#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wis s SER 2 N 0.00 6.37 -0.31 1.61 0.01 -1.26 -4.69 113.70 115.43 1wis s SER 2 Ca 0.00 0.78 -0.04 0.00 1.31 0.00 0.00 55.95 58.00 1wis s SER 2 Cb 0.00 -2.17 0.01 0.00 0.21 0.00 0.00 66.02 64.06 1wis s SER 2 CO 0.00 -0.36 0.14 -1.20 0.41 0.00 0.00 173.24 172.23 1wis n SER 3 N -1.56 -7.88 0.00 2.44 7.64 -1.26 -4.91 113.62 108.10 1wis n SER 3 Ca -0.01 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.02 1wis n SER 3 Cb 0.55 -5.00 0.00 0.00 -1.01 0.00 0.00 64.21 58.74 1wis n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wis n GLY 4 N 0.53 -0.61 2.83 0.23 0.00 -1.26 -5.05 105.19 101.86 1wis n GLY 4 Ca 0.02 -1.51 -0.19 0.00 0.00 0.00 0.00 46.02 44.33 1wis n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wis s SER 5 N -1.79 0.87 0.15 1.61 1.04 -1.26 -4.69 113.70 109.63 1wis s SER 5 Ca 0.00 -0.07 -0.30 0.00 0.48 0.00 0.00 55.95 56.06 1wis s SER 5 Cb 0.00 -0.34 -0.07 0.00 0.10 0.00 0.00 66.02 65.70 1wis s SER 5 CO 0.00 -0.11 1.19 -0.44 0.98 0.00 0.00 173.24 174.86 1wis s SER 6 N 1.21 7.10 0.76 7.02 0.01 -1.26 -5.01 113.70 123.54 1wis s SER 6 Ca -0.07 2.15 -0.11 0.00 1.31 0.00 0.00 55.95 59.24 1wis s SER 6 Cb -0.14 -2.60 0.05 0.00 0.21 0.00 0.00 66.02 63.55 1wis s SER 6 CO -0.02 -0.38 1.09 -0.83 0.41 0.00 0.00 173.24 173.51 1wis s GLY 7 N 0.38 1.70 -0.64 3.44 0.00 -1.26 -4.98 107.32 105.94 1wis s GLY 7 Ca 0.54 0.26 -0.16 0.00 0.00 0.00 0.00 44.72 45.36 1wis s GLY 7 CO 0.34 0.60 0.65 -0.51 0.00 0.00 0.00 173.10 174.19 1wis s THR 8 N -2.89 5.17 0.00 0.90 -4.23 -1.26 -4.99 115.64 108.33 1wis s THR 8 Ca 0.61 -1.60 0.00 0.00 -1.18 0.00 0.00 61.69 59.52 1wis s THR 8 Cb -0.17 -4.44 0.00 0.00 1.34 0.00 0.00 72.50 69.23 1wis s THR 8 CO 0.55 -1.01 0.00 2.30 -0.54 0.00 0.00 174.62 175.92 1wis n ILE 9 N 5.04 0.00 -2.57 2.99 -5.35 -1.26 -4.58 119.36 113.63 1wis n ILE 9 Ca -0.04 0.00 -0.33 0.00 -0.27 0.00 0.00 62.75 62.11 1wis n ILE 9 Cb 0.43 0.00 -0.04 0.00 -1.74 0.00 0.00 39.64 38.28 1wis n ILE 9 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1wis s SER 10 N -4.00 6.57 0.13 7.28 0.15 -1.26 -4.97 113.70 117.59 1wis s SER 10 Ca 0.00 1.76 0.00 0.00 0.70 0.00 0.00 55.95 58.41 1wis s SER 10 Cb 0.00 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 1wis s SER 10 CO 0.00 -0.62 0.00 -1.20 1.20 0.00 0.00 173.24 172.62 1wis n SER 11 N -1.06 0.24 -3.73 5.45 7.64 -1.26 -4.98 113.62 115.92 1wis n SER 11 Ca 0.08 0.21 -0.28 0.00 1.01 0.00 0.00 58.87 59.89 1wis n SER 11 Cb 0.53 0.05 -0.12 0.00 -1.01 0.00 0.00 64.21 63.67 1wis n SER 11 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1wis s GLY 12 N -4.73 2.26 0.05 0.23 0.00 -1.26 -5.09 107.32 98.79 1wis s GLY 12 Ca 0.00 -3.27 -0.31 0.00 0.00 0.00 0.00 44.72 41.14 1wis s GLY 12 CO 0.00 1.45 1.59 0.54 0.00 0.00 0.00 173.10 176.68 1wis s VAL 13 N -0.77 3.19 0.44 1.40 0.11 -1.26 -4.97 120.40 118.53 1wis s VAL 13 Ca 0.26 0.63 -0.22 0.00 -2.93 0.00 0.00 61.98 59.72 1wis s VAL 13 Cb -0.05 -3.40 -0.09 0.00 -1.53 0.00 0.00 36.38 31.31 1wis s VAL 13 CO -0.15 -0.00 1.05 -2.16 -3.33 0.00 0.00 175.10 170.50 1wis s PRO 14 N 2.57 4.00 0.79 1.54 0.04 -1.26 -5.04 135.00 137.63 1wis s PRO 14 Ca 0.71 1.45 -0.11 0.00 0.04 0.00 0.00 61.00 63.09 1wis s PRO 14 Cb -0.38 -2.34 0.06 0.00 0.04 0.00 0.00 34.50 31.88 1wis s PRO 14 CO 0.31 -0.27 1.09 -1.25 0.04 0.00 0.00 177.00 176.92 1wis s PRO 15 N -2.83 2.18 0.43 0.56 0.04 -1.26 -5.09 135.00 129.04 1wis s PRO 15 Ca 0.62 0.67 0.04 0.00 0.04 0.00 0.00 61.00 62.37 1wis s PRO 15 Cb -0.20 -1.93 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 1wis s PRO 15 CO 0.24 -1.56 0.04 -1.21 0.04 0.00 0.00 177.00 174.55 1wis s GLU 16 N -5.14 1.99 0.45 4.56 2.02 -1.15 -4.88 118.70 116.56 1wis s GLU 16 Ca 0.60 -2.21 -0.20 0.00 0.02 0.00 0.00 54.97 53.19 1wis s GLU 16 Cb -0.14 -1.24 -0.10 0.00 0.10 0.00 0.00 34.13 32.74 1wis s GLU 16 CO 0.54 -0.29 0.97 -0.51 0.02 0.00 0.00 175.26 175.99 1wis s LEU 17 N -3.72 3.86 0.00 1.80 1.43 -1.26 -4.66 118.68 116.14 1wis s LEU 17 Ca 0.21 1.69 0.00 0.00 -1.03 0.00 0.00 54.13 55.00 1wis s LEU 17 Cb 0.05 -4.54 0.00 0.00 0.03 0.00 0.00 46.19 41.73 1wis s LEU 17 CO 0.11 -0.45 0.00 -0.81 0.23 0.00 0.00 176.35 175.43 1wis n PRO 18 N -0.87 0.78 -4.35 1.29 -0.04 -1.25 -4.52 135.00 126.03 1wis n PRO 18 Ca 0.07 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.35 1wis n PRO 18 Cb 0.54 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.89 1wis n PRO 18 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1wis s GLY 19 N -1.26 1.81 -0.22 0.55 0.00 -0.30 -4.86 107.32 103.05 1wis s GLY 19 Ca 0.00 -1.91 -0.29 0.00 0.00 0.00 0.00 44.72 42.52 1wis s GLY 19 CO 0.00 -1.66 1.30 2.56 0.00 0.00 0.00 173.10 175.30 1wis s PRO 20 N -3.98 4.09 0.20 2.90 0.04 -1.26 -4.57 135.00 132.42 1wis s PRO 20 Ca 0.37 1.52 -0.30 0.00 0.04 0.00 0.00 61.00 62.63 1wis s PRO 20 Cb 0.08 -3.82 -0.08 0.00 0.04 0.00 0.00 34.50 30.72 1wis s PRO 20 CO 0.14 -0.89 1.11 -1.25 0.04 0.00 0.00 177.00 176.15 1wis s PRO 21 N 3.81 4.59 0.00 0.56 0.04 -1.26 -4.71 135.00 138.03 1wis s PRO 21 Ca 0.56 1.75 0.00 0.00 0.04 0.00 0.00 61.00 63.36 1wis s PRO 21 Cb -0.20 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 31.08 1wis s PRO 21 CO 0.19 0.08 0.00 0.25 0.04 0.00 0.00 177.00 177.56 1wis n THR 22 N 2.17 0.00 -2.53 1.26 -2.24 -1.25 -4.73 114.28 106.96 1wis n THR 22 Ca 0.02 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.60 1wis n THR 22 Cb 0.46 -0.50 0.00 0.00 -2.10 0.00 0.00 70.33 68.19 1wis n THR 22 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1wis n ASN 23 N -1.16 -5.63 -4.68 3.42 3.02 -1.26 -3.18 115.26 105.80 1wis n ASN 23 Ca 0.00 -0.09 -0.42 0.00 -0.03 0.00 0.00 54.58 54.04 1wis n ASN 23 Cb 0.00 -4.61 -0.03 0.00 -0.61 0.00 0.00 39.78 34.53 1wis n ASN 23 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1wis s LEU 24 N -5.74 4.30 0.17 3.41 2.96 -1.26 -4.24 118.68 118.28 1wis s LEU 24 Ca 0.08 2.09 0.05 0.00 -0.22 0.00 0.00 54.13 56.13 1wis s LEU 24 Cb -0.03 -3.55 -0.05 0.00 0.50 0.00 0.00 46.19 43.06 1wis s LEU 24 CO 0.10 -0.76 -0.10 -0.83 -1.32 0.00 0.00 176.35 173.44 1wis s GLY 25 N 2.12 1.19 -0.20 7.98 0.00 -0.40 -4.79 107.32 113.22 1wis s GLY 25 Ca 0.64 -1.56 -0.02 0.00 0.00 0.00 0.00 44.72 43.79 1wis s GLY 25 CO 0.26 -1.63 0.01 -0.42 0.00 0.00 0.00 173.10 171.31 1wis s ILE 26 N -3.27 0.80 0.25 0.90 -1.09 -1.26 -2.36 121.20 115.17 1wis s ILE 26 Ca 0.19 -0.69 0.01 0.00 -2.23 0.00 0.00 60.65 57.93 1wis s ILE 26 Cb 0.02 -1.21 -0.05 0.00 -1.58 0.00 0.00 42.46 39.64 1wis s ILE 26 CO 0.03 -0.14 0.09 -0.44 -1.23 0.00 0.00 174.94 173.24 1wis s SER 27 N 1.74 1.15 -1.28 3.58 0.01 -1.01 -4.87 113.70 113.03 1wis s SER 27 Ca -0.02 -1.36 -0.04 0.00 1.31 0.00 0.00 55.95 55.84 1wis s SER 27 Cb -0.17 0.17 -0.01 0.00 0.21 0.00 0.00 66.02 66.22 1wis s SER 27 CO -0.07 -0.72 0.68 0.59 0.41 0.00 0.00 173.24 174.13 1wis n ASN 28 N -0.44 -2.01 -4.55 2.44 3.02 -1.26 -1.68 115.26 110.78 1wis n ASN 28 Ca -0.01 -0.87 -0.39 0.00 -0.03 0.00 0.00 54.58 53.28 1wis n ASN 28 Cb 0.66 -3.86 -0.03 0.00 -0.61 0.00 0.00 39.78 35.94 1wis n ASN 28 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1wis s ILE 29 N -3.67 3.54 0.00 2.41 -1.09 -1.26 -3.22 121.20 117.91 1wis s ILE 29 Ca 0.10 0.26 0.00 0.00 -2.23 0.00 0.00 60.65 58.79 1wis s ILE 29 Cb -0.03 -4.42 0.00 0.00 -1.58 0.00 0.00 42.46 36.43 1wis s ILE 29 CO 0.83 -1.37 0.00 0.61 -1.23 0.00 0.00 174.94 173.78 1wis n GLY 30 N 5.60 -0.39 0.10 6.18 0.00 0.21 -4.42 105.19 112.48 1wis n GLY 30 Ca 0.13 -1.72 -0.11 0.00 0.00 0.00 0.00 46.02 44.33 1wis n GLY 30 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wis h PRO 31 N 0.00 -0.12 0.00 1.61 0.13 -1.90 -1.47 132.00 130.25 1wis h PRO 31 Ca 0.00 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1wis h PRO 31 Cb 0.00 0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.16 1wis h PRO 31 CO 0.00 0.40 -0.18 0.54 -0.23 0.00 0.00 178.00 178.54 1wis n ARG 32 N -4.83 0.90 -3.71 0.86 1.74 -1.26 -3.45 116.66 106.91 1wis n ARG 32 Ca -0.08 -1.75 -0.12 0.00 -0.77 0.00 0.00 57.85 55.14 1wis n ARG 32 Cb 0.29 -1.02 -0.10 0.00 -1.02 0.00 0.00 32.46 30.61 1wis n ARG 32 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1wis s SER 33 N -1.79 -0.50 0.04 0.55 1.04 -1.26 -1.79 113.70 109.99 1wis s SER 33 Ca 0.15 0.92 -0.04 0.00 0.48 0.00 0.00 55.95 57.46 1wis s SER 33 Cb 0.13 0.88 -0.02 0.00 0.10 0.00 0.00 66.02 67.11 1wis s SER 33 CO 0.01 -0.17 0.06 0.68 0.98 0.00 0.00 173.24 174.80 1wis s VAL 34 N 0.72 0.14 -0.08 5.02 -7.23 -1.10 0.65 120.40 118.53 1wis s VAL 34 Ca -0.04 -1.16 -0.16 0.00 -1.81 0.00 0.00 61.98 58.81 1wis s VAL 34 Cb -0.05 -0.88 -0.05 0.00 0.56 0.00 0.00 36.38 35.96 1wis s VAL 34 CO -0.05 -0.64 0.40 -0.89 -0.31 0.00 0.00 175.10 173.61 1wis s THR 35 N -2.60 5.15 -0.18 5.32 2.01 -0.68 -0.01 115.64 124.65 1wis s THR 35 Ca -0.05 0.80 0.01 0.00 0.31 0.00 0.00 61.69 62.76 1wis s THR 35 Cb -0.01 -3.72 0.01 0.00 0.01 0.00 0.00 72.50 68.79 1wis s THR 35 CO -0.05 0.46 -0.18 -0.22 -0.69 0.00 0.00 174.62 173.94 1wis s LEU 36 N -0.18 2.26 -0.07 4.42 0.20 -0.78 -2.39 118.68 122.13 1wis s LEU 36 Ca 0.23 -0.59 -0.02 0.00 0.69 0.00 0.00 54.13 54.43 1wis s LEU 36 Cb -0.15 -1.52 -0.04 0.00 -0.43 0.00 0.00 46.19 44.06 1wis s LEU 36 CO 0.10 0.02 0.04 -1.10 -0.29 0.00 0.00 176.35 175.12 1wis s GLN 37 N 1.20 3.05 0.04 1.98 -0.21 -0.99 -2.83 119.66 121.89 1wis s GLN 37 Ca 0.02 -0.39 -0.01 0.00 0.02 0.00 0.00 55.36 55.00 1wis s GLN 37 Cb -0.14 -2.86 0.00 0.00 1.00 0.00 0.00 33.01 31.02 1wis s GLN 37 CO -0.09 0.70 0.07 1.97 -2.12 0.00 0.00 175.29 175.82 1wis n PHE 38 N 1.87 -1.05 -3.71 0.91 1.16 -1.07 -1.27 117.46 114.30 1wis n PHE 38 Ca -0.17 -0.18 -0.11 0.00 -1.87 0.00 0.00 57.45 55.11 1wis n PHE 38 Cb 0.54 0.08 -0.11 0.00 -1.61 0.00 0.00 39.48 38.38 1wis n PHE 38 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 1wis s ARG 39 N -2.02 0.37 -0.68 3.97 0.52 -1.19 -4.77 118.95 115.15 1wis s ARG 39 Ca 0.02 0.70 -0.27 0.00 -0.52 0.00 0.00 55.73 55.66 1wis s ARG 39 Cb -0.00 -0.00 0.01 0.00 0.52 0.00 0.00 34.95 35.47 1wis s ARG 39 CO 0.01 -0.14 1.56 -1.25 0.02 0.00 0.00 175.30 175.50 1wis s PRO 40 N 1.18 2.91 0.00 3.54 0.04 -1.26 -3.80 135.00 137.61 1wis s PRO 40 Ca -0.08 0.17 0.00 0.00 0.04 0.00 0.00 61.00 61.13 1wis s PRO 40 Cb -0.08 -4.28 0.00 0.00 0.04 0.00 0.00 34.50 30.18 1wis s PRO 40 CO -0.10 -2.44 0.78 0.41 0.04 0.00 0.00 177.00 175.70 1wis n GLY 41 N 5.54 -2.72 2.88 0.56 0.00 -1.26 -4.59 105.19 105.59 1wis n GLY 41 Ca 0.11 0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1wis n GLY 41 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1wis s TYR 42 N -2.13 2.74 0.27 1.61 6.14 -1.26 -4.97 117.35 119.75 1wis s TYR 42 Ca 0.00 -2.37 0.00 0.00 0.64 0.00 0.00 57.07 55.34 1wis s TYR 42 Cb 0.00 -2.32 0.57 0.00 0.42 0.00 0.00 41.96 40.63 1wis s TYR 42 CO 0.00 -0.91 1.77 0.38 0.64 0.00 0.00 175.55 177.42 1wis h ASP 43 N 7.85 0.58 0.00 4.32 2.03 -1.87 -0.79 116.42 128.54 1wis h ASP 43 Ca -0.09 0.09 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1wis h ASP 43 Cb 1.02 -0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.52 1wis h ASP 43 CO 0.49 0.23 0.00 0.61 -1.03 0.00 0.00 179.24 179.55 1wis n GLY 44 N -1.33 1.88 2.46 7.15 0.00 -1.26 -3.80 105.19 110.29 1wis n GLY 44 Ca 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 1wis n GLY 44 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wis n LYS 45 N -0.61 -2.29 -3.43 1.61 5.02 -1.26 -2.92 118.16 114.27 1wis n LYS 45 Ca 0.00 0.71 0.02 0.00 -2.02 0.00 0.00 58.31 57.02 1wis n LYS 45 Cb 0.00 -5.06 -0.05 0.00 -0.02 0.00 0.00 35.03 29.90 1wis n LYS 45 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1wis s THR 46 N -2.87 -0.17 0.79 -0.18 -1.32 -1.26 -4.88 115.64 105.74 1wis s THR 46 Ca 0.10 0.00 -0.16 0.00 -1.21 0.00 0.00 61.69 60.42 1wis s THR 46 Cb -0.04 -1.00 -0.04 0.00 -1.51 0.00 0.00 72.50 69.90 1wis s THR 46 CO 0.12 0.00 0.30 -1.54 -2.21 0.00 0.00 174.62 171.29 1wis n SER 47 N 4.22 -2.13 -4.76 8.08 3.41 -1.26 -4.79 113.62 116.40 1wis n SER 47 Ca -0.12 0.49 -0.40 0.00 -0.26 0.00 0.00 58.87 58.58 1wis n SER 47 Cb 0.55 -1.13 -0.04 0.00 -0.26 0.00 0.00 64.21 63.32 1wis n SER 47 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1wis s ILE 48 N -2.03 3.55 -0.03 -1.33 -1.09 -1.26 -4.76 121.20 114.25 1wis s ILE 48 Ca 0.60 1.54 0.06 0.00 -2.23 0.00 0.00 60.65 60.62 1wis s ILE 48 Cb -0.31 -3.98 -0.24 0.00 -1.58 0.00 0.00 42.46 36.34 1wis s ILE 48 CO 0.63 0.36 0.71 -1.28 -1.23 0.00 0.00 174.94 174.13 1wis h SER 49 N 3.96 0.14 -3.29 3.58 0.87 0.16 -3.36 113.55 115.62 1wis h SER 49 Ca -0.46 -0.27 0.04 0.00 -1.23 0.00 0.00 61.79 59.87 1wis h SER 49 Cb 1.21 -0.05 -0.24 0.00 -0.44 0.00 0.00 62.40 62.88 1wis h SER 49 CO 0.68 1.23 0.31 -0.60 -0.53 0.00 0.00 176.83 177.92 1wis s ARG 50 N -2.61 0.60 -0.23 2.24 3.00 -1.20 -1.11 118.95 119.64 1wis s ARG 50 Ca -0.08 0.78 -0.12 0.00 -1.00 0.00 0.00 55.73 55.32 1wis s ARG 50 Cb 0.08 0.25 -0.05 0.00 0.00 0.00 0.00 34.95 35.23 1wis s ARG 50 CO 0.82 -0.08 0.22 -1.58 0.00 0.00 0.00 175.30 174.68 1wis s TRP 51 N 0.59 3.34 0.02 5.12 0.52 0.34 -2.38 118.94 126.49 1wis s TRP 51 Ca -0.01 0.34 -0.07 0.00 0.02 0.00 0.00 56.10 56.37 1wis s TRP 51 Cb -0.05 -2.33 -0.05 0.00 -1.15 0.00 0.00 33.47 29.89 1wis s TRP 51 CO -0.07 0.06 0.30 -1.17 0.02 0.00 0.00 176.95 176.08 1wis s LEU 52 N 1.09 4.37 -0.24 2.99 2.96 -0.48 -0.17 118.68 129.19 1wis s LEU 52 Ca 0.11 0.61 -0.02 0.00 -0.22 0.00 0.00 54.13 54.60 1wis s LEU 52 Cb -0.14 -2.74 0.08 0.00 0.50 0.00 0.00 46.19 43.88 1wis s LEU 52 CO 0.05 0.23 0.06 -0.69 -1.32 0.00 0.00 176.35 174.69 1wis s VAL 53 N -1.32 0.54 0.24 1.68 1.01 0.16 -2.09 120.40 120.62 1wis s VAL 53 Ca 0.29 -0.81 0.05 0.00 0.00 0.00 0.00 61.98 61.51 1wis s VAL 53 Cb -0.13 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 35.02 1wis s VAL 53 CO 0.17 -0.40 0.33 -1.61 0.00 0.00 0.00 175.10 173.59 1wis s GLU 54 N 1.82 3.34 0.15 2.72 2.02 -1.26 -0.16 118.70 127.33 1wis s GLU 54 Ca 0.03 -0.82 -0.20 0.00 0.02 0.00 0.00 54.97 54.00 1wis s GLU 54 Cb -0.17 -2.83 0.05 0.00 0.10 0.00 0.00 34.13 31.28 1wis s GLU 54 CO -0.16 0.42 0.51 0.00 0.02 0.00 0.00 175.26 176.04 1wis s ALA 55 N -2.01 -1.28 -0.03 5.21 0.00 -0.66 -1.18 121.76 121.80 1wis s ALA 55 Ca 0.34 0.23 0.07 0.00 0.00 0.00 0.00 51.96 52.60 1wis s ALA 55 Cb -0.09 0.80 -0.02 0.00 0.00 0.00 0.00 23.12 23.82 1wis s ALA 55 CO 0.28 -0.72 -0.26 -1.14 0.00 0.00 0.00 175.76 173.93 1wis s GLN 56 N -3.78 2.22 0.14 0.00 -0.44 -1.25 -3.54 119.66 113.02 1wis s GLN 56 Ca 0.02 -0.92 -0.30 0.00 -2.50 0.00 0.00 55.36 51.66 1wis s GLN 56 Cb 0.00 -2.06 -0.07 0.00 -1.64 0.00 0.00 33.01 29.24 1wis s GLN 56 CO -0.12 0.51 1.07 0.08 0.50 0.00 0.00 175.29 177.33 1wis s VAL 57 N -0.48 4.09 0.00 1.34 1.01 -1.26 -3.37 120.40 121.73 1wis s VAL 57 Ca 0.06 1.73 0.00 0.00 0.00 0.00 0.00 61.98 63.77 1wis s VAL 57 Cb -0.11 -4.10 0.00 0.00 0.00 0.00 0.00 36.38 32.17 1wis s VAL 57 CO 0.00 0.26 0.00 0.61 0.00 0.00 0.00 175.10 175.98 1wis n GLY 58 N 2.27 0.51 3.69 4.51 0.00 -0.77 -4.46 105.19 110.93 1wis n GLY 58 Ca 0.03 0.49 -0.64 0.00 0.00 0.00 0.00 46.02 45.91 1wis n GLY 58 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1wis n VAL 59 N 0.00 0.05 -3.82 1.61 3.14 -1.26 -4.70 118.33 113.35 1wis n VAL 59 Ca 0.00 -0.01 -0.29 0.00 -2.96 0.00 0.00 64.34 61.08 1wis n VAL 59 Cb 0.00 -0.54 -0.13 0.00 -1.06 0.00 0.00 33.84 32.11 1wis n VAL 59 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 1wis s VAL 60 N 2.37 2.20 0.00 1.55 1.01 -1.26 -4.84 120.40 121.43 1wis s VAL 60 Ca 1.00 -3.43 0.00 0.00 0.00 0.00 0.00 61.98 59.55 1wis s VAL 60 Cb -1.35 -2.49 0.00 0.00 0.00 0.00 0.00 36.38 32.53 1wis s VAL 60 CO 0.72 -0.94 0.00 0.61 0.00 0.00 0.00 175.10 175.49 1wis n GLY 61 N 2.77 5.38 0.54 4.51 0.00 -1.26 -5.10 105.19 112.03 1wis n GLY 61 Ca 0.14 -1.26 -0.14 0.00 0.00 0.00 0.00 46.02 44.75 1wis n GLY 61 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wis n GLU 62 N 0.00 0.31 -0.29 1.61 1.02 -1.26 -4.60 120.64 117.42 1wis n GLU 62 Ca 0.00 0.13 0.28 0.00 -0.02 0.00 0.00 57.16 57.56 1wis n GLU 62 Cb 0.00 -1.02 0.52 0.00 -0.02 0.00 0.00 31.44 30.93 1wis n GLU 62 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1wis n GLY 63 N 2.14 -0.72 3.81 0.62 0.00 -1.26 -4.29 105.19 105.49 1wis n GLY 63 Ca -0.25 0.75 -0.33 0.00 0.00 0.00 0.00 46.02 46.19 1wis n GLY 63 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wis s GLU 64 N -5.42 3.97 0.52 1.61 8.01 -1.26 -5.05 118.70 121.07 1wis s GLU 64 Ca -0.08 1.22 -0.05 0.00 0.01 0.00 0.00 54.97 56.06 1wis s GLU 64 Cb 0.31 -2.13 -0.02 0.00 -4.31 0.00 0.00 34.13 27.98 1wis s GLU 64 CO 0.71 -0.27 0.82 -1.83 0.01 0.00 0.00 175.26 174.71 1wis s GLU 65 N -3.32 3.35 -0.09 1.61 -1.05 -1.26 -4.91 118.70 113.03 1wis s GLU 65 Ca 0.64 0.14 0.02 0.00 -0.15 0.00 0.00 54.97 55.62 1wis s GLU 65 Cb -0.13 -2.34 -0.02 0.00 -0.44 0.00 0.00 34.13 31.20 1wis s GLU 65 CO 0.19 -0.36 -0.14 -1.58 0.95 0.00 0.00 175.26 174.31 1wis s TRP 66 N -2.82 2.74 0.29 4.83 0.52 -1.26 -4.89 118.94 118.35 1wis s TRP 66 Ca 0.50 -0.44 0.11 0.00 0.02 0.00 0.00 56.10 56.29 1wis s TRP 66 Cb -0.10 -1.73 -0.05 0.00 -1.15 0.00 0.00 33.47 30.43 1wis s TRP 66 CO 0.45 -0.04 -0.13 -0.51 0.02 0.00 0.00 176.95 176.75 1wis s LEU 67 N -0.16 2.77 0.53 2.99 1.43 -1.23 -4.95 118.68 120.06 1wis s LEU 67 Ca -0.01 -0.97 -0.17 0.00 -1.03 0.00 0.00 54.13 51.95 1wis s LEU 67 Cb -0.13 -1.24 -0.07 0.00 0.03 0.00 0.00 46.19 44.78 1wis s LEU 67 CO 0.03 -0.02 1.01 -0.22 0.23 0.00 0.00 176.35 177.38 1wis s LEU 68 N -3.58 3.63 0.00 1.79 2.96 -1.26 -1.65 118.68 120.57 1wis s LEU 68 Ca 0.31 1.69 0.00 0.00 -0.22 0.00 0.00 54.13 55.91 1wis s LEU 68 Cb -0.04 -4.52 0.00 0.00 0.50 0.00 0.00 46.19 42.13 1wis s LEU 68 CO 0.17 -0.77 0.00 2.30 -1.32 0.00 0.00 176.35 176.72 1wis n ILE 69 N -1.59 0.00 -4.26 6.68 -5.35 0.77 -4.84 119.36 110.77 1wis n ILE 69 Ca 0.08 0.00 -0.19 0.00 -0.27 0.00 0.00 62.75 62.36 1wis n ILE 69 Cb 0.53 -0.44 -0.16 0.00 -1.74 0.00 0.00 39.64 37.84 1wis n ILE 69 CO 0.00 0.00 0.00 -2.28 -1.76 0.00 0.00 176.55 172.51 1wis s HIS 70 N -1.63 0.77 -0.05 4.28 5.04 -0.91 -4.92 115.29 117.87 1wis s HIS 70 Ca 0.00 -0.19 -0.01 0.00 -1.54 0.00 0.00 55.06 53.32 1wis s HIS 70 Cb 0.00 -0.59 0.03 0.00 0.04 0.00 0.00 32.58 32.06 1wis s HIS 70 CO 0.00 -0.11 0.02 1.14 -2.34 0.00 0.00 174.74 173.45 1wis s GLN 71 N 0.36 0.30 -0.34 2.88 -2.07 -1.26 0.35 119.66 119.88 1wis s GLN 71 Ca -0.05 0.19 -0.11 0.00 -1.82 0.00 0.00 55.36 53.57 1wis s GLN 71 Cb -0.09 -0.68 0.01 0.00 -1.09 0.00 0.00 33.01 31.15 1wis s GLN 71 CO 0.00 -0.26 0.18 -1.17 -1.32 0.00 0.00 175.29 172.72 1wis s LEU 72 N 1.77 4.42 0.26 2.60 2.96 0.76 -4.91 118.68 126.54 1wis s LEU 72 Ca 0.01 -0.73 0.05 0.00 -0.22 0.00 0.00 54.13 53.25 1wis s LEU 72 Cb -0.13 -2.02 -0.03 0.00 0.50 0.00 0.00 46.19 44.51 1wis s LEU 72 CO -0.03 -0.28 0.36 -0.55 -1.32 0.00 0.00 176.35 174.52 1wis s SER 73 N 1.60 6.17 -0.34 3.68 0.15 -1.26 0.13 113.70 123.83 1wis s SER 73 Ca 0.04 -0.01 -0.30 0.00 0.70 0.00 0.00 55.95 56.38 1wis s SER 73 Cb -0.18 -1.71 0.04 0.00 -1.71 0.00 0.00 66.02 62.46 1wis s SER 73 CO 0.07 -0.12 0.50 0.59 1.20 0.00 0.00 173.24 175.47 1wis n ASN 74 N -1.42 -5.20 0.00 5.45 4.13 -0.27 -4.92 115.26 113.03 1wis n ASN 74 Ca -0.07 -0.06 0.00 0.00 1.68 0.00 0.00 54.58 56.13 1wis n ASN 74 Cb 0.57 -1.46 0.00 0.00 -1.54 0.00 0.00 39.78 37.36 1wis n ASN 74 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1wis n GLU 75 N 0.09 0.00 0.00 3.52 1.02 -1.26 -5.00 120.64 119.01 1wis n GLU 75 Ca -0.07 0.00 0.11 0.00 -0.02 0.00 0.00 57.16 57.18 1wis n GLU 75 Cb 0.60 0.00 0.65 0.00 -0.02 0.00 0.00 31.44 32.67 1wis n GLU 75 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1wis n PRO 76 N 0.00 0.75 -2.31 3.49 -0.04 -1.26 -3.18 135.00 132.45 1wis n PRO 76 Ca 0.00 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.16 1wis n PRO 76 Cb 0.00 -1.46 0.01 0.00 -0.04 0.00 0.00 33.50 32.01 1wis n PRO 76 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1wis n ASP 77 N -0.96 5.41 -3.73 3.54 8.00 -1.26 -4.81 116.55 122.74 1wis n ASP 77 Ca 0.16 -3.75 -0.29 0.00 0.71 0.00 0.00 54.79 51.62 1wis n ASP 77 Cb 0.08 -0.60 -0.13 0.00 -0.02 0.00 0.00 41.12 40.45 1wis n ASP 77 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1wis s ALA 78 N -3.67 2.39 0.47 2.24 0.00 -1.19 -4.94 121.76 117.05 1wis s ALA 78 Ca 0.49 -2.79 0.14 0.00 0.00 0.00 0.00 51.96 49.80 1wis s ALA 78 Cb 0.41 -1.92 1.08 0.00 0.00 0.00 0.00 23.12 22.69 1wis s ALA 78 CO -0.23 -2.06 2.06 0.00 0.00 0.00 0.00 175.76 175.53 1wis h ARG 79 N 6.47 0.07 -4.24 0.00 2.47 -1.90 -3.44 114.38 113.81 1wis h ARG 79 Ca 0.02 -0.01 -0.17 0.00 -1.26 0.00 0.00 59.98 58.57 1wis h ARG 79 Cb 0.90 -0.01 -0.14 0.00 -1.65 0.00 0.00 29.97 29.07 1wis h ARG 79 CO 0.52 0.14 -0.49 -1.54 0.56 0.00 0.00 179.97 179.17 1wis s SER 80 N -6.99 0.14 0.02 7.04 1.04 -1.26 -2.59 113.70 111.09 1wis s SER 80 Ca -0.05 -1.15 -0.28 0.00 0.48 0.00 0.00 55.95 54.95 1wis s SER 80 Cb 0.16 0.40 0.10 0.00 0.10 0.00 0.00 66.02 66.78 1wis s SER 80 CO 0.69 -0.86 0.87 0.00 0.98 0.00 0.00 173.24 174.92 1wis s MET 81 N -4.06 0.88 0.17 4.02 0.23 -1.13 -5.01 119.30 114.40 1wis s MET 81 Ca 0.27 -0.33 -0.22 0.00 -1.03 0.00 0.00 55.69 54.38 1wis s MET 81 Cb 0.05 0.40 -0.08 0.00 -1.53 0.00 0.00 34.83 33.67 1wis s MET 81 CO 0.06 -0.38 0.73 -2.00 -2.03 0.00 0.00 175.02 171.39 1wis s GLU 82 N -3.18 4.39 -0.53 3.16 2.12 -1.26 -1.87 118.70 121.52 1wis s GLU 82 Ca 0.05 0.99 -0.02 0.00 0.36 0.00 0.00 54.97 56.35 1wis s GLU 82 Cb -0.01 -3.11 0.14 0.00 0.26 0.00 0.00 34.13 31.41 1wis s GLU 82 CO -0.09 0.51 0.33 0.08 -0.54 0.00 0.00 175.26 175.55 1wis s VAL 83 N -1.29 3.37 0.39 3.70 1.01 0.98 -4.94 120.40 123.63 1wis s VAL 83 Ca 0.38 -2.72 -0.07 0.00 0.00 0.00 0.00 61.98 59.57 1wis s VAL 83 Cb -0.20 -3.25 0.09 0.00 0.00 0.00 0.00 36.38 33.02 1wis s VAL 83 CO 0.23 -0.80 0.43 -0.81 0.00 0.00 0.00 175.10 174.16 1wis n PRO 84 N 3.79 -1.11 -3.49 2.72 -0.04 -1.26 -2.70 135.00 132.91 1wis n PRO 84 Ca 0.04 -0.68 -0.17 0.00 -0.04 0.00 0.00 63.50 62.65 1wis n PRO 84 Cb 0.38 -0.54 0.01 0.00 -0.04 0.00 0.00 33.50 33.32 1wis n PRO 84 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1wis n ASP 85 N -3.48 -6.08 -4.31 3.54 -0.08 -0.80 -4.85 116.55 100.49 1wis n ASP 85 Ca 0.06 -0.65 -0.27 0.00 -1.51 0.00 0.00 54.79 52.41 1wis n ASP 85 Cb 0.21 -3.49 -0.14 0.00 2.34 0.00 0.00 41.12 40.04 1wis n ASP 85 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1wis s LEU 86 N -5.02 2.23 -0.29 -2.67 1.43 -0.74 -5.00 118.68 108.61 1wis s LEU 86 Ca 0.13 -0.62 -0.24 0.00 -1.03 0.00 0.00 54.13 52.37 1wis s LEU 86 Cb -0.05 -1.10 -0.00 0.00 0.03 0.00 0.00 46.19 45.07 1wis s LEU 86 CO 0.83 0.17 0.80 0.20 0.23 0.00 0.00 176.35 178.58 1wis s ASN 87 N -1.53 6.70 0.58 2.29 0.01 -1.26 -4.33 114.94 117.41 1wis s ASN 87 Ca 0.10 0.76 -0.16 0.00 -0.71 0.00 0.00 52.86 52.85 1wis s ASN 87 Cb -0.10 -2.41 -0.04 0.00 0.41 0.00 0.00 41.25 39.11 1wis s ASN 87 CO 0.03 -0.59 1.05 -2.16 -1.51 0.00 0.00 177.10 173.92 1wis s PRO 88 N 2.93 3.40 -1.59 -0.60 0.04 -1.22 -3.65 135.00 134.31 1wis s PRO 88 Ca 0.33 1.17 -0.12 0.00 0.04 0.00 0.00 61.00 62.42 1wis s PRO 88 Cb -0.14 -2.05 0.10 0.00 0.04 0.00 0.00 34.50 32.45 1wis s PRO 88 CO 0.11 -0.74 0.72 0.34 0.04 0.00 0.00 177.00 177.47 1wis n PHE 89 N -1.97 -1.82 -3.77 0.56 7.35 -0.31 -4.91 117.46 112.60 1wis n PHE 89 Ca 0.08 0.80 -0.13 0.00 -0.76 0.00 0.00 57.45 57.45 1wis n PHE 89 Cb 0.53 -3.36 -0.12 0.00 0.35 0.00 0.00 39.48 36.89 1wis n PHE 89 CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1wis s THR 90 N -3.48 -0.01 -0.21 -2.13 2.01 -1.24 -4.98 115.64 105.59 1wis s THR 90 Ca 0.52 0.03 -0.29 0.00 0.31 0.00 0.00 61.69 62.26 1wis s THR 90 Cb -0.28 -0.38 -0.01 0.00 0.01 0.00 0.00 72.50 71.84 1wis s THR 90 CO 0.90 0.01 1.32 0.00 -0.69 0.00 0.00 174.62 176.16 1wis s TYR 92 N 3.97 0.80 0.45 0.00 1.51 -1.26 -1.85 117.35 120.97 1wis s TYR 92 Ca 0.57 -0.82 0.05 0.00 -1.01 0.00 0.00 57.07 55.86 1wis s TYR 92 Cb -0.21 -0.47 -0.05 0.00 -0.11 0.00 0.00 41.96 41.12 1wis s TYR 92 CO 0.19 -0.15 0.03 0.45 -1.11 0.00 0.00 175.55 174.96 1wis s SER 93 N -2.65 4.02 -0.20 2.29 0.15 -1.22 -4.24 113.70 111.86 1wis s SER 93 Ca 0.06 -1.44 -0.21 0.00 0.70 0.00 0.00 55.95 55.06 1wis s SER 93 Cb 0.02 -0.09 0.06 0.00 -1.71 0.00 0.00 66.02 64.30 1wis s SER 93 CO -0.04 -0.60 0.59 -0.36 1.20 0.00 0.00 173.24 174.03 1wis s PHE 94 N -2.76 -0.64 0.00 3.44 0.08 -1.26 -3.74 117.98 113.11 1wis s PHE 94 Ca 0.26 1.51 0.00 0.00 0.12 0.00 0.00 56.93 58.82 1wis s PHE 94 Cb 0.06 0.24 0.00 0.00 -0.57 0.00 0.00 43.02 42.75 1wis s PHE 94 CO 0.14 -0.34 0.00 2.89 -0.10 0.00 0.00 175.22 177.80 1wis n ARG 95 N 2.54 1.65 -4.19 0.44 1.85 -0.33 -2.49 116.66 116.13 1wis n ARG 95 Ca -0.14 0.00 -0.11 0.00 -1.00 0.00 0.00 57.85 56.59 1wis n ARG 95 Cb 0.56 0.00 -0.10 0.00 -1.05 0.00 0.00 32.46 31.87 1wis n ARG 95 CO 0.00 0.00 0.00 -1.64 -0.01 0.00 0.00 177.63 175.98 1wis s MET 96 N -1.28 0.95 -0.23 2.89 -1.94 -1.26 -4.11 119.30 114.33 1wis s MET 96 Ca 0.00 -1.43 -0.27 0.00 -1.71 0.00 0.00 55.69 52.28 1wis s MET 96 Cb 0.00 -0.09 0.11 0.00 2.01 0.00 0.00 34.83 36.86 1wis s MET 96 CO 0.00 -0.13 0.95 1.03 -0.01 0.00 0.00 175.02 176.86 1wis s ARG 97 N -3.93 0.63 0.11 2.03 0.52 -0.89 -3.92 118.95 113.50 1wis s ARG 97 Ca 0.19 0.50 0.08 0.00 -0.52 0.00 0.00 55.73 55.98 1wis s ARG 97 Cb 0.06 0.30 -0.04 0.00 0.52 0.00 0.00 34.95 35.80 1wis s ARG 97 CO 0.00 -0.12 -0.13 -0.65 0.02 0.00 0.00 175.30 174.41 1wis s GLN 98 N -0.24 1.99 -0.05 3.54 -0.21 -1.26 -1.39 119.66 122.04 1wis s GLN 98 Ca 0.00 -1.09 0.00 0.00 0.02 0.00 0.00 55.36 54.29 1wis s GLN 98 Cb -0.03 -2.23 0.03 0.00 1.00 0.00 0.00 33.01 31.78 1wis s GLN 98 CO -0.02 0.50 -0.02 0.08 -2.12 0.00 0.00 175.29 173.72 1wis s VAL 99 N -1.18 0.37 0.41 1.09 1.01 -1.00 -2.17 120.40 118.92 1wis s VAL 99 Ca 0.20 0.03 0.05 0.00 0.00 0.00 0.00 61.98 62.25 1wis s VAL 99 Cb -0.11 -0.46 -0.02 0.00 0.00 0.00 0.00 36.38 35.79 1wis s VAL 99 CO 0.12 0.21 0.17 0.54 0.00 0.00 0.00 175.10 176.15 1wis s ASN 100 N 1.30 2.71 0.53 3.32 2.20 -0.41 0.18 114.94 124.77 1wis s ASN 100 Ca -0.05 -1.75 0.29 0.00 -0.94 0.00 0.00 52.86 50.41 1wis s ASN 100 Cb -0.13 0.61 1.59 0.00 -2.00 0.00 0.00 41.25 41.31 1wis s ASN 100 CO -0.02 -1.01 1.88 -0.29 -2.94 0.00 0.00 177.10 174.71 1wis h ILE 101 N 1.79 0.00 0.00 0.54 6.09 -1.93 -2.91 117.51 121.09 1wis h ILE 101 Ca -0.32 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.17 1wis h ILE 101 Cb 1.27 0.65 0.00 0.00 0.47 0.00 0.00 36.82 39.21 1wis h ILE 101 CO 0.50 0.00 0.00 0.52 -3.07 0.00 0.00 178.15 176.10 1wis n VAL 102 N -2.65 0.00 -1.65 2.19 0.31 -1.26 -5.07 118.33 110.20 1wis n VAL 102 Ca -0.02 0.24 0.00 0.00 -0.01 0.00 0.00 64.34 64.55 1wis n VAL 102 Cb 0.21 -0.75 0.00 0.00 -0.91 0.00 0.00 33.84 32.39 1wis n VAL 102 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wis n GLY 103 N 2.25 2.33 3.21 2.92 0.00 -1.10 -5.06 105.19 109.74 1wis n GLY 103 Ca 0.00 -0.45 -0.33 0.00 0.00 0.00 0.00 46.02 45.24 1wis n GLY 103 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wis s THR 104 N -1.39 2.24 1.26 2.61 2.01 -1.26 -1.28 115.64 119.83 1wis s THR 104 Ca 0.00 -0.92 -0.16 0.00 0.31 0.00 0.00 61.69 60.92 1wis s THR 104 Cb 0.00 -1.90 0.31 0.00 0.01 0.00 0.00 72.50 70.92 1wis s THR 104 CO 0.00 0.54 0.91 -1.54 -0.69 0.00 0.00 174.62 173.84 1wis n SER 105 N 3.97 -2.47 -4.79 3.53 3.41 -0.92 -4.99 113.62 111.36 1wis n SER 105 Ca -0.20 -0.36 -0.29 0.00 -0.26 0.00 0.00 58.87 57.76 1wis n SER 105 Cb 0.52 -1.17 0.13 0.00 -0.26 0.00 0.00 64.21 63.43 1wis n SER 105 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1wis s PRO 106 N -4.46 1.28 0.20 4.33 0.04 -1.26 -4.75 135.00 130.38 1wis s PRO 106 Ca 0.67 0.33 -0.30 0.00 0.04 0.00 0.00 61.00 61.75 1wis s PRO 106 Cb -0.22 -1.85 -0.08 0.00 0.04 0.00 0.00 34.50 32.39 1wis s PRO 106 CO 0.64 -2.11 1.11 -1.25 0.04 0.00 0.00 177.00 175.42 1wis s PRO 107 N -5.27 4.59 0.69 0.56 0.04 -1.26 -4.84 135.00 129.51 1wis s PRO 107 Ca 0.63 1.75 0.02 0.00 0.04 0.00 0.00 61.00 63.44 1wis s PRO 107 Cb -0.15 -3.26 0.12 0.00 0.04 0.00 0.00 34.50 31.26 1wis s PRO 107 CO 0.53 0.09 0.95 0.45 0.04 0.00 0.00 177.00 179.06 1wis s SER 108 N -0.24 4.51 0.46 6.66 0.15 -1.25 -5.07 113.70 118.92 1wis s SER 108 Ca 0.49 -0.49 -0.22 0.00 0.70 0.00 0.00 55.95 56.43 1wis s SER 108 Cb -0.30 0.08 -0.08 0.00 -1.71 0.00 0.00 66.02 64.01 1wis s SER 108 CO 0.36 -1.75 1.07 0.00 1.20 0.00 0.00 173.24 174.12 1wis s GLN 109 N -5.03 3.86 0.54 5.44 -2.07 -1.26 -4.78 119.66 116.36 1wis s GLN 109 Ca 0.65 1.49 -0.18 0.00 -1.82 0.00 0.00 55.36 55.50 1wis s GLN 109 Cb -0.05 -2.26 -0.06 0.00 -1.09 0.00 0.00 33.01 29.54 1wis s GLN 109 CO 0.43 -0.40 1.04 -1.25 -1.32 0.00 0.00 175.29 173.79 1wis s PRO 110 N -2.94 3.58 0.49 9.60 0.04 -1.26 -4.76 135.00 139.74 1wis s PRO 110 Ca 0.64 1.25 -0.16 0.00 0.04 0.00 0.00 61.00 62.78 1wis s PRO 110 Cb -0.20 -2.07 -0.08 0.00 0.04 0.00 0.00 34.50 32.19 1wis s PRO 110 CO 0.25 -0.60 0.94 -1.54 0.04 0.00 0.00 177.00 176.09 1wis s SER 111 N -2.46 6.61 0.33 6.66 1.04 -1.04 -4.97 113.70 119.88 1wis s SER 111 Ca 0.65 1.49 -0.21 0.00 0.48 0.00 0.00 55.95 58.36 1wis s SER 111 Cb -0.16 -2.48 -0.15 0.00 0.10 0.00 0.00 66.02 63.34 1wis s SER 111 CO 0.29 -0.55 0.17 -2.11 0.98 0.00 0.00 173.24 172.02 1wis n ARG 112 N -1.50 0.00 -1.89 4.02 1.85 -1.26 -4.71 116.66 113.17 1wis n ARG 112 Ca 0.06 0.00 -0.41 0.00 -1.00 0.00 0.00 57.85 56.50 1wis n ARG 112 Cb 0.54 -0.93 -0.01 0.00 -1.05 0.00 0.00 32.46 31.01 1wis n ARG 112 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 177.63 177.83 1wis s LYS 113 N -0.93 4.19 0.23 2.89 2.47 -1.26 -4.94 119.74 122.38 1wis s LYS 113 Ca 0.56 2.46 0.01 0.00 -1.56 0.00 0.00 55.97 57.45 1wis s LYS 113 Cb -0.65 -3.03 -0.01 0.00 -1.46 0.00 0.00 37.83 32.68 1wis s LYS 113 CO 0.57 -0.48 0.05 0.44 0.16 0.00 0.00 175.35 176.09 1wis n ILE 114 N 1.42 0.00 -3.48 5.43 -6.64 -1.26 -5.11 119.36 109.72 1wis n ILE 114 Ca 0.04 -1.24 -0.19 0.00 -1.77 0.00 0.00 62.75 59.60 1wis n ILE 114 Cb 0.39 0.39 -0.13 0.00 -1.44 0.00 0.00 39.64 38.85 1wis n ILE 114 CO 0.00 0.00 0.00 -1.58 -1.77 0.00 0.00 176.55 173.20 1wis s GLN 115 N -2.85 0.21 0.70 6.28 0.74 -1.26 -4.36 119.66 119.11 1wis s GLN 115 Ca 0.08 0.12 -0.16 0.00 0.05 0.00 0.00 55.36 55.44 1wis s GLN 115 Cb 0.00 -1.15 0.02 0.00 1.10 0.00 0.00 33.01 32.98 1wis s GLN 115 CO 0.05 -0.72 1.26 0.95 -0.55 0.00 0.00 175.29 176.28 1wis s THR 116 N 2.32 2.10 1.31 -0.34 -4.23 -1.26 -4.89 115.64 110.65 1wis s THR 116 Ca 0.07 0.05 -0.22 0.00 -1.18 0.00 0.00 61.69 60.42 1wis s THR 116 Cb -0.16 -2.83 0.33 0.00 1.34 0.00 0.00 72.50 71.18 1wis s THR 116 CO -0.16 -0.02 1.04 -0.76 -0.54 0.00 0.00 174.62 174.19 1wis s LEU 117 N -4.79 -0.10 -0.01 4.79 1.43 -0.55 -1.98 118.68 117.46 1wis s LEU 117 Ca 0.79 0.64 -0.12 0.00 -1.03 0.00 0.00 54.13 54.41 1wis s LEU 117 Cb -0.34 -2.20 -0.05 0.00 0.03 0.00 0.00 46.19 43.63 1wis s LEU 117 CO 0.43 -4.72 0.35 -1.10 0.23 0.00 0.00 176.35 171.55 1wis s GLN 118 N -5.35 3.79 -0.36 1.70 -0.21 -1.26 -1.16 119.66 116.82 1wis s GLN 118 Ca 0.71 0.25 -0.20 0.00 0.02 0.00 0.00 55.36 56.14 1wis s GLN 118 Cb -0.10 -3.17 0.00 0.00 1.00 0.00 0.00 33.01 30.74 1wis s GLN 118 CO 0.56 0.68 0.62 0.45 -2.12 0.00 0.00 175.29 175.49 1wis s SER 119 N -1.21 6.42 0.00 5.90 0.15 -1.26 -4.89 113.70 118.80 1wis s SER 119 Ca 0.24 0.12 0.00 0.00 0.70 0.00 0.00 55.95 57.01 1wis s SER 119 Cb -0.15 -2.32 0.00 0.00 -1.71 0.00 0.00 66.02 61.84 1wis s SER 119 CO 0.13 -0.59 0.00 0.61 1.20 0.00 0.00 173.24 174.59 1wis n GLY 120 N 4.68 0.79 3.63 9.45 0.00 -1.26 -5.12 105.19 117.37 1wis n GLY 120 Ca -0.02 -0.75 -0.43 0.00 0.00 0.00 0.00 46.02 44.83 1wis n GLY 120 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wis s PRO 121 N -0.86 3.93 0.17 1.61 0.04 -1.26 -5.01 135.00 133.62 1wis s PRO 121 Ca 0.00 1.33 0.06 0.00 0.04 0.00 0.00 61.00 62.44 1wis s PRO 121 Cb 0.00 -3.89 -0.04 0.00 0.04 0.00 0.00 34.50 30.61 1wis s PRO 121 CO 0.00 -1.10 0.07 -1.12 0.04 0.00 0.00 177.00 174.88 1wis s SER 122 N 2.89 5.13 -0.30 6.66 0.01 -1.26 -5.11 113.70 121.72 1wis s SER 122 Ca 0.58 -0.27 -0.06 0.00 1.31 0.00 0.00 55.95 57.50 1wis s SER 122 Cb -0.18 -1.22 0.19 0.00 0.21 0.00 0.00 66.02 65.02 1wis s SER 122 CO 0.23 0.08 0.82 -0.94 0.41 0.00 0.00 173.24 173.84 1wis s SER 123 N -3.05 -0.96 0.00 2.44 1.04 -1.26 -5.31 113.70 106.60 1wis s SER 123 Ca 0.29 0.49 0.00 0.00 0.48 0.00 0.00 55.95 57.21 1wis s SER 123 Cb -0.10 1.76 0.00 0.00 0.10 0.00 0.00 66.02 67.78 1wis s SER 123 CO 0.21 -0.18 0.00 0.61 0.98 0.00 0.00 173.24 174.86