#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k87 s GLU 15 N 0.00 4.12 0.66 -1.08 0.41 -1.26 -5.02 118.70 116.52 3k87 s GLU 15 Ca 0.00 2.05 -0.13 0.00 -0.41 0.00 0.00 54.97 56.48 3k87 s GLU 15 Cb 0.00 -2.83 -0.01 0.00 -1.78 0.00 0.00 34.13 29.51 3k87 s GLU 15 CO 0.00 -0.33 1.06 0.95 -0.49 0.00 0.00 175.26 176.45 3k87 s THR 16 N -1.27 3.96 0.76 3.63 -4.23 -1.26 -5.03 115.64 112.20 3k87 s THR 16 Ca 0.54 0.74 -0.14 0.00 -1.18 0.00 0.00 61.69 61.66 3k87 s THR 16 Cb -0.36 -3.40 0.06 0.00 1.34 0.00 0.00 72.50 70.14 3k87 s THR 16 CO 0.46 -0.73 1.18 0.68 -0.54 0.00 0.00 174.62 175.67 3k87 s VAL 17 N -2.83 2.38 0.43 2.29 -7.23 -1.26 -4.97 120.40 109.21 3k87 s VAL 17 Ca 0.60 0.17 -0.26 0.00 -1.81 0.00 0.00 61.98 60.68 3k87 s VAL 17 Cb -0.15 -2.65 -0.09 0.00 0.56 0.00 0.00 36.38 34.06 3k87 s VAL 17 CO 0.48 -0.11 1.44 0.00 -0.31 0.00 0.00 175.10 176.60 3k87 s ALA 18 N -2.16 3.33 0.29 1.32 0.00 -1.26 -4.84 121.76 118.43 3k87 s ALA 18 Ca 0.72 1.49 0.04 0.00 0.00 0.00 0.00 51.96 54.21 3k87 s ALA 18 Cb -0.27 -3.60 0.71 0.00 0.00 0.00 0.00 23.12 19.96 3k87 s ALA 18 CO 0.48 -1.16 1.73 0.77 0.00 0.00 0.00 175.76 177.58 3k87 h SER 19 N 2.51 0.50 -0.80 0.00 0.02 -2.00 -0.48 113.55 113.30 3k87 h SER 19 Ca -0.51 0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 60.55 3k87 h SER 19 Cb 1.26 0.06 -0.04 0.00 0.14 0.00 0.00 62.40 63.82 3k87 h SER 19 CO 0.62 0.11 0.44 0.15 -1.14 0.00 0.00 176.83 177.01 3k87 h PHE 20 N 0.54 1.10 -0.53 3.45 3.57 -2.00 -1.63 116.94 121.45 3k87 h PHE 20 Ca 0.55 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 62.01 3k87 h PHE 20 Cb 0.96 -0.35 -0.02 0.00 2.79 0.00 0.00 35.95 39.32 3k87 h PHE 20 CO -0.08 0.77 0.25 -0.44 -2.23 0.00 0.00 178.31 176.57 3k87 h ASP 21 N 1.12 0.69 -0.09 0.41 3.32 -1.49 -1.84 116.42 118.54 3k87 h ASP 21 Ca 0.28 -0.13 0.04 0.00 0.02 0.00 0.00 57.03 57.24 3k87 h ASP 21 Cb 0.03 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.36 3k87 h ASP 21 CO -0.05 0.63 -0.17 0.15 -1.72 0.00 0.00 179.24 178.09 3k87 h PHE 22 N 0.70 -0.43 -0.56 4.55 3.04 -0.90 -0.02 116.94 123.33 3k87 h PHE 22 Ca 0.18 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 62.12 3k87 h PHE 22 Cb 0.12 0.20 -0.03 0.00 2.56 0.00 0.00 35.95 38.81 3k87 h PHE 22 CO -0.00 -0.24 0.24 0.00 -2.02 0.00 0.00 178.31 176.29 3k87 h ARG 23 N -0.23 0.83 -0.12 1.11 3.08 -1.23 -1.15 114.38 116.66 3k87 h ARG 23 Ca 0.08 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 59.99 3k87 h ARG 23 Cb 0.34 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3k87 h ARG 23 CO -0.22 0.70 0.08 0.22 -1.07 0.00 0.00 179.97 179.68 3k87 h ASP 24 N 0.76 0.14 -0.53 7.04 -0.00 -1.16 -2.04 116.42 120.64 3k87 h ASP 24 Ca 0.19 -0.03 0.06 0.00 -0.00 0.00 0.00 57.03 57.25 3k87 h ASP 24 Cb 0.17 -0.04 -0.05 0.00 -0.00 0.00 0.00 39.33 39.41 3k87 h ASP 24 CO -0.02 0.13 0.24 0.00 -0.00 0.00 0.00 179.24 179.59 3k87 h ALA 25 N 1.02 0.67 -0.56 -0.78 0.00 -0.71 -2.03 119.26 116.88 3k87 h ALA 25 Ca 0.04 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.01 3k87 h ALA 25 Cb 0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3k87 h ALA 25 CO -0.01 -0.13 0.37 -0.07 0.00 0.00 0.00 179.25 179.41 3k87 h LEU 26 N 0.46 0.61 -2.58 0.00 3.38 -0.73 -0.64 115.31 115.82 3k87 h LEU 26 Ca 0.24 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.21 3k87 h LEU 26 Cb 0.20 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 3k87 h LEU 26 CO -0.20 0.44 0.13 0.77 0.09 0.00 0.00 178.44 179.67 3k87 h SER 27 N 0.72 0.00 0.39 -0.43 4.64 -0.67 -0.78 113.55 117.43 3k87 h SER 27 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 3k87 h SER 27 Cb -0.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 3k87 h SER 27 CO -0.05 0.00 -0.73 0.29 -0.87 0.00 0.00 176.83 175.47 3k87 n LYS 28 N -3.14 0.07 -2.10 4.77 5.02 -0.25 -0.78 118.16 121.76 3k87 n LYS 28 Ca -0.02 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.00 3k87 n LYS 28 Cb 0.20 -1.53 0.11 0.00 -0.02 0.00 0.00 35.03 33.79 3k87 n LYS 28 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3k87 s ALA 29 N -3.05 2.83 0.20 7.82 0.00 -0.30 -4.87 121.76 124.39 3k87 s ALA 29 Ca 0.09 -1.04 0.09 0.00 0.00 0.00 0.00 51.96 51.10 3k87 s ALA 29 Cb 0.16 -2.67 -0.04 0.00 0.00 0.00 0.00 23.12 20.57 3k87 s ALA 29 CO 0.76 -1.75 -0.18 -1.54 0.00 0.00 0.00 175.76 173.04 3k87 s SER 30 N -4.67 2.92 0.03 0.00 1.04 -1.26 -4.36 113.70 107.40 3k87 s SER 30 Ca 0.66 -0.93 -0.08 0.00 0.48 0.00 0.00 55.95 56.07 3k87 s SER 30 Cb -0.08 -0.19 -0.00 0.00 0.10 0.00 0.00 66.02 65.85 3k87 s SER 30 CO 0.48 -0.04 0.15 0.42 0.98 0.00 0.00 173.24 175.23 3k87 s THR 31 N -2.33 0.11 1.36 2.02 -4.23 -0.98 -5.01 115.64 106.59 3k87 s THR 31 Ca 0.21 -0.94 -0.20 0.00 -1.18 0.00 0.00 61.69 59.58 3k87 s THR 31 Cb -0.05 -0.84 0.35 0.00 1.34 0.00 0.00 72.50 73.30 3k87 s THR 31 CO 0.09 -0.52 0.95 -2.16 -0.54 0.00 0.00 174.62 172.44 3k87 s PRO 32 N -2.42 -2.45 -0.12 3.99 0.04 -1.26 -1.01 135.00 131.77 3k87 s PRO 32 Ca -0.06 0.35 -0.00 0.00 0.04 0.00 0.00 61.00 61.33 3k87 s PRO 32 Cb -0.02 -1.41 0.02 0.00 0.04 0.00 0.00 34.50 33.13 3k87 s PRO 32 CO -0.03 -4.61 -0.09 0.08 0.04 0.00 0.00 177.00 172.38 3k87 s VAL 33 N -2.30 1.16 0.39 -0.36 1.01 -1.07 -4.56 120.40 114.68 3k87 s VAL 33 Ca 0.69 -0.38 0.08 0.00 0.00 0.00 0.00 61.98 62.36 3k87 s VAL 33 Cb -0.17 -1.15 -0.06 0.00 0.00 0.00 0.00 36.38 35.00 3k87 s VAL 33 CO 0.60 0.39 0.09 0.42 0.00 0.00 0.00 175.10 176.60 3k87 s THR 34 N 1.58 2.37 -0.11 3.92 -4.23 -0.52 -0.94 115.64 117.72 3k87 s THR 34 Ca 0.04 -1.85 0.03 0.00 -1.18 0.00 0.00 61.69 58.73 3k87 s THR 34 Cb -0.13 -2.93 -0.00 0.00 1.34 0.00 0.00 72.50 70.78 3k87 s THR 34 CO -0.08 -0.07 -0.21 -0.69 -0.54 0.00 0.00 174.62 173.03 3k87 s VAL 35 N -2.59 2.34 -0.22 2.29 1.01 0.50 -1.39 120.40 122.33 3k87 s VAL 35 Ca 0.38 -0.92 -0.09 0.00 0.00 0.00 0.00 61.98 61.35 3k87 s VAL 35 Cb 0.04 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 3k87 s VAL 35 CO 0.21 0.55 0.10 -0.69 0.00 0.00 0.00 175.10 175.27 3k87 s VAL 36 N 0.34 4.93 0.21 2.92 1.01 -0.39 -1.07 120.40 128.35 3k87 s VAL 36 Ca -0.17 0.03 0.08 0.00 0.00 0.00 0.00 61.98 61.92 3k87 s VAL 36 Cb -0.17 -3.27 -0.05 0.00 0.00 0.00 0.00 36.38 32.89 3k87 s VAL 36 CO 0.08 0.39 -0.15 0.00 0.00 0.00 0.00 175.10 175.42 3k87 s ALA 37 N 0.86 2.08 0.11 5.51 0.00 -0.76 -0.92 121.76 128.64 3k87 s ALA 37 Ca 0.05 -1.68 -0.13 0.00 0.00 0.00 0.00 51.96 50.21 3k87 s ALA 37 Cb -0.13 -0.10 0.02 0.00 0.00 0.00 0.00 23.12 22.90 3k87 s ALA 37 CO 0.03 0.09 0.31 -0.08 0.00 0.00 0.00 175.76 176.10 3k87 s THR 38 N -2.93 0.10 0.15 0.00 -1.32 0.11 -0.71 115.64 111.04 3k87 s THR 38 Ca 0.23 -0.85 -0.20 0.00 -1.21 0.00 0.00 61.69 59.66 3k87 s THR 38 Cb -0.01 -1.25 0.06 0.00 -1.51 0.00 0.00 72.50 69.78 3k87 s THR 38 CO 0.08 -0.46 0.53 0.21 -2.21 0.00 0.00 174.62 172.77 3k87 s ASN 39 N -2.83 -0.45 0.00 8.08 3.04 -1.26 -2.67 114.94 118.86 3k87 s ASN 39 Ca 0.04 -0.11 0.00 0.00 0.04 0.00 0.00 52.86 52.83 3k87 s ASN 39 Cb 0.03 0.55 0.00 0.00 -1.54 0.00 0.00 41.25 40.29 3k87 s ASN 39 CO -0.11 -0.92 0.00 0.61 -3.04 0.00 0.00 177.10 173.63 3k87 n GLY 40 N -0.31 -0.22 0.30 1.21 0.00 -1.22 -4.44 105.19 100.51 3k87 n GLY 40 Ca -0.17 -1.21 0.15 0.00 0.00 0.00 0.00 46.02 44.79 3k87 n GLY 40 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3k87 h PRO 41 N 0.00 0.00 -0.30 1.61 0.11 -1.93 0.30 132.00 131.80 3k87 h PRO 41 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 3k87 h PRO 41 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3k87 h PRO 41 CO 0.00 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 178.98 3k87 n PHE 42 N -3.86 0.38 0.00 0.65 3.01 -1.26 -5.05 117.46 111.33 3k87 n PHE 42 Ca -0.03 -0.19 0.00 0.00 1.01 0.00 0.00 57.45 58.24 3k87 n PHE 42 Cb 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.56 3k87 n PHE 42 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3k87 n GLY 43 N 1.40 -2.03 3.82 1.37 0.00 0.09 -4.93 105.19 104.92 3k87 n GLY 43 Ca 0.18 -2.16 -0.38 0.00 0.00 0.00 0.00 46.02 43.66 3k87 n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k87 s LEU 44 N 0.00 4.48 -0.00 0.99 1.02 -1.26 -3.41 118.68 120.50 3k87 s LEU 44 Ca 0.00 1.23 -0.28 0.00 0.02 0.00 0.00 54.13 55.10 3k87 s LEU 44 Cb 0.00 -3.00 0.09 0.00 0.02 0.00 0.00 46.19 43.30 3k87 s LEU 44 CO 0.00 0.23 0.79 0.00 0.02 0.00 0.00 176.35 177.39 3k87 s ALA 45 N -1.20 -1.78 0.21 4.21 0.00 -1.09 -4.68 121.76 117.44 3k87 s ALA 45 Ca 0.31 1.06 -0.22 0.00 0.00 0.00 0.00 51.96 53.12 3k87 s ALA 45 Cb -0.18 0.22 0.05 0.00 0.00 0.00 0.00 23.12 23.20 3k87 s ALA 45 CO 0.19 -0.56 0.64 0.20 0.00 0.00 0.00 175.76 176.23 3k87 s GLY 46 N -1.98 -0.36 0.15 0.00 0.00 -1.26 -0.71 107.32 103.16 3k87 s GLY 46 Ca -0.01 0.10 -0.14 0.00 0.00 0.00 0.00 44.72 44.67 3k87 s GLY 46 CO -0.04 0.02 0.39 0.48 0.00 0.00 0.00 173.10 173.95 3k87 s LEU 47 N -2.83 0.56 0.03 0.66 2.34 -0.10 -4.82 118.68 114.53 3k87 s LEU 47 Ca 0.06 -0.54 -0.21 0.00 0.06 0.00 0.00 54.13 53.49 3k87 s LEU 47 Cb -0.03 1.68 -0.06 0.00 -0.56 0.00 0.00 46.19 47.23 3k87 s LEU 47 CO -0.04 -0.91 0.63 0.28 -1.06 0.00 0.00 176.35 175.25 3k87 s THR 48 N -3.87 4.80 -0.03 5.48 -1.32 -0.68 -1.26 115.64 118.76 3k87 s THR 48 Ca 0.08 1.34 0.00 0.00 -1.21 0.00 0.00 61.69 61.91 3k87 s THR 48 Cb 0.02 -3.97 0.03 0.00 -1.51 0.00 0.00 72.50 67.06 3k87 s THR 48 CO -0.06 0.45 -0.00 0.00 -2.21 0.00 0.00 174.62 172.79 3k87 n SER 50 N 4.11 0.73 -4.40 0.00 3.41 -1.26 -1.43 113.62 114.77 3k87 n SER 50 Ca -0.27 -0.86 -0.44 0.00 -0.26 0.00 0.00 58.87 57.03 3k87 n SER 50 Cb 0.50 0.76 0.00 0.00 -0.26 0.00 0.00 64.21 65.21 3k87 n SER 50 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k87 n ALA 51 N -0.78 4.05 -2.99 7.33 0.00 -1.26 -4.74 120.51 122.12 3k87 n ALA 51 Ca 0.03 -4.41 -0.12 0.00 0.00 0.00 0.00 53.44 48.93 3k87 n ALA 51 Cb 0.16 -2.82 -0.13 0.00 0.00 0.00 0.00 19.45 16.66 3k87 n ALA 51 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3k87 s VAL 52 N 0.42 0.01 0.23 0.00 1.01 -1.26 -0.78 120.40 120.03 3k87 s VAL 52 Ca 0.38 -0.09 -0.19 0.00 0.00 0.00 0.00 61.98 62.08 3k87 s VAL 52 Cb -0.05 -0.18 0.02 0.00 0.00 0.00 0.00 36.38 36.17 3k87 s VAL 52 CO -0.03 -0.05 0.60 0.00 0.00 0.00 0.00 175.10 175.63 3k87 s SER 54 N -2.90 6.85 -0.01 0.00 1.04 -1.26 -1.07 113.70 116.34 3k87 s SER 54 Ca 0.11 1.38 -0.06 0.00 0.48 0.00 0.00 55.95 57.86 3k87 s SER 54 Cb -0.03 -2.41 -0.02 0.00 0.10 0.00 0.00 66.02 63.65 3k87 s SER 54 CO 0.02 -0.20 -0.12 0.52 0.98 0.00 0.00 173.24 174.44 3k87 n VAL 55 N -0.24 1.21 -3.98 5.02 0.31 0.28 -4.88 118.33 116.04 3k87 n VAL 55 Ca 0.03 0.25 -0.09 0.00 -0.01 0.00 0.00 64.34 64.52 3k87 n VAL 55 Cb 0.53 -1.82 -0.05 0.00 -0.91 0.00 0.00 33.84 31.59 3k87 n VAL 55 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3k87 n ASP 57 N -0.47 2.38 -3.41 0.00 5.68 -1.26 -1.65 116.55 117.82 3k87 n ASP 57 Ca -0.02 -1.69 -0.17 0.00 -0.50 0.00 0.00 54.79 52.41 3k87 n ASP 57 Cb 0.61 0.14 -0.10 0.00 -1.14 0.00 0.00 41.12 40.63 3k87 n ASP 57 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 3k87 s ARG 58 N -1.78 0.30 0.61 0.11 3.52 -1.26 -1.74 118.95 118.73 3k87 s ARG 58 Ca 0.21 -0.06 -0.15 0.00 -0.13 0.00 0.00 55.73 55.60 3k87 s ARG 58 Cb 0.16 -0.73 -0.03 0.00 -1.56 0.00 0.00 34.95 32.79 3k87 s ARG 58 CO 0.31 -0.95 1.07 -1.25 -0.81 0.00 0.00 175.30 173.67 3k87 s PRO 59 N 2.36 3.17 -0.29 5.12 0.04 -1.26 -5.05 135.00 139.09 3k87 s PRO 59 Ca 0.09 1.23 -0.31 0.00 0.04 0.00 0.00 61.00 62.06 3k87 s PRO 59 Cb -0.14 -2.01 -0.08 0.00 0.04 0.00 0.00 34.50 32.31 3k87 s PRO 59 CO -0.29 -0.93 2.23 -0.35 0.04 0.00 0.00 177.00 177.70 3k87 n PRO 60 N -2.19 1.54 -4.42 0.56 -0.04 -0.71 -4.64 135.00 125.10 3k87 n PRO 60 Ca 0.09 0.40 -0.20 0.00 -0.04 0.00 0.00 63.50 63.75 3k87 n PRO 60 Cb 0.53 -2.93 -0.15 0.00 -0.04 0.00 0.00 33.50 30.90 3k87 n PRO 60 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 3k87 s THR 61 N 8.21 0.82 0.32 0.52 2.01 -0.66 -0.20 115.64 126.65 3k87 s THR 61 Ca 1.05 -0.39 0.10 0.00 0.31 0.00 0.00 61.69 62.76 3k87 s THR 61 Cb -0.54 -0.72 -0.06 0.00 0.01 0.00 0.00 72.50 71.20 3k87 s THR 61 CO 0.40 0.25 -0.08 0.68 -0.69 0.00 0.00 174.62 175.18 3k87 s VAL 62 N 0.11 2.50 0.16 3.82 -7.23 -0.01 -0.56 120.40 119.19 3k87 s VAL 62 Ca -0.02 -2.17 0.06 0.00 -1.81 0.00 0.00 61.98 58.04 3k87 s VAL 62 Cb -0.08 -2.62 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 3k87 s VAL 62 CO 0.00 -0.26 -0.12 -1.48 -0.31 0.00 0.00 175.10 172.93 3k87 s LEU 63 N -3.62 2.52 -0.08 1.32 0.05 -0.23 -0.57 118.68 118.06 3k87 s LEU 63 Ca 0.32 -0.98 -0.13 0.00 0.05 0.00 0.00 54.13 53.39 3k87 s LEU 63 Cb -0.01 -0.50 0.03 0.00 -2.05 0.00 0.00 46.19 43.66 3k87 s LEU 63 CO 0.17 -0.24 0.33 -1.48 -0.55 0.00 0.00 176.35 174.59 3k87 s LEU 64 N -3.08 0.74 -0.25 1.48 0.05 -0.66 -2.05 118.68 114.90 3k87 s LEU 64 Ca 0.17 0.45 -0.02 0.00 0.05 0.00 0.00 54.13 54.79 3k87 s LEU 64 Cb -0.00 1.23 0.03 0.00 -2.05 0.00 0.00 46.19 45.40 3k87 s LEU 64 CO 0.03 -0.26 -0.05 0.00 -0.55 0.00 0.00 176.35 175.52 3k87 s ILE 66 N 1.32 1.16 0.14 0.00 -4.36 -0.45 -4.66 121.20 114.35 3k87 s ILE 66 Ca -0.00 -0.60 -0.31 0.00 -0.26 0.00 0.00 60.65 59.47 3k87 s ILE 66 Cb -0.17 -0.98 -0.10 0.00 1.25 0.00 0.00 42.46 42.46 3k87 s ILE 66 CO -0.04 0.33 1.66 0.21 0.24 0.00 0.00 174.94 177.35 3k87 s ASN 67 N -0.17 6.53 0.62 4.36 3.84 -1.26 -1.27 114.94 127.58 3k87 s ASN 67 Ca 0.02 2.65 0.42 0.00 0.21 0.00 0.00 52.86 56.16 3k87 s ASN 67 Cb -0.07 -2.58 2.24 0.00 -0.55 0.00 0.00 41.25 40.28 3k87 s ASN 67 CO 0.00 -0.90 2.27 0.03 -2.79 0.00 0.00 177.10 175.72 3k87 h ARG 68 N 7.52 0.00 0.00 0.43 3.08 -1.55 -1.36 114.38 122.50 3k87 h ARG 68 Ca -0.43 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.57 3k87 h ARG 68 Cb 1.21 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.25 3k87 h ARG 68 CO 0.93 0.00 -0.22 0.87 -1.07 0.00 0.00 179.97 180.48 3k87 h LYS 69 N 0.00 0.00 -6.60 0.04 6.56 -1.89 -3.45 116.57 111.23 3k87 h LYS 69 Ca 0.00 0.00 -0.58 0.00 -1.06 0.00 0.00 60.65 59.01 3k87 h LYS 69 Cb 0.03 0.00 0.09 0.00 -0.57 0.00 0.00 32.23 31.78 3k87 h LYS 69 CO 0.00 0.22 0.52 0.45 -2.06 0.00 0.00 179.45 178.58 3k87 n SER 70 N -3.38 2.53 -0.03 0.86 2.88 -0.52 -4.85 113.62 111.11 3k87 n SER 70 Ca 0.00 1.16 0.06 0.00 -1.33 0.00 0.00 58.87 58.77 3k87 n SER 70 Cb 0.43 -1.42 0.44 0.00 -0.75 0.00 0.00 64.21 62.92 3k87 n SER 70 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 3k87 h TYR 71 N 3.49 0.51 0.00 0.66 3.20 -1.89 -2.58 116.97 120.35 3k87 h TYR 71 Ca -0.45 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.44 3k87 h TYR 71 Cb 1.29 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 39.39 3k87 h TYR 71 CO 0.54 0.30 0.00 0.00 -1.64 0.00 0.00 178.16 177.35 3k87 h ALA 72 N 1.72 1.00 0.03 1.82 0.00 -1.88 -3.35 119.26 118.60 3k87 h ALA 72 Ca 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3k87 h ALA 72 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3k87 h ALA 72 CO -0.05 0.00 -0.02 0.00 0.00 0.00 0.00 179.25 179.19 3k87 h ALA 73 N 2.08 -0.04 -0.58 0.00 0.00 -1.73 -0.47 119.26 118.51 3k87 h ALA 73 Ca 0.00 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 3k87 h ALA 73 Cb 0.74 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 3k87 h ALA 73 CO 0.00 -0.52 0.09 0.78 0.00 0.00 0.00 179.25 179.61 3k87 h GLY 74 N -0.06 1.03 0.93 0.00 0.00 -1.74 -1.28 103.07 101.95 3k87 h GLY 74 Ca -0.00 -0.69 -0.06 0.00 0.00 0.00 0.00 47.33 46.57 3k87 h GLY 74 CO 0.01 0.64 -0.03 -2.22 0.00 0.00 0.00 176.54 174.94 3k87 h ILE 75 N 0.86 1.27 -0.04 2.60 2.04 -1.67 0.12 117.51 122.68 3k87 h ILE 75 Ca 0.18 -1.04 0.02 0.00 1.00 0.00 0.00 64.86 65.01 3k87 h ILE 75 Cb 0.42 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 3k87 h ILE 75 CO 0.01 0.34 -0.06 0.40 0.00 0.00 0.00 178.15 178.85 3k87 h ILE 76 N 0.46 0.83 -0.28 -0.67 2.04 -0.94 -1.12 117.51 117.84 3k87 h ILE 76 Ca 0.10 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.85 3k87 h ILE 76 Cb 0.51 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 3k87 h ILE 76 CO 0.02 0.00 -0.29 0.11 0.00 0.00 0.00 178.15 178.00 3k87 h LYS 77 N -0.08 0.56 -0.07 2.37 1.57 -1.04 -2.03 116.57 117.85 3k87 h LYS 77 Ca 0.04 -0.24 -0.12 0.00 -1.87 0.00 0.00 60.65 58.47 3k87 h LYS 77 Cb 0.14 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 3k87 h LYS 77 CO -0.09 0.79 -0.49 0.77 -0.57 0.00 0.00 179.45 179.86 3k87 h SER 78 N 0.49 0.20 0.67 0.86 0.02 -0.85 -3.05 113.55 111.89 3k87 h SER 78 Ca 0.06 -0.09 -0.15 0.00 -0.84 0.00 0.00 61.79 60.77 3k87 h SER 78 Cb 0.75 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.21 3k87 h SER 78 CO 0.06 0.65 -0.71 0.78 -1.14 0.00 0.00 176.83 176.48 3k87 h ASN 79 N 0.15 0.03 0.00 3.07 2.35 -0.92 -3.47 115.58 116.79 3k87 h ASN 79 Ca 0.01 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 3k87 h ASN 79 Cb 0.92 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.28 3k87 h ASN 79 CO 0.07 0.73 0.00 0.61 -1.65 0.00 0.00 177.43 177.19 3k87 n GLY 80 N 0.49 0.94 3.11 2.83 0.00 -0.79 -4.93 105.19 106.85 3k87 n GLY 80 Ca -0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 3k87 n GLY 80 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k87 s VAL 81 N -3.79 0.65 0.02 1.61 -7.23 -1.26 -1.03 120.40 109.36 3k87 s VAL 81 Ca 0.00 -1.42 -0.28 0.00 -1.81 0.00 0.00 61.98 58.47 3k87 s VAL 81 Cb 0.00 -1.05 0.09 0.00 0.56 0.00 0.00 36.38 35.98 3k87 s VAL 81 CO 0.00 -0.56 0.81 -1.48 -0.31 0.00 0.00 175.10 173.56 3k87 s LEU 82 N -2.15 -0.45 0.13 1.32 0.05 -0.39 -4.54 118.68 112.66 3k87 s LEU 82 Ca -0.01 0.11 0.08 0.00 0.05 0.00 0.00 54.13 54.36 3k87 s LEU 82 Cb -0.04 2.20 -0.04 0.00 -2.05 0.00 0.00 46.19 46.26 3k87 s LEU 82 CO -0.01 -0.68 -0.11 -0.94 -0.55 0.00 0.00 176.35 174.05 3k87 s SER 83 N -2.29 4.26 -0.23 1.48 1.04 0.11 -0.23 113.70 117.85 3k87 s SER 83 Ca 0.02 -0.49 -0.05 0.00 0.48 0.00 0.00 55.95 55.91 3k87 s SER 83 Cb -0.01 -0.74 -0.01 0.00 0.10 0.00 0.00 66.02 65.35 3k87 s SER 83 CO -0.07 0.15 -0.01 -0.69 0.98 0.00 0.00 173.24 173.60 3k87 s VAL 84 N -1.38 3.66 -0.33 5.02 1.01 -0.16 -1.83 120.40 126.38 3k87 s VAL 84 Ca 0.22 -0.40 0.00 0.00 0.00 0.00 0.00 61.98 61.81 3k87 s VAL 84 Cb -0.10 -2.68 0.08 0.00 0.00 0.00 0.00 36.38 33.68 3k87 s VAL 84 CO 0.14 0.40 0.05 0.20 0.00 0.00 0.00 175.10 175.88 3k87 s ASN 85 N 1.47 4.87 -0.25 3.32 0.01 -0.23 -1.14 114.94 122.99 3k87 s ASN 85 Ca 0.05 -1.73 -0.29 0.00 -0.71 0.00 0.00 52.86 50.18 3k87 s ASN 85 Cb -0.14 -1.69 -0.01 0.00 0.41 0.00 0.00 41.25 39.81 3k87 s ASN 85 CO -0.01 -0.35 1.40 0.26 -1.51 0.00 0.00 177.10 176.88 3k87 s TRP 86 N 1.10 2.52 0.45 2.20 0.51 0.36 -0.37 118.94 125.71 3k87 s TRP 86 Ca 0.02 0.77 -0.21 0.00 -2.12 0.00 0.00 56.10 54.57 3k87 s TRP 86 Cb -0.20 -3.87 -0.10 0.00 -0.81 0.00 0.00 33.47 28.49 3k87 s TRP 86 CO -0.04 -2.13 0.98 -0.51 -0.51 0.00 0.00 176.95 174.74 3k87 s LEU 87 N 4.45 3.89 0.54 2.99 1.43 -0.11 -0.81 118.68 131.07 3k87 s LEU 87 Ca 0.61 1.78 -0.03 0.00 -1.03 0.00 0.00 54.13 55.45 3k87 s LEU 87 Cb -0.20 -4.55 0.01 0.00 0.03 0.00 0.00 46.19 41.48 3k87 s LEU 87 CO 0.24 -0.53 0.81 0.00 0.23 0.00 0.00 176.35 177.10 3k87 s ALA 88 N -2.12 3.50 0.48 4.21 0.00 -1.26 -1.35 121.76 125.22 3k87 s ALA 88 Ca 0.64 -0.87 0.22 0.00 0.00 0.00 0.00 51.96 51.95 3k87 s ALA 88 Cb -0.12 -2.41 1.25 0.00 0.00 0.00 0.00 23.12 21.85 3k87 s ALA 88 CO 0.16 -0.66 1.93 0.00 0.00 0.00 0.00 175.76 177.20 3k87 h ALA 89 N 0.04 2.39 0.00 0.00 0.00 -0.17 -0.63 119.26 120.89 3k87 h ALA 89 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3k87 h ALA 89 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3k87 h ALA 89 CO 0.59 -0.59 0.00 0.41 0.00 0.00 0.00 179.25 179.65 3k87 n GLY 90 N -1.60 -0.85 0.62 0.00 0.00 -1.26 -4.20 105.19 97.90 3k87 n GLY 90 Ca 0.14 -0.08 0.05 0.00 0.00 0.00 0.00 46.02 46.14 3k87 n GLY 90 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3k87 n GLN 91 N -0.73 1.72 0.09 1.61 6.02 -0.24 -4.68 117.38 121.17 3k87 n GLN 91 Ca 0.09 -3.02 0.08 0.00 -0.01 0.00 0.00 57.00 54.14 3k87 n GLN 91 Cb 0.04 -1.66 0.54 0.00 1.02 0.00 0.00 30.24 30.19 3k87 n GLN 91 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3k87 h ALA 92 N 0.81 1.94 -0.30 -1.58 0.00 -1.78 -0.46 119.26 117.90 3k87 h ALA 92 Ca 0.05 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 3k87 h ALA 92 Cb 1.21 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 3k87 h ALA 92 CO 0.12 0.01 -0.01 -0.24 0.00 0.00 0.00 179.25 179.13 3k87 h VAL 93 N 0.27 1.18 -0.12 0.00 3.04 -1.95 0.32 116.25 118.99 3k87 h VAL 93 Ca 0.12 -0.72 -0.02 0.00 -1.01 0.00 0.00 66.70 65.08 3k87 h VAL 93 Cb 0.16 0.96 -0.00 0.00 -2.01 0.00 0.00 31.29 30.40 3k87 h VAL 93 CO -0.02 0.24 0.02 0.40 -1.01 0.00 0.00 177.57 177.19 3k87 h ILE 94 N 0.44 1.22 -0.80 3.17 2.04 -1.45 -1.09 117.51 121.03 3k87 h ILE 94 Ca 0.10 -0.71 0.12 0.00 1.00 0.00 0.00 64.86 65.37 3k87 h ILE 94 Cb 0.30 1.47 -0.08 0.00 -0.74 0.00 0.00 36.82 37.76 3k87 h ILE 94 CO 0.01 0.21 0.41 -1.28 0.00 0.00 0.00 178.15 177.50 3k87 h SER 95 N -0.03 0.52 -0.41 1.72 0.87 -1.10 -0.98 113.55 114.13 3k87 h SER 95 Ca 0.04 0.08 -0.08 0.00 -1.23 0.00 0.00 61.79 60.59 3k87 h SER 95 Cb 0.31 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 3k87 h SER 95 CO 0.00 0.25 -0.06 1.56 -0.53 0.00 0.00 176.83 178.06 3k87 h GLN 96 N 0.63 0.77 -0.20 2.24 1.08 -0.70 -0.63 115.11 118.31 3k87 h GLN 96 Ca 0.42 -0.27 0.01 0.00 -1.45 0.00 0.00 58.65 57.35 3k87 h GLN 96 Cb 0.53 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.89 3k87 h GLN 96 CO -0.32 0.88 0.11 1.15 -0.95 0.00 0.00 178.83 179.69 3k87 h THR 97 N 0.59 1.01 0.00 -0.54 2.02 -0.63 -1.19 112.91 114.18 3k87 h THR 97 Ca 0.11 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.21 3k87 h THR 97 Cb 0.57 0.76 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 3k87 h THR 97 CO 0.03 0.04 0.00 0.49 0.37 0.00 0.00 175.52 176.45 3k87 n PHE 98 N -4.98 0.29 1.50 3.16 3.72 -0.43 -1.75 117.46 118.98 3k87 n PHE 98 Ca -0.03 0.09 0.13 0.00 -0.05 0.00 0.00 57.45 57.59 3k87 n PHE 98 Cb 0.04 -0.65 0.52 0.00 -0.94 0.00 0.00 39.48 38.45 3k87 n PHE 98 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3k87 n ALA 99 N -1.59 2.57 -0.26 4.37 0.00 -0.25 -1.68 120.51 123.66 3k87 n ALA 99 Ca 0.05 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.08 3k87 n ALA 99 Cb 0.31 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.57 3k87 n ALA 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k87 n GLY 100 N 1.11 0.78 3.70 0.00 0.00 -0.72 -4.99 105.19 105.08 3k87 n GLY 100 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 3k87 n GLY 100 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k87 s VAL 101 N -2.19 3.66 0.00 1.61 1.01 -0.48 -1.42 120.40 122.59 3k87 s VAL 101 Ca 0.00 1.13 0.00 0.00 0.00 0.00 0.00 61.98 63.11 3k87 s VAL 101 Cb 0.00 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.65 3k87 s VAL 101 CO 0.00 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.76 3k87 n GLY 102 N 3.50 1.07 3.98 4.51 0.00 -1.26 -4.35 105.19 112.64 3k87 n GLY 102 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 3k87 n GLY 102 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3k87 n SER 103 N 0.00 -1.33 -4.72 1.61 7.64 -0.51 -4.84 113.62 111.47 3k87 n SER 103 Ca 0.00 -1.03 -0.42 0.00 1.01 0.00 0.00 58.87 58.43 3k87 n SER 103 Cb 0.00 -1.25 -0.03 0.00 -1.01 0.00 0.00 64.21 61.92 3k87 n SER 103 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3k87 s VAL 104 N -3.96 3.46 0.59 0.44 1.01 -1.26 -4.97 120.40 115.70 3k87 s VAL 104 Ca 0.21 1.05 -0.20 0.00 0.00 0.00 0.00 61.98 63.04 3k87 s VAL 104 Cb -0.12 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 3k87 s VAL 104 CO 0.78 0.08 1.25 -2.65 0.00 0.00 0.00 175.10 174.56 3k87 n PRO 105 N 3.93 1.33 0.08 2.72 -0.02 -1.26 -4.78 135.00 137.00 3k87 n PRO 105 Ca 0.11 0.50 -0.16 0.00 -2.02 0.00 0.00 63.50 61.93 3k87 n PRO 105 Cb 0.43 -2.46 -0.10 0.00 -0.02 0.00 0.00 33.50 31.35 3k87 n PRO 105 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 3k87 h MET 106 N 0.95 -0.68 -0.95 -0.52 2.86 -1.93 -1.62 114.93 113.04 3k87 h MET 106 Ca -0.50 0.05 0.13 0.00 -2.06 0.00 0.00 59.70 57.31 3k87 h MET 106 Cb 1.33 0.15 -0.08 0.00 0.06 0.00 0.00 31.60 33.07 3k87 h MET 106 CO 0.54 -0.45 0.60 0.93 1.06 0.00 0.00 176.91 179.60 3k87 h GLU 107 N -0.70 0.84 0.00 1.72 5.08 -1.91 0.26 114.58 119.87 3k87 h GLU 107 Ca 0.01 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 3k87 h GLU 107 Cb 0.74 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 3k87 h GLU 107 CO -0.33 0.55 -0.12 0.93 -1.00 0.00 0.00 179.01 179.04 3k87 h GLU 108 N 0.86 0.00 0.00 2.33 3.07 -1.73 -2.26 114.58 116.85 3k87 h GLU 108 Ca 0.47 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 59.30 3k87 h GLU 108 Cb 0.57 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.48 3k87 h GLU 108 CO -0.23 0.12 -0.15 0.00 -1.40 0.00 0.00 179.01 177.34 3k87 h ARG 109 N 0.00 0.00 -0.52 2.33 3.08 0.44 -2.92 114.38 116.78 3k87 h ARG 109 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3k87 h ARG 109 Cb 0.48 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.53 3k87 h ARG 109 CO 0.02 0.15 0.00 1.19 -1.07 0.00 0.00 179.97 180.26 3k87 n PHE 110 N -4.11 0.69 0.09 3.04 3.72 -0.86 -4.51 117.46 115.52 3k87 n PHE 110 Ca -0.02 -0.36 0.01 0.00 -0.05 0.00 0.00 57.45 57.02 3k87 n PHE 110 Cb 0.23 -0.00 0.33 0.00 -0.94 0.00 0.00 39.48 39.09 3k87 n PHE 110 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3k87 h ALA 111 N 4.22 1.37 -2.89 4.37 0.00 -1.47 -3.44 119.26 121.43 3k87 h ALA 111 Ca 0.00 -0.26 -0.53 0.00 0.00 0.00 0.00 54.91 54.12 3k87 h ALA 111 Cb 0.97 -0.10 0.08 0.00 0.00 0.00 0.00 17.79 18.74 3k87 h ALA 111 CO 0.00 0.43 0.73 0.34 0.00 0.00 0.00 179.25 180.76 3k87 s ASP 112 N -6.85 6.54 0.00 0.00 -1.08 -1.26 -4.87 116.67 109.14 3k87 s ASP 112 Ca -0.06 2.87 0.17 0.00 -0.52 0.00 0.00 52.55 55.01 3k87 s ASP 112 Cb 0.15 -2.65 0.85 0.00 -1.46 0.00 0.00 42.92 39.80 3k87 s ASP 112 CO 0.75 -0.73 1.51 0.29 0.52 0.00 0.00 175.17 177.51 3k87 n LYS 113 N 0.95 0.21 0.27 4.34 4.01 -1.26 -2.06 118.16 124.62 3k87 n LYS 113 Ca 0.02 0.14 0.18 0.00 -0.51 0.00 0.00 58.31 58.14 3k87 n LYS 113 Cb 0.40 -1.50 0.87 0.00 -0.51 0.00 0.00 35.03 34.29 3k87 n LYS 113 CO 0.00 0.00 0.00 0.78 -1.11 0.00 0.00 177.40 177.07 3k87 h GLY 114 N 2.85 0.00 -7.19 0.72 0.00 -1.93 -3.40 103.07 94.13 3k87 h GLY 114 Ca 0.00 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.68 3k87 h GLY 114 CO 0.00 0.00 -0.07 -0.98 0.00 0.00 0.00 176.54 175.49 3k87 s TRP 115 N -3.81 3.17 0.31 5.60 0.52 -0.87 -1.07 118.94 122.78 3k87 s TRP 115 Ca -0.01 0.09 0.04 0.00 0.02 0.00 0.00 56.10 56.23 3k87 s TRP 115 Cb 0.10 -2.94 -0.06 0.00 -1.15 0.00 0.00 33.47 29.42 3k87 s TRP 115 CO 0.43 -0.58 0.06 -0.65 0.02 0.00 0.00 176.95 176.23 3k87 s GLN 116 N 2.38 1.61 0.28 4.98 -0.21 -0.28 -4.88 119.66 123.54 3k87 s GLN 116 Ca 0.18 -1.88 -0.13 0.00 0.02 0.00 0.00 55.36 53.54 3k87 s GLN 116 Cb -0.16 -0.80 -0.08 0.00 1.00 0.00 0.00 33.01 32.98 3k87 s GLN 116 CO 0.14 -0.19 0.67 -0.08 -2.12 0.00 0.00 175.29 173.71 3k87 s THR 117 N -3.35 4.76 0.00 -0.19 -1.32 -1.26 0.69 115.64 114.97 3k87 s THR 117 Ca 0.36 0.80 0.00 0.00 -1.21 0.00 0.00 61.69 61.65 3k87 s THR 117 Cb 0.08 -3.63 0.00 0.00 -1.51 0.00 0.00 72.50 67.45 3k87 s THR 117 CO 0.15 -0.12 0.00 -0.38 -2.21 0.00 0.00 174.62 172.06 3k87 n ILE 118 N -0.21 0.00 0.00 5.08 5.41 -1.26 -4.91 119.36 123.46 3k87 n ILE 118 Ca 0.02 0.07 0.00 0.00 1.00 0.00 0.00 62.75 63.84 3k87 n ILE 118 Cb 0.53 -0.93 0.00 0.00 -0.71 0.00 0.00 39.64 38.53 3k87 n ILE 118 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3k87 n ALA 119 N -1.99 1.99 0.35 -1.39 0.00 -1.26 -4.85 120.51 113.36 3k87 n ALA 119 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 3k87 n ALA 119 Cb 0.00 0.42 0.10 0.00 0.00 0.00 0.00 19.45 19.97 3k87 n ALA 119 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3k87 h THR 120 N 0.00 0.00 0.00 0.00 1.35 -1.93 -3.47 112.91 108.86 3k87 h THR 120 Ca 0.00 -0.74 0.00 0.00 -0.55 0.00 0.00 66.41 65.12 3k87 h THR 120 Cb 0.88 1.30 0.00 0.00 -1.73 0.00 0.00 68.15 68.60 3k87 h THR 120 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 3k87 n GLY 121 N 1.26 3.46 3.77 5.82 0.00 -1.26 -5.02 105.19 113.22 3k87 n GLY 121 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 3k87 n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k87 s ALA 122 N -2.92 2.73 0.16 4.61 0.00 -1.26 -4.32 121.76 120.76 3k87 s ALA 122 Ca 0.00 0.84 -0.31 0.00 0.00 0.00 0.00 51.96 52.49 3k87 s ALA 122 Cb 0.00 -3.36 -0.09 0.00 0.00 0.00 0.00 23.12 19.67 3k87 s ALA 122 CO 0.00 -0.75 1.41 -2.14 0.00 0.00 0.00 175.76 174.27 3k87 s PRO 123 N -3.20 4.31 -0.08 0.00 0.02 -1.26 -4.36 135.00 130.43 3k87 s PRO 123 Ca 0.72 2.14 0.03 0.00 0.02 0.00 0.00 61.00 63.91 3k87 s PRO 123 Cb -0.24 -3.20 -0.01 0.00 0.02 0.00 0.00 34.50 31.06 3k87 s PRO 123 CO 0.28 -0.42 -0.19 0.71 -0.33 0.00 0.00 177.00 177.05 3k87 s TYR 124 N 0.74 2.63 -0.62 6.54 2.02 0.22 -4.55 117.35 124.32 3k87 s TYR 124 Ca 0.63 -0.58 -0.25 0.00 -0.37 0.00 0.00 57.07 56.50 3k87 s TYR 124 Cb -0.38 -1.69 0.04 0.00 -0.40 0.00 0.00 41.96 39.53 3k87 s TYR 124 CO 0.34 -0.13 1.05 0.50 -1.57 0.00 0.00 175.55 175.74 3k87 s ARG 125 N -0.11 3.27 0.59 -0.62 6.06 -1.26 -1.13 118.95 125.75 3k87 s ARG 125 Ca -0.03 -0.33 0.35 0.00 -2.50 0.00 0.00 55.73 53.23 3k87 s ARG 125 Cb -0.14 -4.12 1.80 0.00 0.06 0.00 0.00 34.95 32.55 3k87 s ARG 125 CO 0.04 -1.74 2.17 0.52 -2.50 0.00 0.00 175.30 173.79 3k87 h MET 126 N 9.56 0.00 -0.50 5.12 2.86 -1.46 -1.10 114.93 129.41 3k87 h MET 126 Ca -0.27 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 3k87 h MET 126 Cb 1.07 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.73 3k87 h MET 126 CO 1.17 0.04 0.00 -0.40 1.06 0.00 0.00 176.91 178.78 3k87 n ASP 127 N -3.30 3.41 -4.74 1.22 3.85 -1.26 -4.14 116.55 111.58 3k87 n ASP 127 Ca -0.02 -1.97 -0.35 0.00 -0.71 0.00 0.00 54.79 51.74 3k87 n ASP 127 Cb 0.19 -0.33 0.06 0.00 -1.35 0.00 0.00 41.12 39.68 3k87 n ASP 127 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3k87 s ALA 128 N -1.07 2.39 0.24 2.12 0.00 -0.42 -4.67 121.76 120.36 3k87 s ALA 128 Ca 0.36 0.95 -0.04 0.00 0.00 0.00 0.00 51.96 53.23 3k87 s ALA 128 Cb 0.19 -3.45 0.40 0.00 0.00 0.00 0.00 23.12 20.26 3k87 s ALA 128 CO 0.26 -1.44 1.81 0.00 0.00 0.00 0.00 175.76 176.39 3k87 h ALA 129 N 0.41 1.17 -3.07 0.00 0.00 -1.18 -2.87 119.26 113.72 3k87 h ALA 129 Ca -0.49 0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.29 3k87 h ALA 129 Cb 1.30 -0.12 -0.26 0.00 0.00 0.00 0.00 17.79 18.70 3k87 h ALA 129 CO 0.53 0.08 -0.43 0.08 0.00 0.00 0.00 179.25 179.52 3k87 s VAL 130 N -6.03 -0.01 -0.07 0.00 1.01 -1.17 -3.80 120.40 110.33 3k87 s VAL 130 Ca -0.12 0.04 0.01 0.00 0.00 0.00 0.00 61.98 61.91 3k87 s VAL 130 Cb 0.19 -0.38 0.02 0.00 0.00 0.00 0.00 36.38 36.21 3k87 s VAL 130 CO 0.78 0.02 -0.09 -0.55 0.00 0.00 0.00 175.10 175.25 3k87 s SER 131 N 0.44 1.68 -0.17 3.32 0.15 0.48 -0.49 113.70 119.11 3k87 s SER 131 Ca -0.02 -0.26 -0.01 0.00 0.70 0.00 0.00 55.95 56.36 3k87 s SER 131 Cb -0.04 -0.74 -0.00 0.00 -1.71 0.00 0.00 66.02 63.53 3k87 s SER 131 CO -0.02 -0.03 -0.13 -0.36 1.20 0.00 0.00 173.24 173.90 3k87 s PHE 132 N 0.98 2.82 -0.15 3.44 0.08 -0.29 -1.22 117.98 123.64 3k87 s PHE 132 Ca -0.09 -1.03 -0.21 0.00 0.12 0.00 0.00 56.93 55.72 3k87 s PHE 132 Cb -0.15 -1.93 -0.03 0.00 -0.57 0.00 0.00 43.02 40.34 3k87 s PHE 132 CO 0.00 -0.49 0.61 0.34 -0.10 0.00 0.00 175.22 175.58 3k87 s ASP 133 N 0.94 6.76 0.03 1.36 -1.08 0.33 -0.99 116.67 124.01 3k87 s ASP 133 Ca -0.03 0.91 0.01 0.00 -0.52 0.00 0.00 52.55 52.93 3k87 s ASP 133 Cb -0.15 -2.35 -0.02 0.00 -1.46 0.00 0.00 42.92 38.94 3k87 s ASP 133 CO -0.01 -0.18 -0.05 0.00 0.52 0.00 0.00 175.17 175.45 3k87 s THR 135 N -1.49 3.89 0.22 0.00 -4.23 -0.79 -1.27 115.64 111.97 3k87 s THR 135 Ca -0.12 -0.39 -0.30 0.00 -1.18 0.00 0.00 61.69 59.70 3k87 s THR 135 Cb -0.10 -2.64 -0.09 0.00 1.34 0.00 0.00 72.50 71.01 3k87 s THR 135 CO -0.01 0.56 1.39 -0.63 -0.54 0.00 0.00 174.62 175.39 3k87 s ILE 136 N -0.35 2.90 -0.07 2.99 1.01 -0.20 -1.12 121.20 126.36 3k87 s ILE 136 Ca 0.06 0.74 0.07 0.00 0.00 0.00 0.00 60.65 61.51 3k87 s ILE 136 Cb -0.12 -3.47 -0.09 0.00 0.01 0.00 0.00 42.46 38.78 3k87 s ILE 136 CO 0.02 0.11 0.04 0.00 0.00 0.00 0.00 174.94 175.11 3k87 n ALA 137 N 2.56 1.87 -3.54 9.38 0.00 0.48 -4.89 120.51 126.36 3k87 n ALA 137 Ca 0.07 -0.45 -0.15 0.00 0.00 0.00 0.00 53.44 52.90 3k87 n ALA 137 Cb 0.41 0.06 -0.07 0.00 0.00 0.00 0.00 19.45 19.85 3k87 n ALA 137 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3k87 s ASN 138 N -3.79 -0.66 -0.08 0.00 2.47 -1.11 -5.01 114.94 106.74 3k87 s ASN 138 Ca -0.04 1.07 -0.00 0.00 0.42 0.00 0.00 52.86 54.31 3k87 s ASN 138 Cb 0.02 1.03 0.03 0.00 -1.45 0.00 0.00 41.25 40.88 3k87 s ASN 138 CO 0.30 -0.38 -0.04 -0.63 -3.72 0.00 0.00 177.10 172.63 3k87 s ILE 139 N -0.28 0.66 -0.20 -5.21 1.01 -1.26 -0.53 121.20 115.39 3k87 s ILE 139 Ca -0.05 -0.09 0.00 0.00 0.00 0.00 0.00 60.65 60.52 3k87 s ILE 139 Cb -0.03 -0.74 0.02 0.00 0.01 0.00 0.00 42.46 41.72 3k87 s ILE 139 CO 0.04 0.30 -0.15 -0.69 0.00 0.00 0.00 174.94 174.44 3k87 s VAL 140 N 1.66 2.38 -0.22 2.92 1.01 0.29 -4.96 120.40 123.49 3k87 s VAL 140 Ca 0.02 -0.95 -0.21 0.00 0.00 0.00 0.00 61.98 60.84 3k87 s VAL 140 Cb -0.13 -2.09 -0.02 0.00 0.00 0.00 0.00 36.38 34.15 3k87 s VAL 140 CO -0.05 0.42 0.66 -1.81 0.00 0.00 0.00 175.10 174.32 3k87 s ASP 141 N 1.31 6.69 -0.07 3.32 1.01 -1.26 -0.79 116.67 126.87 3k87 s ASP 141 Ca 0.03 0.84 -0.00 0.00 0.71 0.00 0.00 52.55 54.13 3k87 s ASP 141 Cb -0.14 -2.36 0.03 0.00 1.01 0.00 0.00 42.92 41.45 3k87 s ASP 141 CO -0.10 -0.33 -0.03 -0.69 0.21 0.00 0.00 175.17 174.24 3k87 s VAL 142 N 2.18 0.55 0.00 -1.27 1.01 0.16 -4.99 120.40 118.04 3k87 s VAL 142 Ca 0.29 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.24 3k87 s VAL 142 Cb -0.16 -0.64 0.00 0.00 0.00 0.00 0.00 36.38 35.58 3k87 s VAL 142 CO 0.10 0.27 0.00 0.61 0.00 0.00 0.00 175.10 176.08 3k87 n GLY 143 N 4.80 2.91 0.05 4.51 0.00 -1.26 -1.26 105.19 114.94 3k87 n GLY 143 Ca -0.13 -0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.02 3k87 n GLY 143 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k87 n SER 144 N 2.46 0.38 -4.61 1.61 3.41 -1.26 -4.89 113.62 110.72 3k87 n SER 144 Ca 0.00 0.54 -0.31 0.00 -0.26 0.00 0.00 58.87 58.84 3k87 n SER 144 Cb 0.00 -0.64 -0.10 0.00 -0.26 0.00 0.00 64.21 63.21 3k87 n SER 144 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3k87 s HIS 145 N -3.06 2.86 -0.25 7.33 0.09 -0.39 -1.33 115.29 120.56 3k87 s HIS 145 Ca 0.12 -0.07 -0.19 0.00 -0.00 0.00 0.00 55.06 54.92 3k87 s HIS 145 Cb 0.15 -1.54 -0.02 0.00 -0.00 0.00 0.00 32.58 31.17 3k87 s HIS 145 CO 0.54 0.41 0.56 -1.12 -0.00 0.00 0.00 174.74 175.13 3k87 s SER 146 N -1.86 6.51 -0.37 1.40 0.01 -0.40 -0.66 113.70 118.33 3k87 s SER 146 Ca 0.20 0.62 -0.20 0.00 1.31 0.00 0.00 55.95 57.89 3k87 s SER 146 Cb -0.11 -2.30 0.00 0.00 0.21 0.00 0.00 66.02 63.82 3k87 s SER 146 CO 0.12 -0.30 0.59 -0.69 0.41 0.00 0.00 173.24 173.36 3k87 s VAL 147 N 2.28 4.93 -0.23 3.43 1.01 0.03 -1.34 120.40 130.51 3k87 s VAL 147 Ca 0.24 0.39 -0.04 0.00 0.00 0.00 0.00 61.98 62.57 3k87 s VAL 147 Cb -0.16 -4.06 0.00 0.00 0.00 0.00 0.00 36.38 32.17 3k87 s VAL 147 CO 0.09 -0.33 -0.04 -0.63 0.00 0.00 0.00 175.10 174.19 3k87 s ILE 148 N 2.60 3.28 -0.18 2.22 1.01 0.42 -0.55 121.20 130.01 3k87 s ILE 148 Ca 0.22 -0.64 -0.14 0.00 0.00 0.00 0.00 60.65 60.08 3k87 s ILE 148 Cb -0.15 -2.55 -0.04 0.00 0.01 0.00 0.00 42.46 39.73 3k87 s ILE 148 CO 0.15 0.34 0.31 -0.36 0.00 0.00 0.00 174.94 175.39 3k87 s PHE 149 N 1.44 3.42 0.01 3.97 0.08 0.31 -1.65 117.98 125.56 3k87 s PHE 149 Ca 0.04 0.57 0.02 0.00 0.12 0.00 0.00 56.93 57.68 3k87 s PHE 149 Cb -0.15 -2.39 -0.01 0.00 -0.57 0.00 0.00 43.02 39.89 3k87 s PHE 149 CO -0.03 0.14 -0.08 0.00 -0.10 0.00 0.00 175.22 175.15 3k87 s ALA 150 N 0.80 0.62 -0.19 5.36 0.00 0.27 -0.39 121.76 128.23 3k87 s ALA 150 Ca 0.16 -0.45 -0.08 0.00 0.00 0.00 0.00 51.96 51.60 3k87 s ALA 150 Cb -0.14 -0.11 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 3k87 s ALA 150 CO 0.05 0.11 0.07 -1.21 0.00 0.00 0.00 175.76 174.78 3k87 s GLU 151 N -0.57 4.00 -0.11 0.00 2.02 -0.27 -0.83 118.70 122.94 3k87 s GLU 151 Ca -0.00 -0.33 -0.30 0.00 0.02 0.00 0.00 54.97 54.36 3k87 s GLU 151 Cb -0.05 -3.24 -0.03 0.00 0.10 0.00 0.00 34.13 30.91 3k87 s GLU 151 CO 0.00 0.27 1.29 0.08 0.02 0.00 0.00 175.26 176.92 3k87 s VAL 152 N 0.40 4.17 -0.02 2.63 1.01 0.71 -1.89 120.40 127.40 3k87 s VAL 152 Ca 0.04 1.45 0.13 0.00 0.00 0.00 0.00 61.98 63.60 3k87 s VAL 152 Cb -0.12 -3.94 -0.20 0.00 0.00 0.00 0.00 36.38 32.12 3k87 s VAL 152 CO 0.00 -0.08 0.27 1.33 0.00 0.00 0.00 175.10 176.62 3k87 n VAL 153 N 5.11 0.04 -3.59 2.92 0.24 0.95 -4.86 118.33 119.14 3k87 n VAL 153 Ca 0.13 -0.31 -0.11 0.00 -2.04 0.00 0.00 64.34 62.02 3k87 n VAL 153 Cb 0.45 0.16 -0.04 0.00 -1.47 0.00 0.00 33.84 32.94 3k87 n VAL 153 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3k87 s ALA 154 N -2.87 -1.08 0.24 2.33 0.00 -0.96 -4.98 121.76 114.44 3k87 s ALA 154 Ca -0.05 0.12 -0.02 0.00 0.00 0.00 0.00 51.96 52.01 3k87 s ALA 154 Cb 0.08 0.68 -0.03 0.00 0.00 0.00 0.00 23.12 23.85 3k87 s ALA 154 CO 0.54 -0.64 0.26 -0.98 0.00 0.00 0.00 175.76 174.93 3k87 s ARG 155 N -3.59 1.43 -0.24 0.00 1.04 -1.26 -0.51 118.95 115.82 3k87 s ARG 155 Ca 0.01 -1.62 -0.19 0.00 -1.04 0.00 0.00 55.73 52.89 3k87 s ARG 155 Cb 0.01 0.34 0.06 0.00 -2.04 0.00 0.00 34.95 33.32 3k87 s ARG 155 CO -0.11 -0.52 0.61 1.21 -0.04 0.00 0.00 175.30 176.46 3k87 s ASN 156 N -3.17 -0.70 -0.02 -2.89 2.47 -0.36 -4.98 114.94 105.30 3k87 s ASN 156 Ca 0.35 1.27 0.03 0.00 0.42 0.00 0.00 52.86 54.93 3k87 s ASN 156 Cb 0.04 1.24 -0.00 0.00 -1.45 0.00 0.00 41.25 41.08 3k87 s ASN 156 CO 0.15 -0.22 -0.10 -1.00 -3.72 0.00 0.00 177.10 172.21 3k87 s HIS 157 N 0.71 0.96 1.09 0.43 3.76 -1.26 -0.39 115.29 120.60 3k87 s HIS 157 Ca -0.03 -0.22 -0.18 0.00 -0.15 0.00 0.00 55.06 54.47 3k87 s HIS 157 Cb -0.05 -0.66 0.28 0.00 1.11 0.00 0.00 32.58 33.26 3k87 s HIS 157 CO -0.05 -0.08 0.70 0.00 -0.85 0.00 0.00 174.74 174.46 3k87 n ALA 158 N 3.15 -3.76 0.01 -1.40 0.00 -1.08 -4.98 120.51 112.45 3k87 n ALA 158 Ca -0.17 -1.19 -0.09 0.00 0.00 0.00 0.00 53.44 51.99 3k87 n ALA 158 Cb 0.55 -0.10 -0.14 0.00 0.00 0.00 0.00 19.45 19.76 3k87 n ALA 158 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3k87 h GLU 159 N 0.00 0.03 -6.19 0.00 5.08 -1.92 -3.44 114.58 108.14 3k87 h GLU 159 Ca -0.30 -0.05 -0.58 0.00 -1.00 0.00 0.00 59.36 57.42 3k87 h GLU 159 Cb 1.01 0.02 -0.10 0.00 0.50 0.00 0.00 28.75 30.18 3k87 h GLU 159 CO 0.19 0.69 0.78 -1.21 -1.00 0.00 0.00 179.01 178.45 3k87 s GLU 160 N -2.62 3.39 0.00 2.33 2.02 -1.26 -4.90 118.70 117.66 3k87 s GLU 160 Ca -0.04 -0.06 0.24 0.00 0.02 0.00 0.00 54.97 55.13 3k87 s GLU 160 Cb 0.08 -4.05 0.31 0.00 0.10 0.00 0.00 34.13 30.58 3k87 s GLU 160 CO 0.82 -1.62 1.28 0.00 0.02 0.00 0.00 175.26 175.76 3k87 n THR 162 N -1.29 0.48 -2.68 0.00 -1.04 -1.26 -4.83 114.28 103.65 3k87 n THR 162 Ca 0.06 -0.09 -0.40 0.00 -2.04 0.00 0.00 64.05 61.59 3k87 n THR 162 Cb 0.34 -2.04 -0.06 0.00 -1.82 0.00 0.00 70.33 66.76 3k87 n THR 162 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3k87 s PRO 163 N 3.28 4.81 -0.05 -2.82 0.02 -1.26 0.39 135.00 139.36 3k87 s PRO 163 Ca 0.86 1.57 -0.30 0.00 0.02 0.00 0.00 61.00 63.15 3k87 s PRO 163 Cb -0.55 -3.26 -0.04 0.00 0.02 0.00 0.00 34.50 30.68 3k87 s PRO 163 CO 0.42 0.44 1.25 -1.17 -0.33 0.00 0.00 177.00 177.62 3k87 s LEU 164 N -1.25 4.28 0.13 -5.54 2.96 -0.46 -3.85 118.68 114.96 3k87 s LEU 164 Ca 0.42 1.87 0.11 0.00 -0.22 0.00 0.00 54.13 56.30 3k87 s LEU 164 Cb -0.27 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 42.82 3k87 s LEU 164 CO 0.34 -0.63 -0.26 -0.63 -1.32 0.00 0.00 176.35 173.85 3k87 s ILE 165 N 2.39 2.32 -0.05 6.68 1.01 0.41 -2.58 121.20 131.38 3k87 s ILE 165 Ca 0.57 -1.76 0.06 0.00 0.00 0.00 0.00 60.65 59.52 3k87 s ILE 165 Cb -0.26 -2.04 -0.02 0.00 0.01 0.00 0.00 42.46 40.16 3k87 s ILE 165 CO 0.22 0.07 -0.23 -0.47 0.00 0.00 0.00 174.94 174.53 3k87 s TYR 166 N -1.13 2.46 -0.29 3.97 5.04 -0.18 0.01 117.35 127.24 3k87 s TYR 166 Ca 0.15 -0.57 -0.18 0.00 -2.44 0.00 0.00 57.07 54.02 3k87 s TYR 166 Cb -0.10 -1.59 0.13 0.00 0.35 0.00 0.00 41.96 40.75 3k87 s TYR 166 CO 0.07 -0.12 0.95 -1.58 -1.34 0.00 0.00 175.55 173.53 3k87 s HIS 167 N -0.33 -0.61 -1.54 4.97 5.65 0.02 -2.32 115.29 121.13 3k87 s HIS 167 Ca 0.02 1.29 -0.14 0.00 0.25 0.00 0.00 55.06 56.47 3k87 s HIS 167 Cb -0.12 0.38 0.10 0.00 -1.18 0.00 0.00 32.58 31.76 3k87 s HIS 167 CO 0.02 -0.30 0.84 0.54 -0.65 0.00 0.00 174.74 175.19 3k87 n ARG 168 N 3.39 -4.58 -1.76 2.88 3.00 0.04 -0.40 116.66 119.24 3k87 n ARG 168 Ca -0.17 0.53 -0.18 0.00 -0.01 0.00 0.00 57.85 58.02 3k87 n ARG 168 Cb 0.57 -5.36 -0.06 0.00 0.00 0.00 0.00 32.46 27.62 3k87 n ARG 168 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 3k87 n ARG 169 N -4.43 -1.31 -4.21 5.56 1.74 -1.26 -4.98 116.66 107.77 3k87 n ARG 169 Ca 0.04 1.06 -0.12 0.00 -0.77 0.00 0.00 57.85 58.06 3k87 n ARG 169 Cb 0.52 -5.40 -0.10 0.00 -1.02 0.00 0.00 32.46 26.46 3k87 n ARG 169 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 3k87 s GLN 170 N -3.92 0.96 0.44 5.56 1.03 0.47 -5.14 119.66 119.06 3k87 s GLN 170 Ca 0.00 -1.41 -0.22 0.00 0.04 0.00 0.00 55.36 53.76 3k87 s GLN 170 Cb 0.00 -0.33 -0.09 0.00 0.03 0.00 0.00 33.01 32.63 3k87 s GLN 170 CO 0.00 -0.02 1.04 0.71 -2.54 0.00 0.00 175.29 174.48 3k87 s TYR 171 N -3.56 3.14 0.33 9.60 2.02 -1.26 -0.80 117.35 126.82 3k87 s TYR 171 Ca 0.16 1.61 -0.12 0.00 -0.37 0.00 0.00 57.07 58.35 3k87 s TYR 171 Cb 0.05 -3.09 0.02 0.00 -0.40 0.00 0.00 41.96 38.54 3k87 s TYR 171 CO -0.01 -0.71 0.62 0.00 -1.57 0.00 0.00 175.55 173.88 3k87 s ALA 172 N -1.83 -0.29 0.04 3.71 0.00 0.10 -4.93 121.76 118.57 3k87 s ALA 172 Ca 0.62 -0.92 0.01 0.00 0.00 0.00 0.00 51.96 51.67 3k87 s ALA 172 Cb -0.19 0.92 -0.00 0.00 0.00 0.00 0.00 23.12 23.85 3k87 s ALA 172 CO 0.23 -0.91 0.03 -2.37 0.00 0.00 0.00 175.76 172.75 3k87 n THR 173 N -0.49 0.00 -3.54 0.00 5.66 -1.26 0.15 114.28 114.80 3k87 n THR 173 Ca -0.04 -0.31 -0.27 0.00 -3.05 0.00 0.00 64.05 60.39 3k87 n THR 173 Cb 0.61 0.15 -0.03 0.00 -1.55 0.00 0.00 70.33 69.51 3k87 n THR 173 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 3k87 s THR 174 N -2.14 5.13 0.04 1.09 -1.32 -1.26 -4.89 115.64 112.30 3k87 s THR 174 Ca 0.05 -0.30 -0.00 0.00 -1.21 0.00 0.00 61.69 60.23 3k87 s THR 174 Cb 0.00 -3.77 -0.03 0.00 -1.51 0.00 0.00 72.50 67.19 3k87 s THR 174 CO 0.03 -0.31 -0.03 -0.60 -2.21 0.00 0.00 174.62 171.50 3k87 s ARG 175 N -3.64 0.46 0.72 7.08 3.52 -1.26 -5.03 118.95 120.80 3k87 s ARG 175 Ca 0.40 -0.89 -0.13 0.00 -0.13 0.00 0.00 55.73 54.98 3k87 s ARG 175 Cb -0.10 0.13 0.03 0.00 -1.56 0.00 0.00 34.95 33.45 3k87 s ARG 175 CO 0.31 -0.07 1.11 0.45 -0.81 0.00 0.00 175.30 176.29 3k87 s SER 176 N -2.13 4.74 0.00 -2.12 0.15 -1.26 -5.26 113.70 107.82 3k87 s SER 176 Ca -0.05 1.95 0.28 0.00 0.70 0.00 0.00 55.95 58.84 3k87 s SER 176 Cb -0.02 -2.54 1.14 0.00 -1.71 0.00 0.00 66.02 62.88 3k87 s SER 176 CO -0.05 -1.88 1.79 0.18 1.20 0.00 0.00 173.24 174.48