 0.71 -0.27 1.49 -1.00 0.00 0.00 179.01 179.74 3k86 h GLU 108 N 1.11 0.04 -0.50 2.33 4.81 -1.70 -1.70 114.58 118.96 3k86 h GLU 108 Ca 0.42 -0.01 0.15 0.00 -0.13 0.00 0.00 59.36 59.78 3k86 h GLU 108 Cb 0.19 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 3k86 h GLU 108 CO -0.16 0.30 0.42 0.00 -0.73 0.00 0.00 179.01 178.84 3k86 h ARG 109 N 0.03 0.00 -0.42 1.92 3.08 -0.57 -1.80 114.38 116.63 3k86 h ARG 109 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3k86 h ARG 109 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 3k86 h ARG 109 CO 0.04 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.13 3k86 n PHE 110 N -4.10 0.54 0.00 3.04 3.72 -0.64 -4.51 117.46 115.51 3k86 n PHE 110 Ca 0.09 -0.27 -0.04 0.00 -0.05 0.00 0.00 57.45 57.18 3k86 n PHE 110 Cb 0.63 0.00 0.18 0.00 -0.94 0.00 0.00 39.48 39.35 3k86 n PHE 110 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3k86 h ALA 111 N 4.50 1.06 -2.78 4.37 0.00 -1.34 -3.44 119.26 121.64 3k86 h ALA 111 Ca 0.00 -0.35 -0.55 0.00 0.00 0.00 0.00 54.91 54.01 3k86 h ALA 111 Cb 0.98 -0.13 0.10 0.00 0.00 0.00 0.00 17.79 18.75 3k86 h ALA 111 CO 0.00 0.57 0.76 -3.47 0.00 0.00 0.00 179.25 177.11 3k86 n ASP 112 N -4.12 3.61 0.00 0.00 -0.08 -1.26 -4.89 116.55 109.81 3k86 n ASP 112 Ca -0.00 1.19 0.13 0.00 -1.51 0.00 0.00 54.79 54.60 3k86 n ASP 112 Cb 0.41 -1.58 0.73 0.00 2.34 0.00 0.00 41.12 43.02 3k86 n ASP 112 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 3k86 n LYS 113 N 1.16 0.59 0.11 -0.67 5.02 -1.26 -2.07 118.16 121.03 3k86 n LYS 113 Ca 0.05 0.02 0.11 0.00 -2.02 0.00 0.00 58.31 56.47 3k86 n LYS 113 Cb 0.37 -1.50 0.46 0.00 -0.02 0.00 0.00 35.03 34.34 3k86 n LYS 113 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3k86 n GLY 114 N 0.83 -1.27 3.61 0.72 0.00 -1.26 -4.50 105.19 103.32 3k86 n GLY 114 Ca 0.16 0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 3k86 n GLY 114 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3k86 s TRP 115 N -3.25 3.26 0.11 1.61 0.52 -0.88 -0.96 118.94 119.35 3k86 s TRP 115 Ca 0.05 0.60 0.00 0.00 0.02 0.00 0.00 56.10 56.77 3k86 s TRP 115 Cb 0.10 -2.71 -0.04 0.00 -1.15 0.00 0.00 33.47 29.67 3k86 s TRP 115 CO 0.39 -0.28 -0.01 -0.65 0.02 0.00 0.00 176.95 176.42 3k86 s GLN 116 N 2.28 0.85 0.51 4.98 -0.21 -0.31 -4.87 119.66 122.89 3k86 s GLN 116 Ca 0.20 -1.37 -0.07 0.00 0.02 0.00 0.00 55.36 54.14 3k86 s GLN 116 Cb -0.16 0.03 -0.04 0.00 1.00 0.00 0.00 33.01 33.84 3k86 s GLN 116 CO 0.09 -0.14 0.85 0.95 -2.12 0.00 0.00 175.29 174.93 3k86 s THR 117 N -3.84 4.84 0.00 -0.19 -4.23 -1.26 0.67 115.64 111.64 3k86 s THR 117 Ca 0.16 0.43 0.00 0.00 -1.18 0.00 0.00 61.69 61.10 3k86 s THR 117 Cb 0.07 -3.85 0.00 0.00 1.34 0.00 0.00 72.50 70.05 3k86 s THR 117 CO -0.03 -0.90 0.00 -0.38 -0.54 0.00 0.00 174.62 172.77 3k86 n ILE 118 N -2.30 0.00 0.00 2.99 5.41 -1.26 -4.90 119.36 119.30 3k86 n ILE 118 Ca 0.02 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.77 3k86 n ILE 118 Cb 0.55 -0.61 0.00 0.00 -0.71 0.00 0.00 39.64 38.87 3k86 n ILE 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3k86 n ALA 119 N -1.79 2.74 0.19 -1.39 0.00 -1.26 -4.85 120.51 114.14 3k86 n ALA 119 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 3k86 n ALA 119 Cb 0.00 0.45 0.12 0.00 0.00 0.00 0.00 19.45 20.01 3k86 n ALA 119 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3k86 h THR 120 N 0.00 0.03 0.00 0.00 1.35 -1.92 -3.47 112.91 108.89 3k86 h THR 120 Ca 0.00 -1.05 0.00 0.00 -0.55 0.00 0.00 66.41 64.81 3k86 h THR 120 Cb 0.89 1.88 0.00 0.00 -1.73 0.00 0.00 68.15 69.19 3k86 h THR 120 CO 0.00 0.02 0.00 0.61 -0.25 0.00 0.00 175.52 175.90 3k86 n GLY 121 N 1.13 2.55 3.77 5.82 0.00 -1.26 -5.03 105.19 112.16 3k86 n GLY 121 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 3k86 n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k86 s ALA 122 N -2.65 3.33 0.07 4.61 0.00 -1.26 -4.28 121.76 121.58 3k86 s ALA 122 Ca 0.00 1.35 -0.31 0.00 0.00 0.00 0.00 51.96 53.00 3k86 s ALA 122 Cb 0.00 -3.53 -0.08 0.00 0.00 0.00 0.00 23.12 19.51 3k86 s ALA 122 CO 0.00 -0.93 1.58 -2.14 0.00 0.00 0.00 175.76 174.27 3k86 s PRO 123 N -2.22 4.22 -0.13 0.00 0.02 -1.26 -4.35 135.00 131.29 3k86 s PRO 123 Ca 0.56 2.26 -0.02 0.00 0.02 0.00 0.00 61.00 63.82 3k86 s PRO 123 Cb -0.41 -3.51 -0.03 0.00 0.02 0.00 0.00 34.50 30.57 3k86 s PRO 123 CO 0.53 -0.67 -0.06 0.71 -0.33 0.00 0.00 177.00 177.18 3k86 s TYR 124 N 2.30 2.97 -0.57 6.54 2.02 0.21 -4.60 117.35 126.23 3k86 s TYR 124 Ca 0.71 -0.25 -0.23 0.00 -0.37 0.00 0.00 57.07 56.93 3k86 s TYR 124 Cb -0.39 -1.87 0.05 0.00 -0.40 0.00 0.00 41.96 39.36 3k86 s TYR 124 CO 0.31 0.05 0.88 0.50 -1.57 0.00 0.00 175.55 175.72 3k86 s ARG 125 N 0.01 3.22 0.53 -0.62 6.06 -1.26 -1.16 118.95 125.73 3k86 s ARG 125 Ca -0.00 -0.56 0.32 0.00 -2.50 0.00 0.00 55.73 52.98 3k86 s ARG 125 Cb -0.14 -4.11 1.23 0.00 0.06 0.00 0.00 34.95 31.99 3k86 s ARG 125 CO 0.03 -1.52 1.93 0.52 -2.50 0.00 0.00 175.30 173.77 3k86 h MET 126 N 9.31 0.00 -0.64 5.12 2.86 -1.41 -1.22 114.93 128.95 3k86 h MET 126 Ca -0.27 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 3k86 h MET 126 Cb 1.08 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.74 3k86 h MET 126 CO 1.09 0.00 0.00 -0.40 1.06 0.00 0.00 176.91 178.66 3k86 n ASP 127 N -3.08 4.61 -4.85 1.22 3.85 -1.26 -4.58 116.55 112.46 3k86 n ASP 127 Ca 0.01 -2.40 -0.31 0.00 -0.71 0.00 0.00 54.79 51.38 3k86 n ASP 127 Cb 0.34 -0.56 0.02 0.00 -1.35 0.00 0.00 41.12 39.57 3k86 n ASP 127 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3k86 s ALA 128 N -1.75 2.95 0.24 2.12 0.00 -0.46 -4.77 121.76 120.09 3k86 s ALA 128 Ca 0.50 0.02 -0.04 0.00 0.00 0.00 0.00 51.96 52.44 3k86 s ALA 128 Cb 0.32 -3.12 0.44 0.00 0.00 0.00 0.00 23.12 20.76 3k86 s ALA 128 CO 0.25 -0.82 1.76 0.00 0.00 0.00 0.00 175.76 176.95 3k86 h ALA 129 N -0.28 1.10 -3.11 0.00 0.00 -1.22 -3.39 119.26 112.37 3k86 h ALA 129 Ca -0.44 0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.37 3k86 h ALA 129 Cb 1.20 0.01 -0.28 0.00 0.00 0.00 0.00 17.79 18.72 3k86 h ALA 129 CO 0.60 -0.12 -0.47 0.08 0.00 0.00 0.00 179.25 179.34 3k86 s VAL 130 N -6.02 -0.02 -0.09 0.00 1.01 -1.07 -4.24 120.40 109.98 3k86 s VAL 130 Ca -0.12 0.07 0.00 0.00 0.00 0.00 0.00 61.98 61.93 3k86 s VAL 130 Cb 0.20 -0.35 0.02 0.00 0.00 0.00 0.00 36.38 36.25 3k86 s VAL 130 CO 0.77 0.03 -0.08 -0.55 0.00 0.00 0.00 175.10 175.27 3k86 s SER 131 N 0.65 1.86 -0.17 3.32 0.15 -1.07 0.24 113.70 118.68 3k86 s SER 131 Ca -0.04 -0.26 -0.04 0.00 0.70 0.00 0.00 55.95 56.31 3k86 s SER 131 Cb -0.06 -0.76 -0.02 0.00 -1.71 0.00 0.00 66.02 63.47 3k86 s SER 131 CO -0.04 -0.07 -0.04 -0.36 1.20 0.00 0.00 173.24 173.93 3k86 s PHE 132 N 1.32 3.00 -0.17 3.44 0.08 -0.27 -0.27 117.98 125.11 3k86 s PHE 132 Ca -0.03 -0.44 -0.16 0.00 0.12 0.00 0.00 56.93 56.42 3k86 s PHE 132 Cb -0.14 -2.00 -0.04 0.00 -0.57 0.00 0.00 43.02 40.28 3k86 s PHE 132 CO -0.03 -0.16 0.41 0.34 -0.10 0.00 0.00 175.22 175.67 3k86 s ASP 133 N 0.65 6.51 0.03 1.36 2.15 0.51 -1.10 116.67 126.78 3k86 s ASP 133 Ca -0.02 0.60 -0.02 0.00 0.43 0.00 0.00 52.55 53.54 3k86 s ASP 133 Cb -0.14 -2.24 -0.02 0.00 -0.30 0.00 0.00 42.92 40.21 3k86 s ASP 133 CO 0.02 -0.03 0.01 0.00 -0.17 0.00 0.00 175.17 175.00 3k86 s THR 135 N -2.27 4.06 0.19 0.00 -4.23 -0.71 -1.32 115.64 111.36 3k86 s THR 135 Ca -0.08 -0.34 -0.30 0.00 -1.18 0.00 0.00 61.69 59.79 3k86 s THR 135 Cb -0.04 -2.70 -0.08 0.00 1.34 0.00 0.00 72.50 71.02 3k86 s THR 135 CO -0.04 0.59 1.24 -0.63 -0.54 0.00 0.00 174.62 175.23 3k86 s ILE 136 N -0.66 3.43 -0.04 2.99 1.01 -0.27 -0.74 121.20 126.93 3k86 s ILE 136 Ca 0.10 1.20 0.06 0.00 0.00 0.00 0.00 60.65 62.02 3k86 s ILE 136 Cb -0.12 -3.77 -0.09 0.00 0.01 0.00 0.00 42.46 38.50 3k86 s ILE 136 CO 0.02 0.19 0.07 0.00 0.00 0.00 0.00 174.94 175.22 3k86 n ALA 137 N 2.51 2.00 -3.57 9.38 0.00 0.54 -4.90 120.51 126.47 3k86 n ALA 137 Ca 0.05 -0.32 -0.15 0.00 0.00 0.00 0.00 53.44 53.01 3k86 n ALA 137 Cb 0.44 -0.02 -0.07 0.00 0.00 0.00 0.00 19.45 19.80 3k86 n ALA 137 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3k86 s ASN 138 N -3.40 -0.69 -0.09 0.00 2.47 -1.08 -5.01 114.94 107.14 3k86 s ASN 138 Ca -0.03 1.16 0.00 0.00 0.42 0.00 0.00 52.86 54.41 3k86 s ASN 138 Cb 0.03 1.12 0.02 0.00 -1.45 0.00 0.00 41.25 40.97 3k86 s ASN 138 CO 0.27 -0.35 -0.08 -0.63 -3.72 0.00 0.00 177.10 172.58 3k86 s ILE 139 N -0.14 0.95 -0.16 -5.21 1.01 -1.26 -0.67 121.20 115.72 3k86 s ILE 139 Ca -0.04 -0.29 0.01 0.00 0.00 0.00 0.00 60.65 60.33 3k86 s ILE 139 Cb -0.03 -0.95 0.02 0.00 0.01 0.00 0.00 42.46 41.51 3k86 s ILE 139 CO 0.04 0.34 -0.18 -0.69 0.00 0.00 0.00 174.94 174.44 3k86 s VAL 140 N 1.32 1.89 -0.26 2.92 1.01 0.51 -4.95 120.40 122.85 3k86 s VAL 140 Ca -0.03 -0.84 -0.16 0.00 0.00 0.00 0.00 61.98 60.94 3k86 s VAL 140 Cb -0.14 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 3k86 s VAL 140 CO -0.03 0.51 0.45 -1.81 0.00 0.00 0.00 175.10 174.22 3k86 s ASP 141 N 1.26 6.36 -0.12 3.32 1.01 -1.26 -0.28 116.67 126.96 3k86 s ASP 141 Ca 0.03 0.43 -0.01 0.00 0.71 0.00 0.00 52.55 53.71 3k86 s ASP 141 Cb -0.13 -2.25 0.03 0.00 1.01 0.00 0.00 42.92 41.58 3k86 s ASP 141 CO -0.10 -0.22 -0.04 -0.69 0.21 0.00 0.00 175.17 174.33 3k86 s VAL 142 N 2.11 0.79 0.00 -1.27 1.01 -0.11 -4.99 120.40 117.94 3k86 s VAL 142 Ca 0.19 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 61.91 3k86 s VAL 142 Cb -0.16 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.29 3k86 s VAL 142 CO 0.09 0.24 0.00 0.61 0.00 0.00 0.00 175.10 176.04 3k86 n GLY 143 N 5.00 3.15 0.01 4.51 0.00 -1.26 -1.56 105.19 115.04 3k86 n GLY 143 Ca -0.10 -0.12 0.14 0.00 0.00 0.00 0.00 46.02 45.94 3k86 n GLY 143 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k86 n SER 144 N 3.10 0.07 -4.59 1.61 3.41 -1.26 -4.90 113.62 111.06 3k86 n SER 144 Ca 0.00 0.16 -0.27 0.00 -0.26 0.00 0.00 58.87 58.50 3k86 n SER 144 Cb 0.00 -0.35 -0.09 0.00 -0.26 0.00 0.00 64.21 63.51 3k86 n SER 144 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3k86 s HIS 145 N -2.82 2.69 -0.20 7.33 0.09 -0.60 -1.56 115.29 120.22 3k86 s HIS 145 Ca 0.20 -0.20 -0.11 0.00 -0.00 0.00 0.00 55.06 54.94 3k86 s HIS 145 Cb 0.19 -1.31 -0.05 0.00 -0.00 0.00 0.00 32.58 31.42 3k86 s HIS 145 CO 0.51 0.52 0.19 -1.12 -0.00 0.00 0.00 174.74 174.84 3k86 s SER 146 N -2.87 6.26 -0.44 1.40 0.01 0.25 -0.94 113.70 117.37 3k86 s SER 146 Ca 0.26 0.29 -0.16 0.00 1.31 0.00 0.00 55.95 57.65 3k86 s SER 146 Cb -0.09 -2.12 0.04 0.00 0.21 0.00 0.00 66.02 64.06 3k86 s SER 146 CO 0.16 0.13 0.40 -0.69 0.41 0.00 0.00 173.24 173.65 3k86 s VAL 147 N 0.54 5.17 -0.28 3.43 1.01 0.62 -1.58 120.40 129.32 3k86 s VAL 147 Ca 0.11 -0.70 -0.09 0.00 0.00 0.00 0.00 61.98 61.30 3k86 s VAL 147 Cb -0.12 -4.06 -0.02 0.00 0.00 0.00 0.00 36.38 32.18 3k86 s VAL 147 CO 0.01 -0.48 0.12 -0.63 0.00 0.00 0.00 175.10 174.13 3k86 s ILE 148 N 1.88 4.61 -0.21 2.22 1.01 0.67 -0.36 121.20 131.02 3k86 s ILE 148 Ca 0.07 -0.20 -0.15 0.00 0.00 0.00 0.00 60.65 60.38 3k86 s ILE 148 Cb -0.20 -3.24 -0.04 0.00 0.01 0.00 0.00 42.46 38.99 3k86 s ILE 148 CO 0.10 0.22 0.34 -0.36 0.00 0.00 0.00 174.94 175.24 3k86 s PHE 149 N 1.64 3.36 -0.01 3.97 0.08 0.16 -1.26 117.98 125.91 3k86 s PHE 149 Ca 0.06 0.52 0.03 0.00 0.12 0.00 0.00 56.93 57.65 3k86 s PHE 149 Cb -0.16 -2.47 -0.00 0.00 -0.57 0.00 0.00 43.02 39.82 3k86 s PHE 149 CO 0.06 0.00 -0.09 0.00 -0.10 0.00 0.00 175.22 175.09 3k86 s ALA 150 N 1.27 0.80 -0.06 5.36 0.00 0.27 -0.34 121.76 129.07 3k86 s ALA 150 Ca 0.16 -0.37 -0.13 0.00 0.00 0.00 0.00 51.96 51.62 3k86 s ALA 150 Cb -0.14 -0.24 -0.05 0.00 0.00 0.00 0.00 23.12 22.68 3k86 s ALA 150 CO 0.07 0.17 0.34 -1.21 0.00 0.00 0.00 175.76 175.13 3k86 s GLU 151 N -0.05 3.91 -0.19 0.00 2.02 0.08 -1.16 118.70 123.32 3k86 s GLU 151 Ca 0.01 0.25 -0.25 0.00 0.02 0.00 0.00 54.97 55.00 3k86 s GLU 151 Cb -0.06 -3.26 -0.01 0.00 0.10 0.00 0.00 34.13 30.90 3k86 s GLU 151 CO -0.00 0.60 0.82 0.08 0.02 0.00 0.00 175.26 176.77 3k86 s VAL 152 N -0.69 4.88 -0.18 2.63 1.01 0.13 -1.74 120.40 126.44 3k86 s VAL 152 Ca 0.21 1.59 0.11 0.00 0.00 0.00 0.00 61.98 63.88 3k86 s VAL 152 Cb -0.15 -4.12 -0.15 0.00 0.00 0.00 0.00 36.38 31.96 3k86 s VAL 152 CO 0.10 0.01 0.31 1.33 0.00 0.00 0.00 175.10 176.85 3k86 n VAL 153 N 4.85 0.00 -3.44 2.92 0.24 0.12 -4.86 118.33 118.16 3k86 n VAL 153 Ca 0.04 -0.25 -0.12 0.00 -2.04 0.00 0.00 64.34 61.97 3k86 n VAL 153 Cb 0.49 0.51 -0.02 0.00 -1.47 0.00 0.00 33.84 33.34 3k86 n VAL 153 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3k86 s ALA 154 N -2.50 -1.56 0.07 2.33 0.00 -1.01 -5.00 121.76 114.09 3k86 s ALA 154 Ca -0.01 0.48 0.01 0.00 0.00 0.00 0.00 51.96 52.43 3k86 s ALA 154 Cb 0.07 0.85 -0.04 0.00 0.00 0.00 0.00 23.12 24.00 3k86 s ALA 154 CO 0.45 -0.75 -0.05 -0.98 0.00 0.00 0.00 175.76 174.43 3k86 s ARG 155 N -3.67 0.69 -0.03 0.00 1.70 -1.26 -0.36 118.95 116.02 3k86 s ARG 155 Ca 0.01 -1.20 0.06 0.00 -0.47 0.00 0.00 55.73 54.13 3k86 s ARG 155 Cb -0.01 -0.04 -0.01 0.00 -0.57 0.00 0.00 34.95 34.32 3k86 s ARG 155 CO -0.12 -0.05 -0.21 1.21 -1.08 0.00 0.00 175.30 175.05 3k86 s ASN 156 N -2.78 2.58 -0.66 -2.89 3.84 0.63 -4.97 114.94 110.70 3k86 s ASN 156 Ca 0.06 -0.41 -0.12 0.00 0.21 0.00 0.00 52.86 52.61 3k86 s ASN 156 Cb 0.04 -0.49 0.17 0.00 -0.55 0.00 0.00 41.25 40.42 3k86 s ASN 156 CO -0.06 0.24 0.57 -1.00 -2.79 0.00 0.00 177.10 174.06 3k86 s HIS 157 N -0.30 3.53 0.64 0.43 3.76 -1.26 -2.61 115.29 119.48 3k86 s HIS 157 Ca 0.03 -1.94 -0.03 0.00 -0.15 0.00 0.00 55.06 52.97 3k86 s HIS 157 Cb -0.10 -3.65 0.06 0.00 1.11 0.00 0.00 32.58 30.00 3k86 s HIS 157 CO 0.01 -0.97 0.91 0.00 -0.85 0.00 0.00 174.74 173.84 3k86 s ALA 158 N 0.68 3.52 -0.21 -1.40 0.00 -1.26 -5.06 121.76 118.03 3k86 s ALA 158 Ca 0.12 -1.19 -0.17 0.00 0.00 0.00 0.00 51.96 50.72 3k86 s ALA 158 Cb -0.19 -2.31 -0.04 0.00 0.00 0.00 0.00 23.12 20.58 3k86 s ALA 158 CO -0.04 -1.10 0.45 -1.21 0.00 0.00 0.00 175.76 173.87 3k86 s GLU 159 N -5.03 4.17 -1.55 0.00 2.02 -1.26 -4.72 118.70 112.33 3k86 s GLU 159 Ca 0.60 0.29 -0.00 0.00 0.02 0.00 0.00 54.97 55.87 3k86 s GLU 159 Cb -0.10 -3.56 0.00 0.00 0.10 0.00 0.00 34.13 30.58 3k86 s GLU 159 CO 0.42 -0.10 0.02 0.39 0.02 0.00 0.00 175.26 176.00 3k86 n GLU 160 N 4.67 -1.02 -2.89 1.61 1.02 -1.26 -4.88 120.64 117.90 3k86 n GLU 160 Ca -0.07 0.10 -0.43 0.00 -0.02 0.00 0.00 57.16 56.74 3k86 n GLU 160 Cb 0.51 -3.62 -0.04 0.00 -0.02 0.00 0.00 31.44 28.27 3k86 n GLU 160 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3k86 n THR 162 N 5.93 1.60 -2.75 0.00 -2.24 -1.26 -4.87 114.28 110.69 3k86 n THR 162 Ca -0.03 -0.40 -0.33 0.00 -2.27 0.00 0.00 64.05 61.02 3k86 n THR 162 Cb 0.46 -1.46 -0.06 0.00 -2.10 0.00 0.00 70.33 67.17 3k86 n THR 162 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3k86 s PRO 163 N -1.29 4.10 -0.19 -0.78 0.04 -1.26 -0.55 135.00 135.07 3k86 s PRO 163 Ca 0.61 0.98 -0.17 0.00 0.04 0.00 0.00 61.00 62.46 3k86 s PRO 163 Cb -0.62 -2.21 -0.04 0.00 0.04 0.00 0.00 34.50 31.67 3k86 s PRO 163 CO 0.57 -0.07 0.43 -1.17 0.04 0.00 0.00 177.00 176.80 3k86 s LEU 164 N -3.43 4.16 0.15 -3.56 2.96 -0.64 -3.79 118.68 114.53 3k86 s LEU 164 Ca 0.60 0.58 0.11 0.00 -0.22 0.00 0.00 54.13 55.19 3k86 s LEU 164 Cb -0.09 -2.57 -0.04 0.00 0.50 0.00 0.00 46.19 43.98 3k86 s LEU 164 CO 0.19 -0.10 -0.26 -0.63 -1.32 0.00 0.00 176.35 174.24 3k86 s ILE 165 N 1.33 2.26 -0.09 6.68 1.01 0.12 -0.87 121.20 131.64 3k86 s ILE 165 Ca 0.21 -1.82 0.04 0.00 0.00 0.00 0.00 60.65 59.08 3k86 s ILE 165 Cb -0.15 -2.01 -0.01 0.00 0.01 0.00 0.00 42.46 40.30 3k86 s ILE 165 CO 0.08 0.03 -0.23 -0.47 0.00 0.00 0.00 174.94 174.36 3k86 s TYR 166 N -1.23 2.56 -0.24 3.97 5.04 0.46 -0.47 117.35 127.43 3k86 s TYR 166 Ca 0.15 -0.86 -0.14 0.00 -2.44 0.00 0.00 57.07 53.79 3k86 s TYR 166 Cb -0.09 -1.69 0.07 0.00 0.35 0.00 0.00 41.96 40.60 3k86 s TYR 166 CO 0.07 -0.30 0.60 -1.58 -1.34 0.00 0.00 175.55 172.99 3k86 s HIS 167 N 0.13 -0.92 -1.46 4.97 5.65 -0.43 -1.61 115.29 121.63 3k86 s HIS 167 Ca -0.12 1.86 -0.03 0.00 0.25 0.00 0.00 55.06 57.03 3k86 s HIS 167 Cb -0.16 0.52 0.02 0.00 -1.18 0.00 0.00 32.58 31.78 3k86 s HIS 167 CO 0.07 -0.47 0.45 0.54 -0.65 0.00 0.00 174.74 174.67 3k86 n ARG 168 N 4.33 -3.17 -1.43 2.88 1.74 0.01 -1.43 116.66 119.60 3k86 n ARG 168 Ca -0.21 0.38 -0.15 0.00 -0.77 0.00 0.00 57.85 57.11 3k86 n ARG 168 Cb 0.57 -4.56 -0.06 0.00 -1.02 0.00 0.00 32.46 27.39 3k86 n ARG 168 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3k86 n ARG 169 N -4.42 -1.16 -4.09 5.56 1.74 -1.26 -4.97 116.66 108.07 3k86 n ARG 169 Ca -0.25 1.01 -0.14 0.00 -0.77 0.00 0.00 57.85 57.69 3k86 n ARG 169 Cb 0.66 -5.19 -0.11 0.00 -1.02 0.00 0.00 32.46 26.79 3k86 n ARG 169 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3k86 s GLN 170 N -3.21 0.61 0.58 5.56 -0.21 -0.51 -5.14 119.66 117.33 3k86 s GLN 170 Ca 0.00 -0.82 -0.18 0.00 0.02 0.00 0.00 55.36 54.37 3k86 s GLN 170 Cb 0.00 -0.42 -0.04 0.00 1.00 0.00 0.00 33.01 33.55 3k86 s GLN 170 CO 0.00 0.08 1.13 0.71 -2.12 0.00 0.00 175.29 175.09 3k86 s TYR 171 N -1.42 2.62 0.28 0.91 2.02 -1.26 -1.31 117.35 119.18 3k86 s TYR 171 Ca -0.07 1.54 -0.15 0.00 -0.37 0.00 0.00 57.07 58.02 3k86 s TYR 171 Cb -0.10 -3.28 0.01 0.00 -0.40 0.00 0.00 41.96 38.19 3k86 s TYR 171 CO 0.01 -1.68 0.58 0.00 -1.57 0.00 0.00 175.55 172.88 3k86 s ALA 172 N -1.89 -0.50 0.23 3.71 0.00 0.38 -4.90 121.76 118.79 3k86 s ALA 172 Ca 0.72 -0.75 0.03 0.00 0.00 0.00 0.00 51.96 51.96 3k86 s ALA 172 Cb -0.24 0.98 -0.01 0.00 0.00 0.00 0.00 23.12 23.84 3k86 s ALA 172 CO 0.31 -0.92 0.12 -2.37 0.00 0.00 0.00 175.76 172.91 3k86 n THR 173 N -0.43 0.00 -3.64 0.00 5.66 -1.26 0.12 114.28 114.72 3k86 n THR 173 Ca -0.03 -1.45 -0.31 0.00 -3.05 0.00 0.00 64.05 59.21 3k86 n THR 173 Cb 0.61 0.61 -0.05 0.00 -1.55 0.00 0.00 70.33 69.95 3k86 n THR 173 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3k86 s THR 174 N -2.62 5.14 0.20 1.09 -4.23 -1.26 -4.93 115.64 109.03 3k86 s THR 174 Ca 0.17 0.07 0.04 0.00 -1.18 0.00 0.00 61.69 60.80 3k86 s THR 174 Cb 0.01 -3.62 -0.05 0.00 1.34 0.00 0.00 72.50 70.17 3k86 s THR 174 CO 0.12 0.02 -0.05 0.00 -0.54 0.00 0.00 174.62 174.17 3k86 s ARG 175 N -2.69 1.25 0.75 3.99 1.70 -1.26 -5.02 118.95 117.66 3k86 s ARG 175 Ca 0.42 -1.59 -0.11 0.00 -0.47 0.00 0.00 55.73 53.97 3k86 s ARG 175 Cb -0.12 -0.68 0.04 0.00 -0.57 0.00 0.00 34.95 33.62 3k86 s ARG 175 CO 0.24 -0.01 1.08 -1.54 -1.08 0.00 0.00 175.30 173.99 3k86 s SER 176 N -3.26 4.88 0.00 -2.89 1.04 -1.26 -5.26 113.70 106.95 3k86 s SER 176 Ca 0.24 1.53 0.06 0.00 0.48 0.00 0.00 55.95 58.26 3k86 s SER 176 Cb 0.04 -2.33 0.34 0.00 0.10 0.00 0.00 66.02 64.17 3k86 s SER 176 CO 0.06 -1.75 0.81 0.18 0.98 0.00 0.00 173.24 173.51