#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k88 s GLU 15 N 0.00 3.51 0.52 -1.08 0.41 -1.26 -5.08 118.70 115.72 3k88 s GLU 15 Ca 0.00 -0.21 -0.18 0.00 -0.41 0.00 0.00 54.97 54.17 3k88 s GLU 15 Cb 0.00 -3.06 -0.07 0.00 -1.78 0.00 0.00 34.13 29.21 3k88 s GLU 15 CO 0.00 0.64 1.03 0.95 -0.49 0.00 0.00 175.26 177.39 3k88 s THR 16 N -1.35 4.00 0.89 3.63 -4.23 -1.26 -5.03 115.64 112.28 3k88 s THR 16 Ca 0.29 1.09 -0.11 0.00 -1.18 0.00 0.00 61.69 61.78 3k88 s THR 16 Cb -0.13 -3.49 0.12 0.00 1.34 0.00 0.00 72.50 70.34 3k88 s THR 16 CO 0.19 -0.42 1.08 1.33 -0.54 0.00 0.00 174.62 176.26 3k88 n VAL 17 N -1.39 0.60 -1.85 2.29 0.24 -1.26 -4.97 118.33 111.99 3k88 n VAL 17 Ca 0.08 -0.08 -0.41 0.00 -2.04 0.00 0.00 64.34 61.89 3k88 n VAL 17 Cb 0.53 -1.01 0.00 0.00 -1.47 0.00 0.00 33.84 31.89 3k88 n VAL 17 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3k88 s ALA 18 N -2.46 3.46 0.25 2.33 0.00 -1.26 -4.85 121.76 119.23 3k88 s ALA 18 Ca 0.68 1.50 -0.03 0.00 0.00 0.00 0.00 51.96 54.11 3k88 s ALA 18 Cb -0.25 -3.59 0.46 0.00 0.00 0.00 0.00 23.12 19.75 3k88 s ALA 18 CO 0.57 -1.04 1.78 0.77 0.00 0.00 0.00 175.76 177.83 3k88 h SER 19 N 2.84 0.55 -0.45 0.00 0.02 -1.99 -1.19 113.55 113.33 3k88 h SER 19 Ca -0.51 0.08 0.08 0.00 -0.84 0.00 0.00 61.79 60.60 3k88 h SER 19 Cb 1.25 -0.02 -0.07 0.00 0.14 0.00 0.00 62.40 63.70 3k88 h SER 19 CO 0.63 0.27 0.03 0.15 -1.14 0.00 0.00 176.83 176.77 3k88 h PHE 20 N 0.66 0.03 -0.60 3.45 3.57 -2.00 -2.02 116.94 120.02 3k88 h PHE 20 Ca 0.43 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.88 3k88 h PHE 20 Cb 0.53 0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 3k88 h PHE 20 CO -0.09 -0.06 0.09 -0.44 -2.23 0.00 0.00 178.31 175.57 3k88 h ASP 21 N 0.14 0.97 -0.08 0.41 3.32 -1.78 -1.36 116.42 118.04 3k88 h ASP 21 Ca 0.22 -0.27 0.04 0.00 0.02 0.00 0.00 57.03 57.04 3k88 h ASP 21 Cb 0.31 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.56 3k88 h ASP 21 CO -0.34 0.99 -0.20 0.15 -1.72 0.00 0.00 179.24 178.12 3k88 h PHE 22 N 0.91 -0.52 -0.34 4.55 3.04 -1.08 -0.96 116.94 122.55 3k88 h PHE 22 Ca 0.18 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 62.13 3k88 h PHE 22 Cb 0.44 0.24 -0.01 0.00 2.56 0.00 0.00 35.95 39.18 3k88 h PHE 22 CO 0.03 -0.28 0.09 0.00 -2.02 0.00 0.00 178.31 176.14 3k88 h ARG 23 N -0.28 0.53 -0.32 1.11 3.08 -1.31 -1.79 114.38 115.40 3k88 h ARG 23 Ca 0.08 -0.12 0.02 0.00 0.07 0.00 0.00 59.98 60.03 3k88 h ARG 23 Cb 0.39 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.35 3k88 h ARG 23 CO -0.24 0.57 0.17 0.22 -1.07 0.00 0.00 179.97 179.62 3k88 h ASP 24 N 0.39 0.27 -0.12 7.04 -0.00 -1.17 -0.29 116.42 122.53 3k88 h ASP 24 Ca 0.11 0.01 0.01 0.00 -0.00 0.00 0.00 57.03 57.16 3k88 h ASP 24 Cb 0.27 -0.05 -0.02 0.00 -0.00 0.00 0.00 39.33 39.54 3k88 h ASP 24 CO -0.00 0.20 0.02 0.00 -0.00 0.00 0.00 179.24 179.46 3k88 h ALA 25 N 1.15 0.11 0.00 -0.78 0.00 -1.08 -2.48 119.26 116.19 3k88 h ALA 25 Ca 0.13 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3k88 h ALA 25 Cb 0.02 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 3k88 h ALA 25 CO -0.07 -0.44 -0.05 -0.07 0.00 0.00 0.00 179.25 178.62 3k88 h LEU 26 N 0.07 0.00 -2.21 0.00 3.38 -1.13 -1.63 115.31 113.78 3k88 h LEU 26 Ca 0.05 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.07 3k88 h LEU 26 Cb 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3k88 h LEU 26 CO -0.07 0.05 0.25 0.77 0.09 0.00 0.00 178.44 179.52 3k88 h SER 27 N 0.00 0.00 0.75 -0.43 4.64 -0.56 -1.01 113.55 116.95 3k88 h SER 27 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3k88 h SER 27 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 3k88 h SER 27 CO 0.01 0.00 -0.24 0.29 -0.87 0.00 0.00 176.83 176.02 3k88 n LYS 28 N -3.60 0.01 -1.95 4.77 5.02 -0.61 -0.37 118.16 121.42 3k88 n LYS 28 Ca 0.02 -0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 56.01 3k88 n LYS 28 Cb 0.36 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 33.92 3k88 n LYS 28 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3k88 s ALA 29 N -2.99 2.93 -0.04 7.82 0.00 -0.38 -4.81 121.76 124.28 3k88 s ALA 29 Ca 0.13 -0.41 0.01 0.00 0.00 0.00 0.00 51.96 51.69 3k88 s ALA 29 Cb 0.18 -2.97 -0.03 0.00 0.00 0.00 0.00 23.12 20.31 3k88 s ALA 29 CO 0.61 -1.13 -0.03 -1.12 0.00 0.00 0.00 175.76 174.09 3k88 s SER 30 N -4.37 4.90 0.09 0.00 0.01 -1.26 -4.22 113.70 108.86 3k88 s SER 30 Ca 0.58 -0.00 0.03 0.00 1.31 0.00 0.00 55.95 57.86 3k88 s SER 30 Cb -0.11 -1.26 -0.04 0.00 0.21 0.00 0.00 66.02 64.82 3k88 s SER 30 CO 0.51 0.33 -0.09 0.42 0.41 0.00 0.00 173.24 174.82 3k88 s THR 31 N -0.94 0.82 0.99 1.44 -4.23 -0.57 -4.98 115.64 108.17 3k88 s THR 31 Ca 0.15 -1.70 -0.12 0.00 -1.18 0.00 0.00 61.69 58.84 3k88 s THR 31 Cb -0.11 -1.41 0.18 0.00 1.34 0.00 0.00 72.50 72.51 3k88 s THR 31 CO 0.05 -0.66 1.09 -2.16 -0.54 0.00 0.00 174.62 172.40 3k88 s PRO 32 N -3.06 0.51 -0.11 3.99 0.04 -1.26 -0.91 135.00 134.20 3k88 s PRO 32 Ca 0.06 0.57 0.04 0.00 0.04 0.00 0.00 61.00 61.71 3k88 s PRO 32 Cb -0.01 -1.74 0.00 0.00 0.04 0.00 0.00 34.50 32.79 3k88 s PRO 32 CO -0.02 -2.69 -0.23 0.08 0.04 0.00 0.00 177.00 174.18 3k88 s VAL 33 N -2.95 2.05 0.27 -0.36 1.01 -1.12 -4.56 120.40 114.74 3k88 s VAL 33 Ca 0.65 -1.00 0.07 0.00 0.00 0.00 0.00 61.98 61.69 3k88 s VAL 33 Cb -0.19 -1.78 -0.06 0.00 0.00 0.00 0.00 36.38 34.36 3k88 s VAL 33 CO 0.58 0.56 -0.06 0.42 0.00 0.00 0.00 175.10 176.59 3k88 s THR 34 N 0.46 1.63 -0.15 3.92 -4.23 0.89 -1.60 115.64 116.55 3k88 s THR 34 Ca -0.16 -2.13 -0.03 0.00 -1.18 0.00 0.00 61.69 58.19 3k88 s THR 34 Cb -0.17 -2.41 -0.02 0.00 1.34 0.00 0.00 72.50 71.23 3k88 s THR 34 CO 0.06 -0.33 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.06 3k88 s VAL 35 N -3.03 3.68 -0.22 2.29 1.01 -0.32 -0.38 120.40 123.43 3k88 s VAL 35 Ca 0.29 -0.44 -0.08 0.00 0.00 0.00 0.00 61.98 61.75 3k88 s VAL 35 Cb 0.03 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 3k88 s VAL 35 CO 0.11 0.50 0.10 -0.69 0.00 0.00 0.00 175.10 175.12 3k88 s VAL 36 N 0.34 4.81 0.14 2.92 1.01 -0.12 -0.47 120.40 129.03 3k88 s VAL 36 Ca -0.06 -0.01 0.05 0.00 0.00 0.00 0.00 61.98 61.95 3k88 s VAL 36 Cb -0.15 -3.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.97 3k88 s VAL 36 CO 0.04 0.38 -0.11 0.00 0.00 0.00 0.00 175.10 175.41 3k88 s ALA 37 N 0.99 1.43 0.13 5.51 0.00 -0.43 -1.29 121.76 128.10 3k88 s ALA 37 Ca 0.05 -1.44 -0.10 0.00 0.00 0.00 0.00 51.96 50.47 3k88 s ALA 37 Cb -0.14 0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.01 3k88 s ALA 37 CO 0.03 -0.07 0.28 -0.08 0.00 0.00 0.00 175.76 175.93 3k88 s THR 38 N -3.10 0.09 0.16 0.00 -1.32 -0.31 0.33 115.64 111.50 3k88 s THR 38 Ca 0.15 -1.16 -0.18 0.00 -1.21 0.00 0.00 61.69 59.28 3k88 s THR 38 Cb 0.01 -1.55 0.04 0.00 -1.51 0.00 0.00 72.50 69.49 3k88 s THR 38 CO 0.01 -0.42 0.50 0.21 -2.21 0.00 0.00 174.62 172.71 3k88 s ASN 39 N -2.90 -0.31 0.00 8.08 3.04 -1.26 -2.12 114.94 119.47 3k88 s ASN 39 Ca 0.10 -0.33 0.00 0.00 0.04 0.00 0.00 52.86 52.68 3k88 s ASN 39 Cb 0.03 0.55 0.00 0.00 -1.54 0.00 0.00 41.25 40.29 3k88 s ASN 39 CO -0.06 -0.97 0.00 0.61 -3.04 0.00 0.00 177.10 173.65 3k88 n GLY 40 N -0.31 -0.16 0.21 1.21 0.00 -1.24 -4.51 105.19 100.40 3k88 n GLY 40 Ca -0.14 -1.25 0.15 0.00 0.00 0.00 0.00 46.02 44.78 3k88 n GLY 40 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3k88 h PRO 41 N 0.00 0.00 -0.02 1.61 0.11 -1.94 -0.37 132.00 131.39 3k88 h PRO 41 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3k88 h PRO 41 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3k88 h PRO 41 CO 0.00 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 178.98 3k88 n PHE 42 N -2.60 0.00 0.00 0.65 3.01 -1.26 -5.06 117.46 112.20 3k88 n PHE 42 Ca 0.00 -0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 3k88 n PHE 42 Cb 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.65 3k88 n PHE 42 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3k88 n GLY 43 N 1.25 0.51 3.74 1.37 0.00 -0.15 -4.93 105.19 106.98 3k88 n GLY 43 Ca 0.17 -2.15 -0.39 0.00 0.00 0.00 0.00 46.02 43.65 3k88 n GLY 43 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3k88 s LEU 44 N 0.00 4.39 0.14 0.99 2.96 -1.26 -3.59 118.68 122.30 3k88 s LEU 44 Ca 0.00 1.21 -0.22 0.00 -0.22 0.00 0.00 54.13 54.90 3k88 s LEU 44 Cb 0.00 -3.03 0.06 0.00 0.50 0.00 0.00 46.19 43.73 3k88 s LEU 44 CO 0.00 0.01 0.56 0.00 -1.32 0.00 0.00 176.35 175.61 3k88 s ALA 45 N 0.17 -1.47 0.07 5.97 0.00 -0.90 -4.61 121.76 121.00 3k88 s ALA 45 Ca 0.34 0.43 -0.26 0.00 0.00 0.00 0.00 51.96 52.47 3k88 s ALA 45 Cb -0.18 0.79 0.08 0.00 0.00 0.00 0.00 23.12 23.81 3k88 s ALA 45 CO 0.18 -0.72 0.81 0.20 0.00 0.00 0.00 175.76 176.23 3k88 s GLY 46 N -2.65 -0.46 0.15 0.00 0.00 -1.26 -1.16 107.32 101.94 3k88 s GLY 46 Ca 0.00 0.70 -0.15 0.00 0.00 0.00 0.00 44.72 45.27 3k88 s GLY 46 CO -0.11 0.23 0.42 0.48 0.00 0.00 0.00 173.10 174.12 3k88 s LEU 47 N -2.63 0.38 0.10 0.66 2.34 -0.41 -4.81 118.68 114.30 3k88 s LEU 47 Ca 0.05 -0.45 -0.27 0.00 0.06 0.00 0.00 54.13 53.52 3k88 s LEU 47 Cb -0.01 1.84 -0.06 0.00 -0.56 0.00 0.00 46.19 47.40 3k88 s LEU 47 CO -0.08 -0.92 0.86 -0.89 -1.06 0.00 0.00 176.35 174.25 3k88 s THR 48 N -3.85 4.55 -0.07 5.48 2.01 -0.63 -0.95 115.64 122.19 3k88 s THR 48 Ca 0.07 1.85 -0.04 0.00 0.31 0.00 0.00 61.69 63.88 3k88 s THR 48 Cb 0.01 -4.22 0.03 0.00 0.01 0.00 0.00 72.50 68.34 3k88 s THR 48 CO -0.07 0.37 0.16 0.00 -0.69 0.00 0.00 174.62 174.38 3k88 n SER 50 N 3.79 0.17 -4.27 0.00 3.41 -1.26 -0.08 113.62 115.37 3k88 n SER 50 Ca -0.22 -0.57 -0.43 0.00 -0.26 0.00 0.00 58.87 57.39 3k88 n SER 50 Cb 0.54 1.00 0.00 0.00 -0.26 0.00 0.00 64.21 65.50 3k88 n SER 50 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k88 n ALA 51 N -1.07 4.35 -2.97 7.33 0.00 -1.26 -4.78 120.51 122.11 3k88 n ALA 51 Ca 0.01 -4.24 -0.12 0.00 0.00 0.00 0.00 53.44 49.08 3k88 n ALA 51 Cb 0.05 -3.06 -0.13 0.00 0.00 0.00 0.00 19.45 16.30 3k88 n ALA 51 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3k88 s VAL 52 N 1.34 0.00 0.21 0.00 1.01 -1.26 -1.23 120.40 120.47 3k88 s VAL 52 Ca 0.42 -0.01 -0.20 0.00 0.00 0.00 0.00 61.98 62.19 3k88 s VAL 52 Cb 0.02 -0.14 0.04 0.00 0.00 0.00 0.00 36.38 36.29 3k88 s VAL 52 CO 0.01 -0.01 0.60 0.00 0.00 0.00 0.00 175.10 175.70 3k88 s SER 54 N -2.85 7.60 -0.15 0.00 0.15 -1.26 -1.18 113.70 116.01 3k88 s SER 54 Ca 0.07 1.93 -0.13 0.00 0.70 0.00 0.00 55.95 58.52 3k88 s SER 54 Cb -0.02 -2.61 -0.06 0.00 -1.71 0.00 0.00 66.02 61.62 3k88 s SER 54 CO -0.03 0.09 -0.27 0.52 1.20 0.00 0.00 173.24 174.75 3k88 n VAL 55 N 1.78 1.34 -3.75 4.45 0.31 0.17 -4.88 118.33 117.75 3k88 n VAL 55 Ca -0.01 0.01 -0.09 0.00 -0.01 0.00 0.00 64.34 64.24 3k88 n VAL 55 Cb 0.47 -2.03 -0.03 0.00 -0.91 0.00 0.00 33.84 31.34 3k88 n VAL 55 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3k88 n ASP 57 N -0.40 2.22 -3.37 0.00 3.85 -1.26 -1.95 116.55 115.65 3k88 n ASP 57 Ca -0.08 -1.60 -0.13 0.00 -0.71 0.00 0.00 54.79 52.27 3k88 n ASP 57 Cb 0.61 -0.03 -0.08 0.00 -1.35 0.00 0.00 41.12 40.27 3k88 n ASP 57 CO 0.00 0.00 0.00 -0.60 -1.01 0.00 0.00 177.20 175.59 3k88 s ARG 58 N -1.09 0.34 0.63 0.11 3.00 -1.26 -3.10 118.95 117.59 3k88 s ARG 58 Ca 0.17 0.14 -0.16 0.00 -1.00 0.00 0.00 55.73 54.87 3k88 s ARG 58 Cb 0.11 -0.56 -0.02 0.00 0.00 0.00 0.00 34.95 34.48 3k88 s ARG 58 CO 0.17 -0.90 1.13 -2.14 0.00 0.00 0.00 175.30 173.56 3k88 s PRO 59 N 2.46 2.91 0.08 5.12 0.02 -1.26 -5.06 135.00 139.27 3k88 s PRO 59 Ca 0.10 1.51 -0.31 0.00 0.02 0.00 0.00 61.00 62.32 3k88 s PRO 59 Cb -0.14 -1.95 -0.07 0.00 0.02 0.00 0.00 34.50 32.35 3k88 s PRO 59 CO -0.26 -1.19 1.42 -2.14 -0.33 0.00 0.00 177.00 174.50 3k88 s PRO 60 N -3.81 4.30 -0.10 5.54 0.02 -1.18 -4.68 135.00 135.09 3k88 s PRO 60 Ca 0.70 2.07 -0.07 0.00 0.02 0.00 0.00 61.00 63.72 3k88 s PRO 60 Cb -0.23 -3.36 0.04 0.00 0.02 0.00 0.00 34.50 30.97 3k88 s PRO 60 CO 0.37 -0.50 0.25 0.99 -0.33 0.00 0.00 177.00 177.78 3k88 s THR 61 N 1.57 -0.02 0.30 0.99 2.01 -0.82 -1.41 115.64 118.27 3k88 s THR 61 Ca 0.65 0.07 0.10 0.00 0.31 0.00 0.00 61.69 62.82 3k88 s THR 61 Cb -0.36 -0.37 -0.06 0.00 0.01 0.00 0.00 72.50 71.72 3k88 s THR 61 CO 0.29 0.03 -0.12 0.68 -0.69 0.00 0.00 174.62 174.81 3k88 s VAL 62 N 0.71 2.15 0.18 3.82 -7.23 -0.57 -0.65 120.40 118.82 3k88 s VAL 62 Ca -0.05 -2.25 0.07 0.00 -1.81 0.00 0.00 61.98 57.94 3k88 s VAL 62 Cb -0.06 -2.46 -0.04 0.00 0.56 0.00 0.00 36.38 34.38 3k88 s VAL 62 CO -0.04 -0.31 -0.14 -1.48 -0.31 0.00 0.00 175.10 172.81 3k88 s LEU 63 N -3.52 2.53 -0.03 1.32 0.05 -0.32 -0.82 118.68 117.88 3k88 s LEU 63 Ca 0.30 -0.98 -0.10 0.00 0.05 0.00 0.00 54.13 53.40 3k88 s LEU 63 Cb 0.00 -0.63 0.01 0.00 -2.05 0.00 0.00 46.19 43.53 3k88 s LEU 63 CO 0.14 -0.18 0.21 -1.48 -0.55 0.00 0.00 176.35 174.50 3k88 s LEU 64 N -3.15 1.22 -0.22 1.48 0.05 -0.46 -1.98 118.68 115.62 3k88 s LEU 64 Ca 0.20 0.09 -0.03 0.00 0.05 0.00 0.00 54.13 54.44 3k88 s LEU 64 Cb -0.01 0.87 -0.00 0.00 -2.05 0.00 0.00 46.19 45.00 3k88 s LEU 64 CO 0.05 -0.30 -0.06 0.00 -0.55 0.00 0.00 176.35 175.50 3k88 s ILE 66 N 1.44 0.44 0.12 0.00 -5.25 -0.06 -4.75 121.20 113.14 3k88 s ILE 66 Ca 0.05 -0.20 -0.31 0.00 -0.99 0.00 0.00 60.65 59.20 3k88 s ILE 66 Cb -0.14 -0.40 -0.10 0.00 2.95 0.00 0.00 42.46 44.76 3k88 s ILE 66 CO -0.04 0.14 1.84 0.21 -1.79 0.00 0.00 174.94 175.30 3k88 s ASN 67 N 0.11 6.42 0.34 4.36 3.84 -1.26 -0.79 114.94 127.95 3k88 s ASN 67 Ca -0.01 2.76 0.24 0.00 0.21 0.00 0.00 52.86 56.06 3k88 s ASN 67 Cb -0.05 -2.57 1.23 0.00 -0.55 0.00 0.00 41.25 39.32 3k88 s ASN 67 CO -0.00 -1.01 1.73 0.03 -2.79 0.00 0.00 177.10 175.06 3k88 h ARG 68 N 8.67 0.00 0.00 0.43 3.08 -1.61 -1.82 114.38 123.12 3k88 h ARG 68 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.59 3k88 h ARG 68 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.27 3k88 h ARG 68 CO 0.95 0.00 -0.01 1.63 -1.07 0.00 0.00 179.97 181.47 3k88 n LYS 69 N -2.33 0.26 -1.88 0.04 5.02 -1.26 -4.76 118.16 113.25 3k88 n LYS 69 Ca -0.01 0.21 -0.41 0.00 -2.02 0.00 0.00 58.31 56.08 3k88 n LYS 69 Cb 0.08 -1.80 -0.00 0.00 -0.02 0.00 0.00 35.03 33.29 3k88 n LYS 69 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3k88 s SER 70 N -4.49 6.35 0.44 4.39 0.15 -0.69 -4.90 113.70 114.95 3k88 s SER 70 Ca 0.11 2.94 0.14 0.00 0.70 0.00 0.00 55.95 59.83 3k88 s SER 70 Cb 0.12 -2.66 0.97 0.00 -1.71 0.00 0.00 66.02 62.75 3k88 s SER 70 CO 0.60 -0.86 1.99 0.22 1.20 0.00 0.00 173.24 176.39 3k88 h TYR 71 N 2.95 0.04 0.00 3.44 3.20 -1.90 -2.31 116.97 122.39 3k88 h TYR 71 Ca -0.50 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.32 3k88 h TYR 71 Cb 1.24 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 39.49 3k88 h TYR 71 CO 0.53 0.21 -0.20 0.00 -1.64 0.00 0.00 178.16 177.05 3k88 h ALA 72 N 1.80 0.96 0.28 1.82 0.00 -1.90 -3.37 119.26 118.85 3k88 h ALA 72 Ca 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3k88 h ALA 72 Cb 0.32 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3k88 h ALA 72 CO 0.02 0.25 -0.33 0.00 0.00 0.00 0.00 179.25 179.20 3k88 h ALA 73 N 1.80 -0.67 -0.02 0.00 0.00 -1.69 -1.03 119.26 117.65 3k88 h ALA 73 Ca -0.00 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 3k88 h ALA 73 Cb 0.85 0.49 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 3k88 h ALA 73 CO 0.03 -0.92 -0.53 0.78 0.00 0.00 0.00 179.25 178.60 3k88 h GLY 74 N -0.66 0.05 0.96 0.00 0.00 -1.74 -1.94 103.07 99.74 3k88 h GLY 74 Ca -0.01 -0.05 -0.07 0.00 0.00 0.00 0.00 47.33 47.20 3k88 h GLY 74 CO -0.09 0.05 -0.01 -2.22 0.00 0.00 0.00 176.54 174.26 3k88 h ILE 75 N 0.03 1.26 0.25 2.60 2.04 -1.67 -1.54 117.51 120.49 3k88 h ILE 75 Ca -0.00 -1.05 -0.01 0.00 1.00 0.00 0.00 64.86 64.80 3k88 h ILE 75 Cb 0.95 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.16 3k88 h ILE 75 CO 0.07 0.35 -0.12 0.40 0.00 0.00 0.00 178.15 178.86 3k88 h ILE 76 N 0.56 0.76 -0.64 -0.67 2.04 -1.08 0.70 117.51 119.19 3k88 h ILE 76 Ca 0.11 -0.01 -0.04 0.00 1.00 0.00 0.00 64.86 65.92 3k88 h ILE 76 Cb 0.50 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 3k88 h ILE 76 CO 0.02 0.00 0.22 0.11 0.00 0.00 0.00 178.15 178.51 3k88 h LYS 77 N -0.34 0.96 -0.07 2.37 1.57 -1.30 -1.06 116.57 118.71 3k88 h LYS 77 Ca -0.03 -0.17 -0.19 0.00 -1.87 0.00 0.00 60.65 58.38 3k88 h LYS 77 Cb 0.26 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 3k88 h LYS 77 CO 0.06 0.81 -0.77 0.77 -0.57 0.00 0.00 179.45 179.74 3k88 h SER 78 N 0.93 0.50 0.12 0.86 0.02 -1.13 -3.08 113.55 111.77 3k88 h SER 78 Ca 0.21 -0.34 -0.09 0.00 -0.84 0.00 0.00 61.79 60.73 3k88 h SER 78 Cb 0.23 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 3k88 h SER 78 CO -0.01 1.10 -0.29 0.78 -1.14 0.00 0.00 176.83 177.26 3k88 h ASN 79 N 0.27 0.29 0.00 3.07 2.35 -0.55 -3.47 115.58 117.54 3k88 h ASN 79 Ca -0.04 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.61 3k88 h ASN 79 Cb 1.36 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.65 3k88 h ASN 79 CO 0.13 0.58 0.00 0.61 -1.65 0.00 0.00 177.43 177.10 3k88 n GLY 80 N -0.43 1.06 3.08 2.83 0.00 -0.43 -4.95 105.19 106.36 3k88 n GLY 80 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 3k88 n GLY 80 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k88 s VAL 81 N -3.17 0.36 0.14 1.61 -7.23 -1.26 -1.37 120.40 109.47 3k88 s VAL 81 Ca 0.00 -1.53 -0.24 0.00 -1.81 0.00 0.00 61.98 58.40 3k88 s VAL 81 Cb 0.00 -1.15 0.07 0.00 0.56 0.00 0.00 36.38 35.87 3k88 s VAL 81 CO 0.00 -0.77 0.65 -1.48 -0.31 0.00 0.00 175.10 173.19 3k88 s LEU 82 N -2.43 -0.53 0.28 1.32 0.05 -0.97 -4.59 118.68 111.81 3k88 s LEU 82 Ca 0.01 -0.01 0.11 0.00 0.05 0.00 0.00 54.13 54.29 3k88 s LEU 82 Cb 0.01 2.51 -0.05 0.00 -2.05 0.00 0.00 46.19 46.61 3k88 s LEU 82 CO -0.05 -0.92 -0.16 -0.94 -0.55 0.00 0.00 176.35 173.73 3k88 s SER 83 N -2.71 3.78 -0.13 1.48 1.04 0.15 -0.92 113.70 116.38 3k88 s SER 83 Ca 0.02 -0.96 0.01 0.00 0.48 0.00 0.00 55.95 55.49 3k88 s SER 83 Cb -0.01 -0.40 0.02 0.00 0.10 0.00 0.00 66.02 65.72 3k88 s SER 83 CO -0.12 0.02 -0.15 -0.69 0.98 0.00 0.00 173.24 173.29 3k88 s VAL 84 N -2.48 1.53 -0.31 5.02 1.01 -0.68 -1.31 120.40 123.18 3k88 s VAL 84 Ca 0.30 -0.63 0.02 0.00 0.00 0.00 0.00 61.98 61.67 3k88 s VAL 84 Cb -0.05 -1.42 0.09 0.00 0.00 0.00 0.00 36.38 35.00 3k88 s VAL 84 CO 0.16 0.45 0.04 0.20 0.00 0.00 0.00 175.10 175.95 3k88 s ASN 85 N 1.27 4.38 -0.12 3.32 0.01 0.38 -1.35 114.94 122.83 3k88 s ASN 85 Ca -0.00 -1.80 -0.29 0.00 -0.71 0.00 0.00 52.86 50.05 3k88 s ASN 85 Cb -0.14 -1.32 -0.03 0.00 0.41 0.00 0.00 41.25 40.17 3k88 s ASN 85 CO -0.07 -0.36 1.47 0.26 -1.51 0.00 0.00 177.10 176.90 3k88 s TRP 86 N 1.21 2.37 0.38 2.20 0.51 0.60 -1.17 118.94 125.05 3k88 s TRP 86 Ca 0.07 0.59 -0.17 0.00 -2.12 0.00 0.00 56.10 54.47 3k88 s TRP 86 Cb -0.18 -3.75 -0.09 0.00 -0.81 0.00 0.00 33.47 28.64 3k88 s TRP 86 CO -0.13 -2.81 0.83 -0.51 -0.51 0.00 0.00 176.95 173.82 3k88 s LEU 87 N 3.92 3.96 0.49 2.99 1.43 -0.63 -1.27 118.68 129.57 3k88 s LEU 87 Ca 0.65 1.42 -0.02 0.00 -1.03 0.00 0.00 54.13 55.15 3k88 s LEU 87 Cb -0.27 -4.26 -0.00 0.00 0.03 0.00 0.00 46.19 41.69 3k88 s LEU 87 CO 0.23 -0.31 0.74 0.00 0.23 0.00 0.00 176.35 177.25 3k88 s ALA 88 N -2.14 3.59 0.60 4.21 0.00 -1.26 -1.50 121.76 125.26 3k88 s ALA 88 Ca 0.57 -0.90 0.31 0.00 0.00 0.00 0.00 51.96 51.95 3k88 s ALA 88 Cb -0.10 -2.31 1.84 0.00 0.00 0.00 0.00 23.12 22.55 3k88 s ALA 88 CO 0.18 -0.48 2.20 0.00 0.00 0.00 0.00 175.76 177.66 3k88 h ALA 89 N 0.23 1.55 -0.01 0.00 0.00 -0.22 -1.32 119.26 119.50 3k88 h ALA 89 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3k88 h ALA 89 Cb 1.25 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3k88 h ALA 89 CO 0.59 -0.13 -0.02 0.41 0.00 0.00 0.00 179.25 180.11 3k88 n GLY 90 N -1.32 -0.56 1.84 0.00 0.00 -1.26 -4.34 105.19 99.56 3k88 n GLY 90 Ca -0.01 -0.32 -0.06 0.00 0.00 0.00 0.00 46.02 45.63 3k88 n GLY 90 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3k88 n GLN 91 N -0.48 3.30 -0.06 1.61 6.02 -0.50 -4.59 117.38 122.68 3k88 n GLN 91 Ca 0.21 -3.07 0.03 0.00 -0.01 0.00 0.00 57.00 54.15 3k88 n GLN 91 Cb 0.24 -2.14 0.38 0.00 1.02 0.00 0.00 30.24 29.74 3k88 n GLN 91 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3k88 h ALA 92 N 2.23 1.66 -0.23 -1.58 0.00 -1.78 -1.33 119.26 118.23 3k88 h ALA 92 Ca 0.28 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 3k88 h ALA 92 Cb 2.25 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.83 3k88 h ALA 92 CO 0.70 0.31 -0.03 0.28 0.00 0.00 0.00 179.25 180.52 3k88 h VAL 93 N 0.67 1.16 -0.54 0.00 2.07 -1.96 -0.31 116.25 117.33 3k88 h VAL 93 Ca 0.19 -0.63 -0.05 0.00 0.82 0.00 0.00 66.70 67.03 3k88 h VAL 93 Cb -0.05 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 3k88 h VAL 93 CO -0.04 0.21 0.14 0.40 0.02 0.00 0.00 177.57 178.30 3k88 h ILE 94 N 0.33 1.24 -0.70 4.57 2.04 -1.60 -1.29 117.51 122.10 3k88 h ILE 94 Ca 0.07 -0.85 0.02 0.00 1.00 0.00 0.00 64.86 65.10 3k88 h ILE 94 Cb 0.27 0.76 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 3k88 h ILE 94 CO 0.01 0.31 0.45 -1.28 0.00 0.00 0.00 178.15 177.65 3k88 h SER 95 N 0.76 0.77 0.14 1.72 0.87 -1.20 -1.60 113.55 115.01 3k88 h SER 95 Ca 0.17 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.71 3k88 h SER 95 Cb 0.32 -0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.10 3k88 h SER 95 CO -0.00 0.54 -0.07 1.56 -0.53 0.00 0.00 176.83 178.34 3k88 h GLN 96 N 0.91 -0.18 -0.41 2.24 1.08 -0.94 -1.00 115.11 116.81 3k88 h GLN 96 Ca 0.27 0.01 0.08 0.00 -1.45 0.00 0.00 58.65 57.57 3k88 h GLN 96 Cb -0.05 0.04 -0.08 0.00 -0.05 0.00 0.00 27.48 27.34 3k88 h GLN 96 CO -0.08 -0.05 -0.12 1.15 -0.95 0.00 0.00 178.83 178.78 3k88 h THR 97 N -0.27 0.55 0.00 -0.54 2.02 -1.03 -1.51 112.91 112.12 3k88 h THR 97 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.16 3k88 h THR 97 Cb 0.21 0.55 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 3k88 h THR 97 CO 0.03 0.00 0.00 0.49 0.37 0.00 0.00 175.52 176.41 3k88 n PHE 98 N -5.33 0.00 1.36 3.16 3.72 -0.62 -2.19 117.46 117.55 3k88 n PHE 98 Ca 0.03 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.56 3k88 n PHE 98 Cb 0.24 -0.45 0.40 0.00 -0.94 0.00 0.00 39.48 38.73 3k88 n PHE 98 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3k88 n ALA 99 N -1.45 2.54 -0.08 4.37 0.00 -0.39 -1.60 120.51 123.90 3k88 n ALA 99 Ca 0.06 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.99 3k88 n ALA 99 Cb 0.23 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.61 3k88 n ALA 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k88 n GLY 100 N 1.22 0.64 3.73 0.00 0.00 -0.93 -4.99 105.19 104.87 3k88 n GLY 100 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 3k88 n GLY 100 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k88 s VAL 101 N -2.13 3.30 0.00 1.61 1.01 -0.65 -1.81 120.40 121.74 3k88 s VAL 101 Ca 0.00 0.99 0.00 0.00 0.00 0.00 0.00 61.98 62.97 3k88 s VAL 101 Cb 0.00 -3.64 0.00 0.00 0.00 0.00 0.00 36.38 32.74 3k88 s VAL 101 CO 0.00 0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.82 3k88 n GLY 102 N 2.94 2.45 3.85 4.51 0.00 -1.26 -4.37 105.19 113.31 3k88 n GLY 102 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 3k88 n GLY 102 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3k88 n SER 103 N 0.00 -4.83 -4.71 1.61 7.64 -0.75 -4.92 113.62 107.66 3k88 n SER 103 Ca 0.00 -1.13 -0.41 0.00 1.01 0.00 0.00 58.87 58.34 3k88 n SER 103 Cb 0.00 -2.57 -0.04 0.00 -1.01 0.00 0.00 64.21 60.59 3k88 n SER 103 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3k88 s VAL 104 N -3.46 4.92 0.37 0.44 1.01 -1.26 -4.99 120.40 117.43 3k88 s VAL 104 Ca 0.46 1.87 -0.27 0.00 0.00 0.00 0.00 61.98 64.04 3k88 s VAL 104 Cb -0.21 -4.23 -0.11 0.00 0.00 0.00 0.00 36.38 31.83 3k88 s VAL 104 CO 0.91 0.19 1.30 -2.65 0.00 0.00 0.00 175.10 174.84 3k88 n PRO 105 N 3.89 2.10 -0.36 2.72 -0.02 -1.26 -4.78 135.00 137.29 3k88 n PRO 105 Ca 0.04 0.74 -0.08 0.00 -2.02 0.00 0.00 63.50 62.18 3k88 n PRO 105 Cb 0.51 -2.38 -0.05 0.00 -0.02 0.00 0.00 33.50 31.57 3k88 n PRO 105 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 3k88 h MET 106 N 2.40 -0.06 -0.90 -0.52 2.86 -1.94 -1.00 114.93 115.77 3k88 h MET 106 Ca -0.47 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.19 3k88 h MET 106 Cb 1.28 0.01 -0.05 0.00 0.06 0.00 0.00 31.60 32.91 3k88 h MET 106 CO 0.62 -0.04 0.59 0.93 1.06 0.00 0.00 176.91 180.07 3k88 h GLU 107 N -0.06 1.15 0.00 1.72 5.08 -1.90 -0.93 114.58 119.63 3k88 h GLU 107 Ca 0.22 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 3k88 h GLU 107 Cb 0.50 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 3k88 h GLU 107 CO -0.90 0.76 -0.05 1.49 -1.00 0.00 0.00 179.01 179.31 3k88 h GLU 108 N 1.18 0.00 0.00 2.33 4.81 -1.56 -2.02 114.58 119.32 3k88 h GLU 108 Ca 0.35 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.57 3k88 h GLU 108 Cb -0.07 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.31 3k88 h GLU 108 CO -0.10 0.05 -0.04 0.00 -0.73 0.00 0.00 179.01 178.19 3k88 h ARG 109 N 0.00 0.00 -0.47 1.92 3.08 -0.54 -2.02 114.38 116.35 3k88 h ARG 109 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3k88 h ARG 109 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 3k88 h ARG 109 CO 0.01 0.04 0.00 1.19 -1.07 0.00 0.00 179.97 180.14 3k88 n PHE 110 N -3.36 1.18 0.05 3.04 3.72 -0.76 -4.61 117.46 116.71 3k88 n PHE 110 Ca -0.02 -0.68 -0.04 0.00 -0.05 0.00 0.00 57.45 56.67 3k88 n PHE 110 Cb 0.17 -0.24 0.18 0.00 -0.94 0.00 0.00 39.48 38.65 3k88 n PHE 110 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3k88 h ALA 111 N 2.99 1.01 -2.77 4.37 0.00 -1.46 -3.45 119.26 119.97 3k88 h ALA 111 Ca 0.00 -0.42 -0.53 0.00 0.00 0.00 0.00 54.91 53.96 3k88 h ALA 111 Cb 1.35 -0.10 0.07 0.00 0.00 0.00 0.00 17.79 19.11 3k88 h ALA 111 CO 0.21 0.61 0.84 0.34 0.00 0.00 0.00 179.25 181.25 3k88 s ASP 112 N -6.86 6.49 0.61 0.00 -1.08 -1.26 -4.90 116.67 109.66 3k88 s ASP 112 Ca -0.06 2.82 0.38 0.00 -0.52 0.00 0.00 52.55 55.17 3k88 s ASP 112 Cb 0.13 -2.63 2.05 0.00 -1.46 0.00 0.00 42.92 41.02 3k88 s ASP 112 CO 0.79 -0.83 2.15 0.07 0.52 0.00 0.00 175.17 177.87 3k88 h LYS 113 N 5.09 0.00 0.00 4.34 2.10 -2.01 -2.46 116.57 123.64 3k88 h LYS 113 Ca -0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 3k88 h LYS 113 Cb 1.22 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.55 3k88 h LYS 113 CO 0.80 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 178.66 3k88 n GLY 114 N -1.14 -1.23 3.61 0.07 0.00 -1.26 -4.44 105.19 100.80 3k88 n GLY 114 Ca -0.03 0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 3k88 n GLY 114 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3k88 s TRP 115 N -3.35 3.23 0.00 1.61 0.52 -0.93 -1.40 118.94 118.62 3k88 s TRP 115 Ca 0.03 0.71 0.00 0.00 0.02 0.00 0.00 56.10 56.86 3k88 s TRP 115 Cb 0.09 -3.03 0.00 0.00 -1.15 0.00 0.00 33.47 29.38 3k88 s TRP 115 CO 0.37 -0.47 0.00 1.04 0.02 0.00 0.00 176.95 177.91 3k88 n GLN 116 N 5.94 1.04 -4.31 4.98 6.02 -0.68 -4.92 117.38 125.46 3k88 n GLN 116 Ca 0.01 0.00 -0.23 0.00 -0.01 0.00 0.00 57.00 56.76 3k88 n GLN 116 Cb 0.49 0.00 -0.08 0.00 1.02 0.00 0.00 30.24 31.67 3k88 n GLN 116 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 3k88 s THR 117 N -1.46 3.28 0.00 5.09 -4.23 -1.26 -0.65 115.64 116.41 3k88 s THR 117 Ca 0.00 -1.96 0.00 0.00 -1.18 0.00 0.00 61.69 58.55 3k88 s THR 117 Cb 0.00 -2.79 0.00 0.00 1.34 0.00 0.00 72.50 71.05 3k88 s THR 117 CO 0.00 -0.36 0.00 -0.38 -0.54 0.00 0.00 174.62 173.34 3k88 n ILE 118 N -0.88 0.00 -0.00 2.99 5.41 -1.26 -4.91 119.36 120.70 3k88 n ILE 118 Ca -0.06 0.08 -0.01 0.00 1.00 0.00 0.00 62.75 63.76 3k88 n ILE 118 Cb 0.59 -0.99 -0.00 0.00 -0.71 0.00 0.00 39.64 38.53 3k88 n ILE 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3k88 n ALA 119 N -2.18 2.46 0.11 -1.39 0.00 -1.26 -4.86 120.51 113.39 3k88 n ALA 119 Ca 0.00 -0.02 0.09 0.00 0.00 0.00 0.00 53.44 53.51 3k88 n ALA 119 Cb 0.00 0.49 0.01 0.00 0.00 0.00 0.00 19.45 19.95 3k88 n ALA 119 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3k88 h THR 120 N -0.01 0.13 0.00 0.00 1.35 -1.94 -3.47 112.91 108.97 3k88 h THR 120 Ca -0.01 -1.23 0.00 0.00 -0.55 0.00 0.00 66.41 64.61 3k88 h THR 120 Cb 1.02 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 69.14 3k88 h THR 120 CO -0.01 0.07 0.00 0.61 -0.25 0.00 0.00 175.52 175.95 3k88 n GLY 121 N 1.21 1.42 3.76 5.82 0.00 -1.26 -5.02 105.19 111.12 3k88 n GLY 121 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 3k88 n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k88 s ALA 122 N -2.34 2.84 0.21 4.61 0.00 -1.26 -4.27 121.76 121.55 3k88 s ALA 122 Ca 0.00 1.02 -0.30 0.00 0.00 0.00 0.00 51.96 52.68 3k88 s ALA 122 Cb 0.00 -3.43 -0.09 0.00 0.00 0.00 0.00 23.12 19.60 3k88 s ALA 122 CO 0.00 -0.90 1.26 -2.14 0.00 0.00 0.00 175.76 173.98 3k88 s PRO 123 N -2.91 4.43 -0.07 0.00 0.02 -1.26 -4.44 135.00 130.77 3k88 s PRO 123 Ca 0.68 2.00 0.05 0.00 0.02 0.00 0.00 61.00 63.76 3k88 s PRO 123 Cb -0.31 -3.19 -0.01 0.00 0.02 0.00 0.00 34.50 31.01 3k88 s PRO 123 CO 0.36 -0.17 -0.22 0.71 -0.33 0.00 0.00 177.00 177.35 3k88 s TYR 124 N -0.15 2.53 -0.48 6.54 2.02 0.18 -4.56 117.35 123.43 3k88 s TYR 124 Ca 0.54 -0.72 -0.21 0.00 -0.37 0.00 0.00 57.07 56.31 3k88 s TYR 124 Cb -0.35 -1.65 0.04 0.00 -0.40 0.00 0.00 41.96 39.59 3k88 s TYR 124 CO 0.39 -0.22 0.70 0.50 -1.57 0.00 0.00 175.55 175.35 3k88 s ARG 125 N -0.07 3.25 0.51 -0.62 6.06 -1.26 -1.69 118.95 125.14 3k88 s ARG 125 Ca -0.06 -0.49 0.30 0.00 -2.50 0.00 0.00 55.73 52.98 3k88 s ARG 125 Cb -0.14 -4.01 1.24 0.00 0.06 0.00 0.00 34.95 32.09 3k88 s ARG 125 CO 0.05 -1.16 1.94 0.52 -2.50 0.00 0.00 175.30 174.15 3k88 h MET 126 N 8.99 0.00 -0.44 5.12 2.86 -1.61 -1.58 114.93 128.27 3k88 h MET 126 Ca -0.26 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.33 3k88 h MET 126 Cb 1.09 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.72 3k88 h MET 126 CO 0.95 0.08 0.04 -0.40 1.06 0.00 0.00 176.91 178.65 3k88 n ASP 127 N -3.23 4.48 -4.78 1.22 3.85 -1.26 -4.67 116.55 112.16 3k88 n ASP 127 Ca 0.00 -3.09 -0.33 0.00 -0.71 0.00 0.00 54.79 50.66 3k88 n ASP 127 Cb 0.34 -0.63 0.04 0.00 -1.35 0.00 0.00 41.12 39.52 3k88 n ASP 127 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3k88 s ALA 128 N -2.88 2.56 0.25 2.12 0.00 -0.59 -4.79 121.76 118.42 3k88 s ALA 128 Ca 0.48 0.44 -0.03 0.00 0.00 0.00 0.00 51.96 52.85 3k88 s ALA 128 Cb 0.39 -3.28 0.47 0.00 0.00 0.00 0.00 23.12 20.70 3k88 s ALA 128 CO 0.11 -1.15 1.74 0.00 0.00 0.00 0.00 175.76 176.45 3k88 h ALA 129 N 0.03 1.11 -3.32 0.00 0.00 -1.36 -3.42 119.26 112.30 3k88 h ALA 129 Ca -0.46 0.11 -0.19 0.00 0.00 0.00 0.00 54.91 54.36 3k88 h ALA 129 Cb 1.23 0.07 -0.27 0.00 0.00 0.00 0.00 17.79 18.82 3k88 h ALA 129 CO 0.55 -0.19 -0.53 0.08 0.00 0.00 0.00 179.25 179.17 3k88 s VAL 130 N -6.01 -0.00 -0.07 0.00 1.01 -1.20 -4.59 120.40 109.53 3k88 s VAL 130 Ca -0.12 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 61.86 3k88 s VAL 130 Cb 0.21 -0.24 0.03 0.00 0.00 0.00 0.00 36.38 36.37 3k88 s VAL 130 CO 0.77 0.01 0.01 -0.55 0.00 0.00 0.00 175.10 175.33 3k88 s SER 131 N 0.20 1.59 -0.13 3.32 0.15 -1.26 -0.29 113.70 117.28 3k88 s SER 131 Ca -0.01 -0.09 -0.01 0.00 0.70 0.00 0.00 55.95 56.54 3k88 s SER 131 Cb -0.02 -0.43 -0.02 0.00 -1.71 0.00 0.00 66.02 63.84 3k88 s SER 131 CO -0.00 -0.20 -0.08 -0.36 1.20 0.00 0.00 173.24 173.79 3k88 s PHE 132 N 1.98 2.91 -0.18 3.44 0.08 -0.45 -1.92 117.98 123.84 3k88 s PHE 132 Ca 0.05 -0.39 -0.10 0.00 0.12 0.00 0.00 56.93 56.61 3k88 s PHE 132 Cb -0.12 -1.86 -0.05 0.00 -0.57 0.00 0.00 43.02 40.41 3k88 s PHE 132 CO -0.05 -0.05 0.15 0.34 -0.10 0.00 0.00 175.22 175.52 3k88 s ASP 133 N 0.15 6.27 0.06 1.36 2.15 0.53 -1.69 116.67 125.50 3k88 s ASP 133 Ca -0.04 0.31 -0.00 0.00 0.43 0.00 0.00 52.55 53.25 3k88 s ASP 133 Cb -0.14 -2.10 -0.04 0.00 -0.30 0.00 0.00 42.92 40.34 3k88 s ASP 133 CO 0.04 0.21 -0.04 0.00 -0.17 0.00 0.00 175.17 175.21 3k88 s THR 135 N -3.50 2.62 0.23 0.00 -4.23 -0.26 -2.28 115.64 108.22 3k88 s THR 135 Ca 0.05 -0.99 -0.30 0.00 -1.18 0.00 0.00 61.69 59.27 3k88 s THR 135 Cb 0.05 -2.01 -0.10 0.00 1.34 0.00 0.00 72.50 71.78 3k88 s THR 135 CO -0.08 0.52 1.43 -0.63 -0.54 0.00 0.00 174.62 175.32 3k88 s ILE 136 N -0.74 2.78 -0.07 2.99 1.01 -0.47 -0.54 121.20 126.16 3k88 s ILE 136 Ca 0.12 0.64 0.07 0.00 0.00 0.00 0.00 60.65 61.47 3k88 s ILE 136 Cb -0.10 -3.41 -0.09 0.00 0.01 0.00 0.00 42.46 38.86 3k88 s ILE 136 CO 0.01 0.09 0.04 0.00 0.00 0.00 0.00 174.94 175.09 3k88 n ALA 137 N 2.59 1.87 -3.56 9.38 0.00 0.24 -4.86 120.51 126.17 3k88 n ALA 137 Ca 0.07 -0.46 -0.13 0.00 0.00 0.00 0.00 53.44 52.92 3k88 n ALA 137 Cb 0.41 0.05 -0.08 0.00 0.00 0.00 0.00 19.45 19.83 3k88 n ALA 137 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3k88 s ASN 138 N -3.80 -0.69 -0.07 0.00 2.47 -1.12 -5.02 114.94 106.70 3k88 s ASN 138 Ca -0.04 1.31 0.02 0.00 0.42 0.00 0.00 52.86 54.57 3k88 s ASN 138 Cb 0.02 1.32 0.02 0.00 -1.45 0.00 0.00 41.25 41.16 3k88 s ASN 138 CO 0.31 -0.23 -0.11 -0.63 -3.72 0.00 0.00 177.10 172.72 3k88 s ILE 139 N 0.43 1.08 -0.12 -5.21 1.01 -1.26 -0.66 121.20 116.46 3k88 s ILE 139 Ca -0.01 -0.43 0.01 0.00 0.00 0.00 0.00 60.65 60.23 3k88 s ILE 139 Cb -0.05 -1.01 0.02 0.00 0.01 0.00 0.00 42.46 41.43 3k88 s ILE 139 CO -0.00 0.35 -0.14 -0.69 0.00 0.00 0.00 174.94 174.45 3k88 s VAL 140 N 0.85 1.48 -0.20 2.92 1.01 -0.29 -4.95 120.40 121.20 3k88 s VAL 140 Ca -0.11 -0.60 -0.13 0.00 0.00 0.00 0.00 61.98 61.14 3k88 s VAL 140 Cb -0.15 -1.38 -0.05 0.00 0.00 0.00 0.00 36.38 34.81 3k88 s VAL 140 CO 0.02 0.44 0.25 -1.81 0.00 0.00 0.00 175.10 173.99 3k88 s ASP 141 N 1.23 6.29 -0.06 3.32 1.11 -1.26 -0.08 116.67 127.22 3k88 s ASP 141 Ca -0.01 0.32 -0.01 0.00 0.18 0.00 0.00 52.55 53.03 3k88 s ASP 141 Cb -0.14 -2.15 0.03 0.00 1.07 0.00 0.00 42.92 41.73 3k88 s ASP 141 CO -0.06 0.06 -0.00 -0.69 1.18 0.00 0.00 175.17 175.66 3k88 s VAL 142 N 0.86 0.32 0.00 -1.27 1.01 0.33 -4.98 120.40 116.66 3k88 s VAL 142 Ca 0.13 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.21 3k88 s VAL 142 Cb -0.13 -0.45 0.00 0.00 0.00 0.00 0.00 36.38 35.80 3k88 s VAL 142 CO 0.04 0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.97 3k88 n GLY 143 N 4.77 2.89 0.07 4.51 0.00 -1.26 -1.54 105.19 114.62 3k88 n GLY 143 Ca -0.14 -0.08 0.13 0.00 0.00 0.00 0.00 46.02 45.94 3k88 n GLY 143 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k88 n SER 144 N 2.29 0.50 -4.68 1.61 3.41 -1.26 -4.89 113.62 110.60 3k88 n SER 144 Ca 0.00 0.55 -0.27 0.00 -0.26 0.00 0.00 58.87 58.89 3k88 n SER 144 Cb 0.00 -0.69 -0.07 0.00 -0.26 0.00 0.00 64.21 63.19 3k88 n SER 144 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3k88 s HIS 145 N -3.07 2.90 -0.22 7.33 0.09 -0.59 -1.50 115.29 120.24 3k88 s HIS 145 Ca 0.11 -0.11 -0.10 0.00 -0.00 0.00 0.00 55.06 54.96 3k88 s HIS 145 Cb 0.14 -1.42 -0.05 0.00 -0.00 0.00 0.00 32.58 31.26 3k88 s HIS 145 CO 0.55 0.51 0.15 -1.12 -0.00 0.00 0.00 174.74 174.83 3k88 s SER 146 N -2.86 6.18 -0.35 1.40 0.01 0.03 -0.52 113.70 117.59 3k88 s SER 146 Ca 0.28 0.19 -0.14 0.00 1.31 0.00 0.00 55.95 57.59 3k88 s SER 146 Cb -0.10 -2.10 -0.01 0.00 0.21 0.00 0.00 66.02 64.02 3k88 s SER 146 CO 0.19 0.13 0.30 -0.69 0.41 0.00 0.00 173.24 173.58 3k88 s VAL 147 N 0.67 5.23 -0.25 3.43 1.01 0.88 -0.88 120.40 130.49 3k88 s VAL 147 Ca 0.08 -0.12 -0.07 0.00 0.00 0.00 0.00 61.98 61.88 3k88 s VAL 147 Cb -0.12 -3.78 -0.02 0.00 0.00 0.00 0.00 36.38 32.46 3k88 s VAL 147 CO 0.01 -0.07 0.05 -0.63 0.00 0.00 0.00 175.10 174.46 3k88 s ILE 148 N 1.86 4.09 -0.20 2.22 1.01 0.51 -1.14 121.20 129.54 3k88 s ILE 148 Ca 0.09 -0.28 -0.17 0.00 0.00 0.00 0.00 60.65 60.29 3k88 s ILE 148 Cb -0.17 -2.92 -0.04 0.00 0.01 0.00 0.00 42.46 39.34 3k88 s ILE 148 CO 0.11 0.33 0.43 -0.36 0.00 0.00 0.00 174.94 175.45 3k88 s PHE 149 N 1.58 3.37 -0.05 3.97 0.08 0.16 -1.35 117.98 125.74 3k88 s PHE 149 Ca 0.06 0.66 0.04 0.00 0.12 0.00 0.00 56.93 57.80 3k88 s PHE 149 Cb -0.15 -2.57 0.00 0.00 -0.57 0.00 0.00 43.02 39.74 3k88 s PHE 149 CO 0.02 -0.04 -0.15 0.00 -0.10 0.00 0.00 175.22 174.95 3k88 s ALA 150 N 1.40 1.41 0.07 5.36 0.00 -0.00 -0.59 121.76 129.42 3k88 s ALA 150 Ca 0.20 -0.60 -0.21 0.00 0.00 0.00 0.00 51.96 51.36 3k88 s ALA 150 Cb -0.15 -0.51 -0.07 0.00 0.00 0.00 0.00 23.12 22.40 3k88 s ALA 150 CO 0.08 0.23 0.62 -1.21 0.00 0.00 0.00 175.76 175.48 3k88 s GLU 151 N 0.20 4.30 -0.20 0.00 2.02 0.30 -1.50 118.70 123.81 3k88 s GLU 151 Ca -0.07 0.82 -0.23 0.00 0.02 0.00 0.00 54.97 55.52 3k88 s GLU 151 Cb -0.12 -3.27 -0.02 0.00 0.10 0.00 0.00 34.13 30.82 3k88 s GLU 151 CO 0.03 0.55 0.75 0.08 0.02 0.00 0.00 175.26 176.69 3k88 s VAL 152 N -0.86 4.92 -0.09 2.63 1.01 -0.50 -1.10 120.40 126.41 3k88 s VAL 152 Ca 0.31 1.43 0.11 0.00 0.00 0.00 0.00 61.98 63.83 3k88 s VAL 152 Cb -0.20 -4.05 -0.16 0.00 0.00 0.00 0.00 36.38 31.97 3k88 s VAL 152 CO 0.20 0.03 0.27 1.33 0.00 0.00 0.00 175.10 176.92 3k88 n VAL 153 N 4.90 0.00 -3.91 2.92 0.24 0.75 -4.83 118.33 118.40 3k88 n VAL 153 Ca 0.03 -0.24 -0.08 0.00 -2.04 0.00 0.00 64.34 62.00 3k88 n VAL 153 Cb 0.49 0.38 -0.03 0.00 -1.47 0.00 0.00 33.84 33.21 3k88 n VAL 153 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3k88 s ALA 154 N -2.61 -0.85 0.15 2.33 0.00 -1.03 -4.99 121.76 114.77 3k88 s ALA 154 Ca -0.03 -0.53 -0.10 0.00 0.00 0.00 0.00 51.96 51.30 3k88 s ALA 154 Cb 0.07 0.93 -0.00 0.00 0.00 0.00 0.00 23.12 24.12 3k88 s ALA 154 CO 0.44 -0.97 0.30 -0.98 0.00 0.00 0.00 175.76 174.55 3k88 s ARG 155 N -3.93 1.12 0.79 0.00 1.04 -1.26 -0.35 118.95 116.36 3k88 s ARG 155 Ca 0.15 -1.07 -0.04 0.00 -1.04 0.00 0.00 55.73 53.74 3k88 s ARG 155 Cb -0.04 0.39 0.16 0.00 -2.04 0.00 0.00 34.95 33.42 3k88 s ARG 155 CO 0.08 -0.41 1.09 0.54 -0.04 0.00 0.00 175.30 176.56 3k88 s ASN 156 N -2.93 3.95 -0.44 -2.89 4.22 -0.81 -4.99 114.94 111.05 3k88 s ASN 156 Ca 0.13 -0.31 0.06 0.00 -2.14 0.00 0.00 52.86 50.60 3k88 s ASN 156 Cb 0.03 0.08 0.22 0.00 1.28 0.00 0.00 41.25 42.85 3k88 s ASN 156 CO -0.03 -2.15 0.48 1.41 -2.04 0.00 0.00 177.10 174.77 3k88 n HIS 157 N -3.09 0.07 -3.61 1.54 8.25 -1.26 -4.84 115.22 112.28 3k88 n HIS 157 Ca 0.16 -3.58 -0.30 0.00 -0.26 0.00 0.00 57.72 53.74 3k88 n HIS 157 Cb 0.60 -0.17 -0.04 0.00 1.12 0.00 0.00 29.99 31.50 3k88 n HIS 157 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3k88 s ALA 158 N -0.90 3.76 -0.18 -1.41 0.00 -1.26 -5.04 121.76 116.73 3k88 s ALA 158 Ca 0.34 -0.59 -0.22 0.00 0.00 0.00 0.00 51.96 51.49 3k88 s ALA 158 Cb 0.11 -2.15 -0.19 0.00 0.00 0.00 0.00 23.12 20.89 3k88 s ALA 158 CO -0.14 0.56 0.34 0.93 0.00 0.00 0.00 175.76 177.45 3k88 h GLU 159 N 2.50 0.00 -6.06 0.00 5.08 -1.91 -3.46 114.58 110.73 3k88 h GLU 159 Ca -0.47 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.33 3k88 h GLU 159 Cb 1.17 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.37 3k88 h GLU 159 CO 0.71 0.89 0.38 -1.21 -1.00 0.00 0.00 179.01 178.77 3k88 s GLU 160 N -2.28 4.37 -0.00 2.33 2.02 -1.26 -4.94 118.70 118.94 3k88 s GLU 160 Ca -0.24 1.11 0.00 0.00 0.02 0.00 0.00 54.97 55.86 3k88 s GLU 160 Cb 0.03 -3.54 0.00 0.00 0.10 0.00 0.00 34.13 30.72 3k88 s GLU 160 CO 0.57 -0.24 0.95 0.00 0.02 0.00 0.00 175.26 176.56 3k88 n THR 162 N -0.01 0.35 -2.94 0.00 -1.04 -1.26 -4.90 114.28 104.47 3k88 n THR 162 Ca 0.00 -0.06 -0.36 0.00 -2.04 0.00 0.00 64.05 61.59 3k88 n THR 162 Cb 0.68 -1.73 -0.06 0.00 -1.82 0.00 0.00 70.33 67.40 3k88 n THR 162 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 3k88 s PRO 163 N 2.80 4.38 -0.12 -2.82 0.05 -1.26 0.34 135.00 138.37 3k88 s PRO 163 Ca 0.87 1.08 -0.23 0.00 0.05 0.00 0.00 61.00 62.77 3k88 s PRO 163 Cb -0.69 -2.76 -0.03 0.00 0.05 0.00 0.00 34.50 31.07 3k88 s PRO 163 CO 0.46 0.29 0.71 -1.17 0.05 0.00 0.00 177.00 177.35 3k88 s LEU 164 N -2.17 4.24 0.20 -3.56 2.96 -0.56 -3.84 118.68 115.95 3k88 s LEU 164 Ca 0.48 1.10 0.11 0.00 -0.22 0.00 0.00 54.13 55.60 3k88 s LEU 164 Cb -0.16 -3.07 -0.04 0.00 0.50 0.00 0.00 46.19 43.42 3k88 s LEU 164 CO 0.21 -0.21 -0.23 -0.63 -1.32 0.00 0.00 176.35 174.17 3k88 s ILE 165 N 1.36 2.33 -0.07 6.68 -1.09 -0.04 -2.78 121.20 127.59 3k88 s ILE 165 Ca 0.35 -2.07 0.03 0.00 -2.23 0.00 0.00 60.65 56.73 3k88 s ILE 165 Cb -0.17 -2.13 0.01 0.00 -1.58 0.00 0.00 42.46 38.59 3k88 s ILE 165 CO 0.15 -0.17 -0.15 -0.47 -1.23 0.00 0.00 174.94 173.07 3k88 s TYR 166 N -1.81 1.68 -0.27 3.97 5.04 -0.09 -0.69 117.35 125.18 3k88 s TYR 166 Ca 0.22 -0.61 -0.14 0.00 -2.44 0.00 0.00 57.07 54.10 3k88 s TYR 166 Cb -0.07 -1.19 0.09 0.00 0.35 0.00 0.00 41.96 41.14 3k88 s TYR 166 CO 0.10 -0.27 0.65 -1.58 -1.34 0.00 0.00 175.55 173.11 3k88 s HIS 167 N 0.47 -1.06 -1.43 4.97 5.65 -0.41 -1.51 115.29 121.98 3k88 s HIS 167 Ca -0.13 2.07 -0.04 0.00 0.25 0.00 0.00 55.06 57.21 3k88 s HIS 167 Cb -0.15 0.62 0.00 0.00 -1.18 0.00 0.00 32.58 31.87 3k88 s HIS 167 CO 0.04 -0.53 0.29 0.54 -0.65 0.00 0.00 174.74 174.44 3k88 n ARG 168 N 4.49 -1.97 -1.28 2.88 1.74 0.50 -1.75 116.66 121.27 3k88 n ARG 168 Ca -0.19 0.25 -0.10 0.00 -0.77 0.00 0.00 57.85 57.05 3k88 n ARG 168 Cb 0.57 -3.95 -0.04 0.00 -1.02 0.00 0.00 32.46 28.01 3k88 n ARG 168 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3k88 n ARG 169 N -4.52 -0.96 -4.11 5.56 1.74 -1.26 -4.98 116.66 108.14 3k88 n ARG 169 Ca -0.29 0.79 -0.11 0.00 -0.77 0.00 0.00 57.85 57.47 3k88 n ARG 169 Cb 0.68 -4.79 -0.08 0.00 -1.02 0.00 0.00 32.46 27.25 3k88 n ARG 169 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 3k88 s GLN 170 N -2.62 1.38 0.57 5.56 -2.07 -0.72 -5.16 119.66 116.60 3k88 s GLN 170 Ca 0.00 -1.46 -0.16 0.00 -1.82 0.00 0.00 55.36 51.92 3k88 s GLN 170 Cb 0.00 0.37 -0.05 0.00 -1.09 0.00 0.00 33.01 32.24 3k88 s GLN 170 CO 0.00 -0.52 1.04 0.71 -1.32 0.00 0.00 175.29 175.21 3k88 s TYR 171 N -4.07 3.08 0.37 9.60 2.02 -1.26 -1.29 117.35 125.80 3k88 s TYR 171 Ca 0.31 1.50 -0.14 0.00 -0.37 0.00 0.00 57.07 58.38 3k88 s TYR 171 Cb 0.03 -2.97 0.04 0.00 -0.40 0.00 0.00 41.96 38.67 3k88 s TYR 171 CO 0.11 -0.96 0.73 0.00 -1.57 0.00 0.00 175.55 173.86 3k88 s ALA 172 N -2.47 -0.53 0.00 3.71 0.00 0.14 -4.88 121.76 117.73 3k88 s ALA 172 Ca 0.63 -0.84 0.00 0.00 0.00 0.00 0.00 51.96 51.75 3k88 s ALA 172 Cb -0.15 0.78 0.00 0.00 0.00 0.00 0.00 23.12 23.75 3k88 s ALA 172 CO 0.35 -0.96 0.00 -2.37 0.00 0.00 0.00 175.76 172.78 3k88 n THR 173 N -0.53 0.00 -3.81 0.00 5.66 -1.26 -0.86 114.28 113.48 3k88 n THR 173 Ca -0.06 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.73 3k88 n THR 173 Cb 0.60 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.35 3k88 n THR 173 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3k88 s THR 174 N -1.52 3.60 0.02 1.09 -4.23 -1.26 -4.89 115.64 108.45 3k88 s THR 174 Ca 0.00 -1.35 -0.05 0.00 -1.18 0.00 0.00 61.69 59.11 3k88 s THR 174 Cb 0.00 -3.21 -0.01 0.00 1.34 0.00 0.00 72.50 70.63 3k88 s THR 174 CO 0.00 -0.18 0.09 -0.60 -0.54 0.00 0.00 174.62 173.39 3k88 s ARG 175 N -4.00 0.51 0.50 3.99 3.52 -1.26 -5.04 118.95 117.18 3k88 s ARG 175 Ca 0.41 -0.60 -0.20 0.00 -0.13 0.00 0.00 55.73 55.20 3k88 s ARG 175 Cb -0.06 0.20 -0.07 0.00 -1.56 0.00 0.00 34.95 33.46 3k88 s ARG 175 CO 0.27 -0.12 1.09 -1.12 -0.81 0.00 0.00 175.30 174.61 3k88 s SER 176 N -1.75 6.07 0.00 -2.12 0.01 -1.26 -5.27 113.70 109.38 3k88 s SER 176 Ca -0.10 2.08 0.00 0.00 1.31 0.00 0.00 55.95 59.24 3k88 s SER 176 Cb -0.05 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.61 3k88 s SER 176 CO -0.02 -0.98 0.00 0.18 0.41 0.00 0.00 173.24 172.84