#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ip7 s VAL 2 N 0.00 3.34 0.52 0.58 1.01 -1.26 -0.45 120.40 124.14 1ip7 s VAL 2 Ca 0.00 -0.97 -0.20 0.00 0.00 0.00 0.00 61.98 60.81 1ip7 s VAL 2 Cb 0.00 -2.75 -0.06 0.00 0.00 0.00 0.00 36.38 33.56 1ip7 s VAL 2 CO 0.00 0.08 1.12 -0.36 0.00 0.00 0.00 175.10 175.94 1ip7 s PHE 3 N 1.38 2.75 0.27 5.22 0.08 -0.42 -4.99 117.98 122.27 1ip7 s PHE 3 Ca 0.00 1.55 -0.15 0.00 0.12 0.00 0.00 56.93 58.46 1ip7 s PHE 3 Cb -0.17 -3.26 -0.08 0.00 -0.57 0.00 0.00 43.02 38.93 1ip7 s PHE 3 CO -0.01 -1.43 0.68 -2.00 -0.10 0.00 0.00 175.22 172.36 1ip7 s GLU 4 N -3.21 4.00 0.06 0.44 -6.30 -1.26 -4.87 118.70 107.56 1ip7 s GLU 4 Ca 0.71 0.60 -0.12 0.00 -2.50 0.00 0.00 54.97 53.66 1ip7 s GLU 4 Cb -0.23 -2.60 -0.03 0.00 0.00 0.00 0.00 34.13 31.26 1ip7 s GLU 4 CO 0.26 0.26 1.21 -0.09 0.02 0.00 0.00 175.26 176.93 1ip7 h ARG 5 N 2.64 -0.04 0.00 4.30 2.43 -1.96 -1.03 114.38 120.72 1ip7 h ARG 5 Ca -0.48 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 58.67 1ip7 h ARG 5 Cb 1.18 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.73 1ip7 h ARG 5 CO 0.66 -0.03 -0.14 0.00 -1.51 0.00 0.00 179.97 178.95 1ip7 h GLU 7 N 0.00 0.27 -0.48 0.00 4.81 -1.67 -0.90 114.58 116.61 1ip7 h GLU 7 Ca -0.00 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 59.11 1ip7 h GLU 7 Cb 0.37 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 1ip7 h GLU 7 CO 0.02 0.42 0.10 1.25 -0.73 0.00 0.00 179.01 180.07 1ip7 h LEU 8 N 0.08 0.74 -0.31 1.64 5.85 -0.80 -2.02 115.31 120.49 1ip7 h LEU 8 Ca 0.05 -0.24 0.06 0.00 0.84 0.00 0.00 57.88 58.59 1ip7 h LEU 8 Cb 0.27 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.05 1ip7 h LEU 8 CO 0.00 0.79 -0.03 0.00 -0.34 0.00 0.00 178.44 178.87 1ip7 h ALA 9 N 0.97 0.26 -0.82 1.25 0.00 -1.08 0.62 119.26 120.46 1ip7 h ALA 9 Ca 0.15 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 1ip7 h ALA 9 Cb 0.35 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1ip7 h ALA 9 CO 0.00 -0.43 0.37 0.00 0.00 0.00 0.00 179.25 179.20 1ip7 h ARG 10 N 0.06 1.20 -0.14 0.00 3.08 -1.04 -1.74 114.38 115.80 1ip7 h ARG 10 Ca 0.15 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 1ip7 h ARG 10 Cb 0.21 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1ip7 h ARG 10 CO -0.28 0.94 0.04 1.15 -1.07 0.00 0.00 179.97 180.75 1ip7 h THR 11 N 1.18 1.20 -0.77 2.04 2.02 -0.73 0.17 112.91 118.01 1ip7 h THR 11 Ca 0.28 -0.61 -0.03 0.00 0.77 0.00 0.00 66.41 66.81 1ip7 h THR 11 Cb 0.15 1.34 -0.04 0.00 -1.74 0.00 0.00 68.15 67.87 1ip7 h THR 11 CO -0.03 0.18 0.35 -0.07 0.37 0.00 0.00 175.52 176.32 1ip7 h LEU 12 N 0.03 1.01 -0.41 2.58 3.38 -0.80 -0.31 115.31 120.79 1ip7 h LEU 12 Ca 0.04 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 1ip7 h LEU 12 Cb 0.25 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1ip7 h LEU 12 CO 0.00 0.87 0.02 0.50 0.09 0.00 0.00 178.44 179.92 1ip7 h LYS 13 N 1.10 0.71 -0.31 1.13 3.64 -1.13 -1.70 116.57 120.01 1ip7 h LYS 13 Ca 0.26 -0.21 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1ip7 h LYS 13 Cb 0.14 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 1ip7 h LYS 13 CO -0.03 0.78 0.11 -0.09 -2.27 0.00 0.00 179.45 177.95 1ip7 h ARG 14 N 0.55 0.44 -0.76 1.90 2.43 -0.47 -2.20 114.38 116.27 1ip7 h ARG 14 Ca 0.12 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.24 1ip7 h ARG 14 Cb 0.44 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.91 1ip7 h ARG 14 CO 0.02 0.38 0.00 1.28 -1.51 0.00 0.00 179.97 180.14 1ip7 n LEU 15 N -4.40 2.31 -1.58 3.80 4.77 -0.17 -4.91 117.00 116.82 1ip7 n LEU 15 Ca 0.02 -1.17 -0.13 0.00 -0.03 0.00 0.00 56.01 54.69 1ip7 n LEU 15 Cb 0.14 -0.49 -0.00 0.00 -2.33 0.00 0.00 43.42 40.74 1ip7 n LEU 15 CO 0.36 0.36 -0.15 0.61 -1.33 0.00 0.00 177.39 177.25 1ip7 n GLY 16 N 0.32 -0.17 0.09 -0.72 0.00 -0.83 -4.95 105.19 98.94 1ip7 n GLY 16 Ca 0.09 -0.31 0.11 0.00 0.00 0.00 0.00 46.02 45.91 1ip7 n GLY 16 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1ip7 n MET 17 N -2.35 0.60 -1.96 1.61 2.81 -0.69 -4.49 117.12 112.64 1ip7 n MET 17 Ca -0.15 0.05 -0.40 0.00 -1.81 0.00 0.00 57.70 55.40 1ip7 n MET 17 Cb 0.61 -1.75 -0.03 0.00 -0.71 0.00 0.00 33.22 31.34 1ip7 n MET 17 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1ip7 s ASP 18 N -5.11 5.39 0.00 7.83 2.15 -1.26 -1.72 116.67 123.95 1ip7 s ASP 18 Ca -0.02 0.79 0.00 0.00 0.43 0.00 0.00 52.55 53.75 1ip7 s ASP 18 Cb 0.11 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.20 1ip7 s ASP 18 CO 0.81 -2.20 0.00 0.61 -0.17 0.00 0.00 175.17 174.22 1ip7 n GLY 19 N 5.64 0.69 3.70 2.66 0.00 0.16 -4.89 105.19 113.14 1ip7 n GLY 19 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 1ip7 n GLY 19 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ip7 s TYR 20 N -2.59 2.27 -1.34 1.61 5.04 -0.70 -0.67 117.35 120.97 1ip7 s TYR 20 Ca 0.00 0.03 -0.08 0.00 -2.44 0.00 0.00 57.07 54.57 1ip7 s TYR 20 Cb 0.00 -4.18 0.06 0.00 0.35 0.00 0.00 41.96 38.18 1ip7 s TYR 20 CO 0.00 -4.82 0.52 0.54 -1.34 0.00 0.00 175.55 170.45 1ip7 n ARG 21 N 5.38 -3.74 -1.01 4.97 5.12 -1.26 -0.75 116.66 125.37 1ip7 n ARG 21 Ca 0.17 0.57 -0.00 0.00 -1.93 0.00 0.00 57.85 56.66 1ip7 n ARG 21 Cb 0.37 -5.31 -0.00 0.00 -1.16 0.00 0.00 32.46 26.36 1ip7 n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1ip7 n GLY 22 N -1.25 0.34 3.57 -0.13 0.00 0.15 -5.00 105.19 102.88 1ip7 n GLY 22 Ca -0.04 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 1ip7 n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ip7 s ILE 23 N -1.65 5.17 0.82 -0.61 1.01 0.07 -4.88 121.20 121.12 1ip7 s ILE 23 Ca 0.00 0.27 -0.10 0.00 0.00 0.00 0.00 60.65 60.81 1ip7 s ILE 23 Cb 0.00 -3.77 0.08 0.00 0.01 0.00 0.00 42.46 38.79 1ip7 s ILE 23 CO 0.00 0.01 1.10 -0.94 0.00 0.00 0.00 174.94 175.11 1ip7 s SER 24 N 1.70 4.04 0.20 3.58 1.04 -1.26 0.36 113.70 123.37 1ip7 s SER 24 Ca 0.13 1.88 -0.11 0.00 0.48 0.00 0.00 55.95 58.34 1ip7 s SER 24 Cb -0.16 -2.51 0.14 0.00 0.10 0.00 0.00 66.02 63.59 1ip7 s SER 24 CO 0.11 -2.34 1.87 0.25 0.98 0.00 0.00 173.24 174.11 1ip7 h LEU 25 N -1.34 0.84 -1.25 2.42 5.85 -1.90 -1.80 115.31 118.12 1ip7 h LEU 25 Ca -0.44 -0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.33 1ip7 h LEU 25 Cb 1.24 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 42.01 1ip7 h LEU 25 CO 0.49 0.62 0.55 0.00 -0.34 0.00 0.00 178.44 179.76 1ip7 h ALA 26 N 1.26 1.65 -0.27 1.25 0.00 -1.92 -0.32 119.26 120.91 1ip7 h ALA 26 Ca 0.26 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 55.00 1ip7 h ALA 26 Cb -0.10 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 1ip7 h ALA 26 CO -0.06 0.19 -0.49 -0.91 0.00 0.00 0.00 179.25 177.98 1ip7 h ASN 27 N 0.85 0.81 -0.69 0.00 2.35 -1.67 -0.56 115.58 116.68 1ip7 h ASN 27 Ca 0.38 -0.41 -0.08 0.00 -0.55 0.00 0.00 56.30 55.65 1ip7 h ASN 27 Cb 0.35 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.47 1ip7 h ASN 27 CO -0.15 1.16 0.13 -0.50 -1.65 0.00 0.00 177.43 176.42 1ip7 h TRP 28 N 0.58 1.20 -0.50 1.19 4.06 -0.77 -1.11 115.95 120.61 1ip7 h TRP 28 Ca 0.03 -0.16 -0.02 0.00 2.06 0.00 0.00 58.89 60.79 1ip7 h TRP 28 Cb 1.06 -0.33 -0.02 0.00 -1.00 0.00 0.00 29.16 28.86 1ip7 h TRP 28 CO 0.06 0.99 0.21 0.52 -3.56 0.00 0.00 178.44 176.66 1ip7 h MET 29 N 1.07 0.73 -0.80 0.49 2.86 -0.94 -1.22 114.93 117.12 1ip7 h MET 29 Ca 0.21 -0.12 -0.04 0.00 -2.06 0.00 0.00 59.70 57.69 1ip7 h MET 29 Cb 0.42 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 31.92 1ip7 h MET 29 CO 0.01 0.64 0.33 0.00 1.06 0.00 0.00 176.91 178.95 1ip7 h LEU 31 N 1.15 -0.25 -0.85 0.00 5.85 -0.90 -2.50 115.31 117.81 1ip7 h LEU 31 Ca 0.27 -0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.95 1ip7 h LEU 31 Cb 0.19 0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 1ip7 h LEU 31 CO -0.02 -0.08 0.54 0.00 -0.34 0.00 0.00 178.44 178.54 1ip7 h ALA 32 N 0.34 1.13 0.32 1.25 0.00 -1.02 -0.32 119.26 120.96 1ip7 h ALA 32 Ca -0.03 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ip7 h ALA 32 Cb 0.31 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1ip7 h ALA 32 CO 0.05 0.35 -0.30 -0.22 0.00 0.00 0.00 179.25 179.13 1ip7 h LYS 33 N 1.03 -0.62 0.00 0.00 3.11 -1.10 -0.19 116.57 118.80 1ip7 h LYS 33 Ca 0.35 0.04 -0.04 0.00 -2.81 0.00 0.00 60.65 58.19 1ip7 h LYS 33 Cb 0.05 0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 31.42 1ip7 h LYS 33 CO -0.13 -0.42 -0.21 -1.49 -2.81 0.00 0.00 179.45 174.39 1ip7 h TRP 34 N -0.65 0.00 0.05 1.91 4.06 -1.26 -0.42 115.95 119.64 1ip7 h TRP 34 Ca -0.02 0.00 -0.10 0.00 2.06 0.00 0.00 58.89 60.83 1ip7 h TRP 34 Cb 0.58 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.75 1ip7 h TRP 34 CO -0.18 0.21 -0.48 0.93 -3.56 0.00 0.00 178.44 175.36 1ip7 h GLU 35 N 0.00 0.10 0.00 0.49 4.39 -0.92 -3.44 114.58 115.21 1ip7 h GLU 35 Ca -0.00 -0.18 0.00 0.00 0.34 0.00 0.00 59.36 59.52 1ip7 h GLU 35 Cb 0.90 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.61 1ip7 h GLU 35 CO 0.03 1.08 0.00 -1.13 -1.16 0.00 0.00 179.01 177.83 1ip7 n SER 36 N -4.40 0.14 -1.71 1.42 3.41 -0.16 -4.86 113.62 107.47 1ip7 n SER 36 Ca -0.15 -0.68 -0.13 0.00 -0.26 0.00 0.00 58.87 57.64 1ip7 n SER 36 Cb 0.63 0.08 0.01 0.00 -0.26 0.00 0.00 64.21 64.67 1ip7 n SER 36 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ip7 n GLY 37 N 0.08 -0.12 2.42 5.00 0.00 -0.17 -2.46 105.19 109.94 1ip7 n GLY 37 Ca 0.00 -0.28 -0.15 0.00 0.00 0.00 0.00 46.02 45.59 1ip7 n GLY 37 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ip7 n TYR 38 N -4.02 -0.09 -3.33 1.61 0.53 -1.18 -4.77 117.16 105.91 1ip7 n TYR 38 Ca -0.12 0.00 -0.42 0.00 -1.02 0.00 0.00 57.90 56.35 1ip7 n TYR 38 Cb 0.60 -2.73 -0.09 0.00 -1.03 0.00 0.00 39.34 36.09 1ip7 n TYR 38 CO 0.00 0.00 0.00 1.21 -1.02 0.00 0.00 176.86 177.05 1ip7 s ASN 39 N -2.77 6.22 0.55 7.72 2.47 -1.03 -1.30 114.94 126.79 1ip7 s ASN 39 Ca 0.00 -0.35 0.33 0.00 0.42 0.00 0.00 52.86 53.25 1ip7 s ASN 39 Cb 0.00 -2.23 1.54 0.00 -1.45 0.00 0.00 41.25 39.12 1ip7 s ASN 39 CO 0.00 -0.47 2.07 0.71 -3.72 0.00 0.00 177.10 175.69 1ip7 h THR 40 N 5.64 0.24 -0.01 -5.21 1.35 -1.09 -2.78 112.91 111.03 1ip7 h THR 40 Ca -0.28 -0.50 0.00 0.00 -0.55 0.00 0.00 66.41 65.08 1ip7 h THR 40 Cb 1.13 1.40 0.00 0.00 -1.73 0.00 0.00 68.15 68.94 1ip7 h THR 40 CO 0.75 0.06 -0.12 0.54 -0.25 0.00 0.00 175.52 176.51 1ip7 n ARG 41 N -3.29 1.46 -1.73 4.72 5.12 -1.26 -4.06 116.66 117.63 1ip7 n ARG 41 Ca -0.01 -0.95 -0.42 0.00 -1.93 0.00 0.00 57.85 54.54 1ip7 n ARG 41 Cb 0.26 -1.48 -0.02 0.00 -1.16 0.00 0.00 32.46 30.05 1ip7 n ARG 41 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ip7 n ALA 42 N 0.06 2.58 -2.78 7.54 0.00 -1.05 -4.77 120.51 122.09 1ip7 n ALA 42 Ca 0.15 0.39 -0.15 0.00 0.00 0.00 0.00 53.44 53.83 1ip7 n ALA 42 Cb 0.39 -2.48 -0.14 0.00 0.00 0.00 0.00 19.45 17.22 1ip7 n ALA 42 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1ip7 s THR 43 N 0.57 0.37 -0.26 0.00 -4.23 -1.26 -0.61 115.64 110.21 1ip7 s THR 43 Ca 0.70 -0.23 -0.01 0.00 -1.18 0.00 0.00 61.69 60.97 1ip7 s THR 43 Cb -0.51 -0.32 0.08 0.00 1.34 0.00 0.00 72.50 73.09 1ip7 s THR 43 CO 0.41 0.08 0.04 0.21 -0.54 0.00 0.00 174.62 174.82 1ip7 s ASN 44 N -0.17 3.76 0.08 3.99 2.47 -0.16 -4.94 114.94 119.98 1ip7 s ASN 44 Ca 0.01 -1.35 -0.24 0.00 0.42 0.00 0.00 52.86 51.70 1ip7 s ASN 44 Cb -0.02 -0.94 -0.06 0.00 -1.45 0.00 0.00 41.25 38.77 1ip7 s ASN 44 CO -0.00 -0.34 0.72 -0.47 -3.72 0.00 0.00 177.10 173.30 1ip7 s TYR 45 N 1.56 3.79 -0.33 0.43 6.14 -1.26 -0.42 117.35 127.27 1ip7 s TYR 45 Ca 0.03 1.47 -0.01 0.00 0.64 0.00 0.00 57.07 59.20 1ip7 s TYR 45 Cb -0.18 -2.74 0.07 0.00 0.42 0.00 0.00 41.96 39.54 1ip7 s TYR 45 CO -0.14 0.40 0.05 -0.80 0.64 0.00 0.00 175.55 175.69 1ip7 s ASN 46 N -0.55 4.94 0.51 4.32 0.01 0.67 -4.99 114.94 119.85 1ip7 s ASN 46 Ca 0.36 -1.57 0.15 0.00 -0.71 0.00 0.00 52.86 51.09 1ip7 s ASN 46 Cb -0.21 -1.72 1.24 0.00 0.41 0.00 0.00 41.25 40.97 1ip7 s ASN 46 CO 0.23 -0.34 2.14 0.00 -1.51 0.00 0.00 177.10 177.62 1ip7 h ALA 47 N 7.95 1.98 -0.08 0.60 0.00 -1.95 0.27 119.26 128.04 1ip7 h ALA 47 Ca -0.17 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.77 1ip7 h ALA 47 Cb 1.05 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1ip7 h ALA 47 CO 0.57 0.02 -0.11 0.78 0.00 0.00 0.00 179.25 180.51 1ip7 h GLY 48 N 0.04 -0.06 -0.61 0.00 0.00 -1.95 -3.23 103.07 97.25 1ip7 h GLY 48 Ca 0.01 0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.47 1ip7 h GLY 48 CO -0.00 -0.12 0.00 2.09 0.00 0.00 0.00 176.54 178.51 1ip7 n ASP 49 N -5.25 2.41 -2.21 0.19 5.75 -1.16 -4.99 116.55 111.30 1ip7 n ASP 49 Ca -0.04 -1.97 -0.16 0.00 -0.01 0.00 0.00 54.79 52.61 1ip7 n ASP 49 Cb 0.17 -0.11 -0.02 0.00 -1.03 0.00 0.00 41.12 40.13 1ip7 n ASP 49 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1ip7 n ARG 50 N 0.01 -1.87 -3.59 0.11 1.74 0.92 -4.37 116.66 109.61 1ip7 n ARG 50 Ca 0.06 0.79 -0.22 0.00 -0.77 0.00 0.00 57.85 57.71 1ip7 n ARG 50 Cb 0.33 -5.35 -0.01 0.00 -1.02 0.00 0.00 32.46 26.41 1ip7 n ARG 50 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1ip7 s SER 51 N -2.10 6.25 -0.01 0.55 1.04 -1.14 -4.39 113.70 113.90 1ip7 s SER 51 Ca 0.00 0.24 0.02 0.00 0.48 0.00 0.00 55.95 56.69 1ip7 s SER 51 Cb 0.00 -1.86 -0.01 0.00 0.10 0.00 0.00 66.02 64.25 1ip7 s SER 51 CO 0.00 -0.25 -0.08 -0.89 0.98 0.00 0.00 173.24 173.00 1ip7 s THR 52 N -2.19 0.65 -0.10 2.02 2.01 -1.26 -0.24 115.64 116.53 1ip7 s THR 52 Ca 0.39 -0.35 -0.15 0.00 0.31 0.00 0.00 61.69 61.89 1ip7 s THR 52 Cb -0.09 -0.54 -0.05 0.00 0.01 0.00 0.00 72.50 71.82 1ip7 s THR 52 CO 0.33 0.18 0.39 -1.81 -0.69 0.00 0.00 174.62 173.02 1ip7 s ASP 53 N -0.17 6.63 -0.02 3.53 1.01 0.44 -1.19 116.67 126.90 1ip7 s ASP 53 Ca 0.03 0.75 0.06 0.00 0.71 0.00 0.00 52.55 54.09 1ip7 s ASP 53 Cb -0.03 -2.24 -0.03 0.00 1.01 0.00 0.00 42.92 41.63 1ip7 s ASP 53 CO -0.00 0.14 -0.18 -0.31 0.21 0.00 0.00 175.17 175.02 1ip7 s TYR 54 N 0.03 2.56 0.00 4.23 2.02 -0.08 -0.98 117.35 125.13 1ip7 s TYR 54 Ca 0.22 -0.26 0.00 0.00 -0.37 0.00 0.00 57.07 56.66 1ip7 s TYR 54 Cb -0.15 -1.55 0.00 0.00 -0.40 0.00 0.00 41.96 39.87 1ip7 s TYR 54 CO 0.09 0.15 0.00 0.41 -1.57 0.00 0.00 175.55 174.63 1ip7 n GLY 55 N 2.12 -1.10 0.34 0.71 0.00 0.22 -1.37 105.19 106.11 1ip7 n GLY 55 Ca -0.17 -1.16 0.13 0.00 0.00 0.00 0.00 46.02 44.82 1ip7 n GLY 55 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1ip7 h ILE 56 N 0.00 0.88 -0.02 -0.61 2.10 -1.71 -1.15 117.51 117.00 1ip7 h ILE 56 Ca 0.00 -0.06 0.00 0.00 1.08 0.00 0.00 64.86 65.88 1ip7 h ILE 56 Cb 0.00 0.69 0.00 0.00 -1.09 0.00 0.00 36.82 36.42 1ip7 h ILE 56 CO 0.00 0.03 -0.07 0.49 -1.08 0.00 0.00 178.15 177.52 1ip7 n PHE 57 N -4.46 0.00 -3.70 2.19 0.99 -1.26 -3.98 117.46 107.25 1ip7 n PHE 57 Ca 0.06 0.00 -0.27 0.00 -0.00 0.00 0.00 57.45 57.24 1ip7 n PHE 57 Cb 0.36 0.00 0.03 0.00 -1.00 0.00 0.00 39.48 38.87 1ip7 n PHE 57 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 1ip7 n GLN 58 N 0.91 -2.37 -2.61 -1.08 1.13 -0.43 -4.93 117.38 107.99 1ip7 n GLN 58 Ca 0.11 0.51 -0.42 0.00 -1.94 0.00 0.00 57.00 55.26 1ip7 n GLN 58 Cb 0.49 -4.54 -0.03 0.00 0.11 0.00 0.00 30.24 26.27 1ip7 n GLN 58 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1ip7 s ILE 59 N -3.58 4.61 0.04 5.09 1.01 -0.47 -4.42 121.20 123.48 1ip7 s ILE 59 Ca 0.30 1.90 -0.30 0.00 0.00 0.00 0.00 60.65 62.54 1ip7 s ILE 59 Cb -0.10 -4.22 -0.05 0.00 0.01 0.00 0.00 42.46 38.11 1ip7 s ILE 59 CO 0.85 0.01 1.11 0.21 0.00 0.00 0.00 174.94 177.12 1ip7 s ASN 60 N 1.20 7.20 0.50 3.58 3.84 -1.26 -0.90 114.94 129.11 1ip7 s ASN 60 Ca 0.51 1.88 0.33 0.00 0.21 0.00 0.00 52.86 55.79 1ip7 s ASN 60 Cb -0.21 -2.58 1.51 0.00 -0.55 0.00 0.00 41.25 39.43 1ip7 s ASN 60 CO 0.20 -0.38 1.99 0.77 -2.79 0.00 0.00 177.10 176.89 1ip7 h SER 61 N 6.74 0.00 1.08 -4.21 4.64 -1.40 -1.59 113.55 118.82 1ip7 h SER 61 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1ip7 h SER 61 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1ip7 h SER 61 CO 0.78 0.00 0.00 -0.09 -0.87 0.00 0.00 176.83 176.65 1ip7 h ARG 62 N 0.00 0.00 0.00 4.77 2.43 -1.83 -3.39 114.38 116.35 1ip7 h ARG 62 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1ip7 h ARG 62 Cb 0.33 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 1ip7 h ARG 62 CO 0.00 0.00 -0.46 0.66 -1.51 0.00 0.00 179.97 178.66 1ip7 n TYR 63 N -3.01 0.00 -0.07 2.20 4.02 -1.10 -0.99 117.16 118.21 1ip7 n TYR 63 Ca 0.01 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.86 1ip7 n TYR 63 Cb 0.32 0.00 -0.15 0.00 -0.02 0.00 0.00 39.34 39.49 1ip7 n TYR 63 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76 1ip7 n TRP 64 N -1.57 0.00 -4.06 -0.72 7.02 -0.62 -0.66 117.44 116.83 1ip7 n TRP 64 Ca 0.00 0.00 -0.09 0.00 -1.02 0.00 0.00 57.50 56.39 1ip7 n TRP 64 Cb 0.23 -0.77 -0.09 0.00 -2.42 0.00 0.00 31.31 28.26 1ip7 n TRP 64 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1ip7 s ASN 66 N -2.98 5.40 0.00 0.00 2.47 -0.29 -4.58 114.94 114.97 1ip7 s ASN 66 Ca 0.16 -0.03 0.00 0.00 0.42 0.00 0.00 52.86 53.41 1ip7 s ASN 66 Cb 0.07 -1.94 0.01 0.00 -1.45 0.00 0.00 41.25 37.93 1ip7 s ASN 66 CO -0.03 0.10 0.79 -0.90 -3.72 0.00 0.00 177.10 173.35 1ip7 n ASP 67 N 4.00 1.60 -0.71 -4.21 5.75 -1.26 -0.93 116.55 120.79 1ip7 n ASP 67 Ca -0.16 -1.58 -0.09 0.00 -0.01 0.00 0.00 54.79 52.94 1ip7 n ASP 67 Cb 0.52 -0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.57 1ip7 n ASP 67 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ip7 n GLY 68 N -0.27 0.92 0.49 6.12 0.00 -1.26 -4.78 105.19 106.40 1ip7 n GLY 68 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1ip7 n GLY 68 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ip7 n LYS 69 N -0.84 0.00 -3.88 1.61 2.85 -1.26 -5.06 118.16 111.58 1ip7 n LYS 69 Ca -0.09 -0.74 -0.35 0.00 -1.05 0.00 0.00 58.31 56.07 1ip7 n LYS 69 Cb 0.54 -0.38 -0.14 0.00 -0.65 0.00 0.00 35.03 34.41 1ip7 n LYS 69 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1ip7 s THR 70 N 0.00 3.42 0.29 0.58 2.01 -1.26 -4.86 115.64 115.81 1ip7 s THR 70 Ca 0.00 -0.67 -0.30 0.00 0.31 0.00 0.00 61.69 61.03 1ip7 s THR 70 Cb 0.00 -2.65 -0.13 0.00 0.01 0.00 0.00 72.50 69.73 1ip7 s THR 70 CO 0.00 0.28 1.42 -2.65 -0.69 0.00 0.00 174.62 172.98 1ip7 n PRO 71 N 4.79 2.24 -3.72 4.92 -0.02 -1.26 -2.97 135.00 138.98 1ip7 n PRO 71 Ca -0.17 0.79 -0.28 0.00 -2.02 0.00 0.00 63.50 61.82 1ip7 n PRO 71 Cb 0.49 -2.46 -0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1ip7 n PRO 71 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ip7 n GLY 72 N 1.68 -0.48 3.92 -1.23 0.00 -1.26 -4.95 105.19 102.87 1ip7 n GLY 72 Ca 0.08 0.13 -0.26 0.00 0.00 0.00 0.00 46.02 45.97 1ip7 n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ip7 s ALA 73 N -3.12 3.58 0.48 4.61 0.00 -1.16 -4.99 121.76 121.16 1ip7 s ALA 73 Ca 0.56 -0.67 0.02 0.00 0.00 0.00 0.00 51.96 51.87 1ip7 s ALA 73 Cb -0.29 -2.32 -0.03 0.00 0.00 0.00 0.00 23.12 20.48 1ip7 s ALA 73 CO 0.69 -0.05 0.02 0.14 0.00 0.00 0.00 175.76 176.56 1ip7 s VAL 74 N -2.38 1.25 -0.39 0.00 -7.23 -0.17 -4.99 120.40 106.49 1ip7 s VAL 74 Ca 0.44 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.68 1ip7 s VAL 74 Cb -0.10 -2.34 0.25 0.00 0.56 0.00 0.00 36.38 34.75 1ip7 s VAL 74 CO 0.37 0.00 0.52 -3.20 -0.31 0.00 0.00 175.10 172.48 1ip7 n ASN 75 N -1.21 0.07 -0.18 4.85 5.15 -1.23 -3.81 115.26 118.90 1ip7 n ASN 75 Ca -0.15 -2.69 0.08 0.00 -0.60 0.00 0.00 54.58 51.22 1ip7 n ASN 75 Cb 0.67 -0.58 0.38 0.00 -0.53 0.00 0.00 39.78 39.72 1ip7 n ASN 75 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ip7 h ALA 76 N 4.08 1.77 -0.00 5.20 0.00 -0.91 -0.50 119.26 128.89 1ip7 h ALA 76 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ip7 h ALA 76 Cb 0.88 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1ip7 h ALA 76 CO 0.45 0.09 -0.07 0.00 0.00 0.00 0.00 179.25 179.72 1ip7 n HIS 78 N -0.86 -2.00 -3.71 0.00 -0.00 -0.20 -5.00 115.22 103.45 1ip7 n HIS 78 Ca 0.17 0.65 -0.12 0.00 -0.00 0.00 0.00 57.72 58.42 1ip7 n HIS 78 Cb 0.25 -3.85 -0.07 0.00 -0.00 0.00 0.00 29.99 26.33 1ip7 n HIS 78 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.34 175.17 1ip7 s LEU 79 N -6.34 0.68 0.30 2.41 0.20 -1.26 -5.07 118.68 109.59 1ip7 s LEU 79 Ca 0.32 -0.13 -0.26 0.00 0.69 0.00 0.00 54.13 54.74 1ip7 s LEU 79 Cb -0.09 1.52 -0.10 0.00 -0.43 0.00 0.00 46.19 47.10 1ip7 s LEU 79 CO 0.83 -0.65 0.92 -0.94 -0.29 0.00 0.00 176.35 176.22 1ip7 s SER 80 N -2.10 7.37 0.60 3.68 1.04 -1.26 -1.13 113.70 121.90 1ip7 s SER 80 Ca -0.04 1.82 0.36 0.00 0.48 0.00 0.00 55.95 58.56 1ip7 s SER 80 Cb -0.01 -2.57 1.92 0.00 0.10 0.00 0.00 66.02 65.47 1ip7 s SER 80 CO -0.04 -0.02 2.23 0.00 0.98 0.00 0.00 173.24 176.40 1ip7 h SER 82 N 0.00 0.00 0.46 0.00 4.64 -1.92 -0.76 113.55 115.97 1ip7 h SER 82 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ip7 h SER 82 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1ip7 h SER 82 CO 0.00 0.25 0.00 0.00 -0.87 0.00 0.00 176.83 176.21 1ip7 n ALA 83 N -2.49 1.44 0.26 5.18 0.00 -0.72 -1.19 120.51 122.98 1ip7 n ALA 83 Ca -0.02 0.12 0.09 0.00 0.00 0.00 0.00 53.44 53.62 1ip7 n ALA 83 Cb 0.30 -1.35 0.24 0.00 0.00 0.00 0.00 19.45 18.64 1ip7 n ALA 83 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ip7 n LEU 84 N -2.22 2.94 -0.09 0.00 4.77 -0.29 -3.88 117.00 118.23 1ip7 n LEU 84 Ca 0.01 -1.47 0.08 0.00 -0.03 0.00 0.00 56.01 54.60 1ip7 n LEU 84 Cb 0.16 -0.37 0.11 0.00 -2.33 0.00 0.00 43.42 40.98 1ip7 n LEU 84 CO 0.16 0.72 0.53 0.18 -1.33 0.00 0.00 177.39 177.66 1ip7 n LEU 85 N 1.08 2.10 -4.92 2.23 4.77 -0.33 -2.98 117.00 118.96 1ip7 n LEU 85 Ca 0.18 -2.73 -0.27 0.00 -0.03 0.00 0.00 56.01 53.16 1ip7 n LEU 85 Cb 0.47 -0.33 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 1ip7 n LEU 85 CO 0.13 0.64 0.14 -1.10 -1.33 0.00 0.00 177.39 175.86 1ip7 s GLN 86 N -2.35 3.56 0.30 3.23 -1.52 -1.25 -4.46 119.66 117.17 1ip7 s GLN 86 Ca 0.24 -0.19 0.01 0.00 -1.95 0.00 0.00 55.36 53.48 1ip7 s GLN 86 Cb 0.21 -2.71 0.46 0.00 -0.22 0.00 0.00 33.01 30.76 1ip7 s GLN 86 CO 0.02 0.25 1.81 -0.44 -0.25 0.00 0.00 175.29 176.68 1ip7 h ASP 87 N 1.53 0.60 -3.53 5.90 3.32 -1.93 -3.38 116.42 118.93 1ip7 h ASP 87 Ca -0.48 -0.14 -0.58 0.00 0.02 0.00 0.00 57.03 55.85 1ip7 h ASP 87 Cb 1.20 -0.16 -0.08 0.00 0.22 0.00 0.00 39.33 40.50 1ip7 h ASP 87 CO 0.65 0.70 0.72 0.21 -1.72 0.00 0.00 179.24 179.80 1ip7 s ASN 88 N -6.70 6.69 -0.00 6.45 3.84 -1.26 -4.92 114.94 119.03 1ip7 s ASN 88 Ca -0.08 0.57 0.11 0.00 0.21 0.00 0.00 52.86 53.67 1ip7 s ASN 88 Cb 0.15 -2.50 0.32 0.00 -0.55 0.00 0.00 41.25 38.67 1ip7 s ASN 88 CO 0.79 -0.98 1.26 2.30 -2.79 0.00 0.00 177.10 177.67 1ip7 n ILE 89 N 6.22 0.51 -0.21 -5.21 -5.35 -1.26 -4.43 119.36 109.63 1ip7 n ILE 89 Ca 0.09 -0.48 0.02 0.00 -0.27 0.00 0.00 62.75 62.10 1ip7 n ILE 89 Cb 0.48 0.22 0.12 0.00 -1.74 0.00 0.00 39.64 38.72 1ip7 n ILE 89 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ip7 h ALA 90 N 3.63 0.72 -0.58 -1.28 0.00 -1.94 0.65 119.26 120.47 1ip7 h ALA 90 Ca 0.00 0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 1ip7 h ALA 90 Cb 0.50 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1ip7 h ALA 90 CO 0.01 -0.34 0.04 -0.44 0.00 0.00 0.00 179.25 178.51 1ip7 h ASP 91 N 0.22 0.97 -0.64 0.00 5.19 -1.85 -1.42 116.42 118.89 1ip7 h ASP 91 Ca 0.34 -0.29 -0.03 0.00 -0.62 0.00 0.00 57.03 56.42 1ip7 h ASP 91 Cb 0.53 -0.26 -0.03 0.00 0.18 0.00 0.00 39.33 39.75 1ip7 h ASP 91 CO -0.46 1.02 0.26 0.00 -3.12 0.00 0.00 179.24 176.95 1ip7 h ALA 92 N 0.98 0.83 -0.21 3.45 0.00 -1.52 -1.02 119.26 121.77 1ip7 h ALA 92 Ca 0.17 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1ip7 h ALA 92 Cb 0.50 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1ip7 h ALA 92 CO 0.02 0.44 0.07 0.28 0.00 0.00 0.00 179.25 180.06 1ip7 h VAL 93 N 0.89 1.18 -0.69 0.00 2.07 -0.77 0.21 116.25 119.15 1ip7 h VAL 93 Ca 0.21 -0.56 0.05 0.00 0.82 0.00 0.00 66.70 67.22 1ip7 h VAL 93 Cb 0.19 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 31.08 1ip7 h VAL 93 CO -0.02 0.18 0.41 0.00 0.02 0.00 0.00 177.57 178.16 1ip7 h ALA 94 N 0.90 0.92 -0.21 1.67 0.00 -1.06 0.73 119.26 122.21 1ip7 h ALA 94 Ca 0.07 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.83 1ip7 h ALA 94 Cb 0.21 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1ip7 h ALA 94 CO -0.00 0.13 -0.49 0.00 0.00 0.00 0.00 179.25 178.88 1ip7 h ALA 96 N 1.02 1.13 -0.93 0.00 0.00 -0.11 -1.18 119.26 119.21 1ip7 h ALA 96 Ca 0.02 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1ip7 h ALA 96 Cb 1.02 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 1ip7 h ALA 96 CO 0.09 0.58 0.58 0.87 0.00 0.00 0.00 179.25 181.37 1ip7 h LYS 97 N 0.84 1.25 -0.21 0.00 1.57 -0.61 -2.26 116.57 117.15 1ip7 h LYS 97 Ca 0.18 -0.10 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 1ip7 h LYS 97 Cb 0.35 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 1ip7 h LYS 97 CO 0.00 0.86 0.05 -0.09 -0.57 0.00 0.00 179.45 179.71 1ip7 h ARG 98 N 1.27 0.34 -0.28 3.15 9.65 -0.83 -2.92 114.38 124.75 1ip7 h ARG 98 Ca 0.33 -0.08 0.06 0.00 -1.10 0.00 0.00 59.98 59.20 1ip7 h ARG 98 Cb -0.08 -0.04 -0.06 0.00 -1.39 0.00 0.00 29.97 28.39 1ip7 h ARG 98 CO -0.07 0.46 -0.11 0.28 2.80 0.00 0.00 179.97 183.33 1ip7 h VAL 99 N 0.16 0.62 0.00 0.20 2.07 -0.96 -1.29 116.25 117.05 1ip7 h VAL 99 Ca 0.07 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.59 1ip7 h VAL 99 Cb 0.27 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 30.66 1ip7 h VAL 99 CO 0.00 0.00 0.00 1.33 0.02 0.00 0.00 177.57 178.92 1ip7 n VAL 100 N -5.29 0.56 1.23 2.57 0.24 -0.88 -1.83 118.33 114.95 1ip7 n VAL 100 Ca -0.00 0.14 0.14 0.00 -2.04 0.00 0.00 64.34 62.58 1ip7 n VAL 100 Cb 0.21 -0.88 0.54 0.00 -1.47 0.00 0.00 33.84 32.24 1ip7 n VAL 100 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1ip7 n ARG 101 N -1.30 0.40 -1.88 7.34 1.74 -0.49 -4.18 116.66 118.30 1ip7 n ARG 101 Ca 0.07 -0.14 -0.31 0.00 -0.77 0.00 0.00 57.85 56.70 1ip7 n ARG 101 Cb 0.13 -1.50 0.01 0.00 -1.02 0.00 0.00 32.46 30.09 1ip7 n ARG 101 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ip7 s ASP 102 N -2.69 6.07 0.30 0.55 -0.00 -0.76 -4.94 116.67 115.20 1ip7 s ASP 102 Ca 0.22 1.50 0.00 0.00 -0.00 0.00 0.00 52.55 54.28 1ip7 s ASP 102 Cb 0.19 -2.48 0.70 0.00 -0.00 0.00 0.00 42.92 41.33 1ip7 s ASP 102 CO 0.53 -0.97 1.58 -0.65 -0.00 0.00 0.00 175.17 175.66 1ip7 h PRO 103 N -0.20 0.03 0.00 8.23 0.11 -1.88 -0.19 132.00 138.09 1ip7 h PRO 103 Ca -0.44 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.65 1ip7 h PRO 103 Cb 1.20 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1ip7 h PRO 103 CO 0.61 0.02 -0.08 0.37 -0.21 0.00 0.00 178.00 178.70 1ip7 h GLN 104 N 0.03 0.00 0.00 1.05 4.15 -1.92 -3.49 115.11 114.93 1ip7 h GLN 104 Ca 0.57 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.99 1ip7 h GLN 104 Cb 1.15 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.84 1ip7 h GLN 104 CO -0.89 0.08 0.00 0.41 -1.93 0.00 0.00 178.83 176.51 1ip7 n GLY 105 N -0.09 1.81 0.18 2.39 0.00 -0.09 -2.49 105.19 106.89 1ip7 n GLY 105 Ca -0.00 -0.55 0.13 0.00 0.00 0.00 0.00 46.02 45.60 1ip7 n GLY 105 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1ip7 h ILE 106 N 0.00 0.00 0.00 -0.61 2.10 -1.90 -2.19 117.51 114.91 1ip7 h ILE 106 Ca 0.00 -0.08 0.00 0.00 1.08 0.00 0.00 64.86 65.86 1ip7 h ILE 106 Cb 0.00 0.70 0.00 0.00 -1.09 0.00 0.00 36.82 36.43 1ip7 h ILE 106 CO 0.00 0.00 0.00 0.54 -1.08 0.00 0.00 178.15 177.61 1ip7 n ARG 107 N -2.37 0.25 0.03 2.19 1.74 -1.04 -2.35 116.66 115.11 1ip7 n ARG 107 Ca -0.01 0.10 0.04 0.00 -0.77 0.00 0.00 57.85 57.21 1ip7 n ARG 107 Cb 0.10 -1.50 0.43 0.00 -1.02 0.00 0.00 32.46 30.47 1ip7 n ARG 107 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ip7 h ALA 108 N 2.60 1.69 -2.22 7.54 0.00 -1.57 -3.39 119.26 123.91 1ip7 h ALA 108 Ca 0.00 -0.05 -0.63 0.00 0.00 0.00 0.00 54.91 54.23 1ip7 h ALA 108 Cb 0.06 -0.15 -0.13 0.00 0.00 0.00 0.00 17.79 17.57 1ip7 h ALA 108 CO 0.00 0.27 0.25 -1.58 0.00 0.00 0.00 179.25 178.19 1ip7 s TRP 109 N -5.37 3.10 0.26 0.00 0.51 -0.99 -4.94 118.94 111.53 1ip7 s TRP 109 Ca -0.08 0.34 -0.02 0.00 -2.12 0.00 0.00 56.10 54.22 1ip7 s TRP 109 Cb 0.17 -3.33 0.43 0.00 -0.81 0.00 0.00 33.47 29.93 1ip7 s TRP 109 CO 0.73 -0.74 1.85 0.28 -0.51 0.00 0.00 176.95 178.56 1ip7 h VAL 110 N 5.77 1.01 -0.78 4.03 2.07 -1.89 -1.81 116.25 124.65 1ip7 h VAL 110 Ca -0.25 -0.36 -0.03 0.00 0.82 0.00 0.00 66.70 66.88 1ip7 h VAL 110 Cb 1.10 -0.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 1ip7 h VAL 110 CO 0.89 0.19 0.38 0.00 0.02 0.00 0.00 177.57 179.04 1ip7 h ALA 111 N 1.47 1.21 -0.38 1.67 0.00 -1.95 -0.74 119.26 120.53 1ip7 h ALA 111 Ca 0.43 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 1ip7 h ALA 111 Cb 0.28 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1ip7 h ALA 111 CO -0.21 0.61 0.08 2.35 0.00 0.00 0.00 179.25 182.08 1ip7 h TRP 112 N 1.10 0.65 -0.75 0.00 7.01 -1.69 0.10 115.95 122.37 1ip7 h TRP 112 Ca 0.27 -0.08 0.02 0.00 2.11 0.00 0.00 58.89 61.20 1ip7 h TRP 112 Cb 0.10 -0.18 -0.04 0.00 -2.10 0.00 0.00 29.16 26.94 1ip7 h TRP 112 CO 0.01 0.64 0.49 0.00 -2.79 0.00 0.00 178.44 176.79 1ip7 h ARG 113 N 0.47 0.95 0.02 2.65 3.08 -0.97 0.21 114.38 120.78 1ip7 h ARG 113 Ca 0.12 -0.06 -0.23 0.00 0.07 0.00 0.00 59.98 59.88 1ip7 h ARG 113 Cb 0.33 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.17 1ip7 h ARG 113 CO 0.00 0.63 -0.98 -0.91 -1.07 0.00 0.00 179.97 177.63 1ip7 h ASN 114 N 0.97 0.53 0.00 7.04 2.35 -0.91 -3.32 115.58 122.25 1ip7 h ASN 114 Ca 0.29 -0.44 0.00 0.00 -0.55 0.00 0.00 56.30 55.59 1ip7 h ASN 114 Cb -0.06 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.15 1ip7 h ASN 114 CO -0.08 1.25 -0.73 0.54 -1.65 0.00 0.00 177.43 176.76 1ip7 n ARG 115 N -3.72 2.77 0.00 0.81 5.12 0.34 -4.86 116.66 117.11 1ip7 n ARG 115 Ca -0.07 -0.02 0.00 0.00 -1.93 0.00 0.00 57.85 55.83 1ip7 n ARG 115 Cb 0.86 -1.06 0.00 0.00 -1.16 0.00 0.00 32.46 31.10 1ip7 n ARG 115 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ip7 n GLN 117 N -2.57 1.80 -0.89 0.00 7.27 0.11 -1.85 117.38 121.24 1ip7 n GLN 117 Ca 0.00 0.65 0.00 0.00 0.07 0.00 0.00 57.00 57.72 1ip7 n GLN 117 Cb 0.43 -2.39 0.00 0.00 2.41 0.00 0.00 30.24 30.69 1ip7 n GLN 117 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1ip7 n ASN 118 N 3.78 -2.72 -4.71 1.69 5.03 -1.26 -4.93 115.26 112.13 1ip7 n ASN 118 Ca 0.19 0.00 -0.23 0.00 0.87 0.00 0.00 54.58 55.41 1ip7 n ASN 118 Cb 0.25 -1.81 -0.06 0.00 -1.02 0.00 0.00 39.78 37.14 1ip7 n ASN 118 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1ip7 s ARG 119 N -0.86 2.44 0.08 3.52 0.52 -0.77 -5.08 118.95 118.80 1ip7 s ARG 119 Ca 0.00 -1.40 -0.31 0.00 -0.52 0.00 0.00 55.73 53.50 1ip7 s ARG 119 Cb 0.00 -2.24 -0.07 0.00 0.52 0.00 0.00 34.95 33.16 1ip7 s ARG 119 CO 0.00 0.27 1.37 0.34 0.02 0.00 0.00 175.30 177.30 1ip7 s ASP 120 N -3.77 6.87 -0.02 0.23 -1.08 -1.26 -4.86 116.67 112.77 1ip7 s ASP 120 Ca 0.34 2.24 0.03 0.00 -0.52 0.00 0.00 52.55 54.63 1ip7 s ASP 120 Cb -0.05 -2.58 0.04 0.00 -1.46 0.00 0.00 42.92 38.87 1ip7 s ASP 120 CO 0.22 -0.64 0.85 1.33 0.52 0.00 0.00 175.17 177.45 1ip7 n VAL 121 N 4.11 0.65 0.28 1.11 0.24 -1.26 -4.82 118.33 118.63 1ip7 n VAL 121 Ca 0.11 -0.70 0.15 0.00 -2.04 0.00 0.00 64.34 61.87 1ip7 n VAL 121 Cb 0.43 0.57 0.90 0.00 -1.47 0.00 0.00 33.84 34.26 1ip7 n VAL 121 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1ip7 h ARG 122 N 0.00 0.00 -0.21 7.34 3.08 -1.93 -2.15 114.38 120.50 1ip7 h ARG 122 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1ip7 h ARG 122 Cb 0.87 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.91 1ip7 h ARG 122 CO 0.00 0.00 0.10 -0.56 -1.07 0.00 0.00 179.97 178.44 1ip7 h GLN 123 N 0.00 0.28 -0.18 0.04 -0.00 -1.98 -2.85 115.11 110.42 1ip7 h GLN 123 Ca 0.02 -0.02 0.05 0.00 -0.00 0.00 0.00 58.65 58.69 1ip7 h GLN 123 Cb 0.11 -0.06 -0.01 0.00 -0.00 0.00 0.00 27.48 27.53 1ip7 h GLN 123 CO -0.00 0.23 0.13 1.88 -0.00 0.00 0.00 178.83 181.07 1ip7 h TYR 124 N 0.29 0.03 -0.21 0.06 0.05 -1.73 -2.25 116.97 113.20 1ip7 h TYR 124 Ca 0.08 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.86 1ip7 h TYR 124 Cb 0.04 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 37.77 1ip7 h TYR 124 CO 0.00 0.01 0.00 1.33 -1.05 0.00 0.00 178.16 178.46 1ip7 n VAL 125 N -4.49 0.83 -1.68 -2.88 0.24 -1.10 -4.80 118.33 104.44 1ip7 n VAL 125 Ca 0.01 -0.91 -0.44 0.00 -2.04 0.00 0.00 64.34 60.96 1ip7 n VAL 125 Cb 0.25 0.62 -0.04 0.00 -1.47 0.00 0.00 33.84 33.20 1ip7 n VAL 125 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ip7 n GLN 126 N 0.28 2.53 -1.82 7.34 6.02 -0.85 -2.30 117.38 128.58 1ip7 n GLN 126 Ca 0.08 0.92 -0.15 0.00 -0.01 0.00 0.00 57.00 57.84 1ip7 n GLN 126 Cb 0.35 -2.77 -0.04 0.00 1.02 0.00 0.00 30.24 28.80 1ip7 n GLN 126 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ip7 n GLY 127 N 4.05 0.73 0.01 1.08 0.00 -1.26 -4.91 105.19 104.89 1ip7 n GLY 127 Ca 0.18 -0.28 0.11 0.00 0.00 0.00 0.00 46.02 46.03 1ip7 n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ip7 n ALA 129 N -1.87 -2.29 -0.91 0.00 0.00 -1.26 -4.91 120.51 109.27 1ip7 n ALA 129 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1ip7 n ALA 129 Cb 0.45 -4.32 0.00 0.00 0.00 0.00 0.00 19.45 15.58 1ip7 n ALA 129 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83