#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b7n s VAL 2 N 0.00 3.64 0.53 3.15 1.01 -1.26 -0.80 120.40 126.68 1b7n s VAL 2 Ca 0.00 -1.59 -0.21 0.00 0.00 0.00 0.00 61.98 60.18 1b7n s VAL 2 Cb 0.00 -3.28 -0.06 0.00 0.00 0.00 0.00 36.38 33.05 1b7n s VAL 2 CO 0.00 -0.46 1.18 -0.36 0.00 0.00 0.00 175.10 175.46 1b7n s PHE 3 N 1.30 2.62 0.25 5.22 0.08 -0.09 -4.98 117.98 122.39 1b7n s PHE 3 Ca 0.03 1.52 -0.08 0.00 0.12 0.00 0.00 56.93 58.52 1b7n s PHE 3 Cb -0.22 -3.42 -0.06 0.00 -0.57 0.00 0.00 43.02 38.74 1b7n s PHE 3 CO -0.01 -1.86 0.55 -1.21 -0.10 0.00 0.00 175.22 172.60 1b7n s GLU 4 N -3.07 3.73 0.00 0.44 2.02 -1.26 -4.82 118.70 115.75 1b7n s GLU 4 Ca 0.71 0.17 0.00 0.00 0.02 0.00 0.00 54.97 55.87 1b7n s GLU 4 Cb -0.29 -2.65 0.00 0.00 0.10 0.00 0.00 34.13 31.29 1b7n s GLU 4 CO 0.33 0.28 0.88 -2.13 0.02 0.00 0.00 175.26 174.64 1b7n n ARG 5 N -0.43 0.00 0.01 1.61 0.63 -1.26 -1.42 116.66 115.80 1b7n n ARG 5 Ca -0.00 0.88 0.03 0.00 -0.92 0.00 0.00 57.85 57.83 1b7n n ARG 5 Cb 0.53 -1.38 0.38 0.00 0.45 0.00 0.00 32.46 32.45 1b7n n ARG 5 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1b7n h GLU 7 N 0.50 0.72 -0.39 0.00 4.81 -1.89 -1.84 114.58 116.49 1b7n h GLU 7 Ca 0.13 -0.04 -0.14 0.00 -0.13 0.00 0.00 59.36 59.17 1b7n h GLU 7 Cb 0.10 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 1b7n h GLU 7 CO -0.01 0.48 -0.31 1.25 -0.73 0.00 0.00 179.01 179.69 1b7n h LEU 8 N 0.74 0.95 -0.76 1.64 5.85 -0.51 -2.10 115.31 121.12 1b7n h LEU 8 Ca 0.23 -0.44 0.05 0.00 0.84 0.00 0.00 57.88 58.55 1b7n h LEU 8 Cb -0.02 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.69 1b7n h LEU 8 CO -0.08 1.19 0.47 0.00 -0.34 0.00 0.00 178.44 179.68 1b7n h ALA 9 N 0.79 1.02 -0.05 1.25 0.00 -0.77 0.07 119.26 121.56 1b7n h ALA 9 Ca 0.07 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.81 1b7n h ALA 9 Cb 0.89 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1b7n h ALA 9 CO 0.08 0.22 -0.70 0.00 0.00 0.00 0.00 179.25 178.86 1b7n h ARG 10 N 0.89 0.26 -0.44 0.00 3.08 -1.34 -1.60 114.38 115.23 1b7n h ARG 10 Ca 0.32 -0.21 -0.02 0.00 0.07 0.00 0.00 59.98 60.14 1b7n h ARG 10 Cb 0.10 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 1b7n h ARG 10 CO -0.14 0.85 0.18 1.15 -1.07 0.00 0.00 179.97 180.94 1b7n h THR 11 N 0.18 1.20 -0.55 2.04 2.02 -0.72 0.87 112.91 117.94 1b7n h THR 11 Ca -0.02 -0.60 -0.08 0.00 0.77 0.00 0.00 66.41 66.48 1b7n h THR 11 Cb 1.25 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 68.41 1b7n h THR 11 CO 0.11 0.22 0.02 -0.07 0.37 0.00 0.00 175.52 176.17 1b7n h LEU 12 N 0.56 0.94 -0.46 2.58 3.38 -0.95 -2.30 115.31 119.06 1b7n h LEU 12 Ca 0.15 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 1b7n h LEU 12 Cb 0.17 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1b7n h LEU 12 CO -0.01 1.00 0.27 0.50 0.09 0.00 0.00 178.44 180.29 1b7n h LYS 13 N 0.84 0.63 0.00 1.13 3.64 -0.80 -1.78 116.57 120.24 1b7n h LYS 13 Ca 0.16 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.45 1b7n h LYS 13 Cb 0.51 -0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1b7n h LYS 13 CO 0.02 0.47 -0.13 0.00 -2.27 0.00 0.00 179.45 177.55 1b7n h ARG 14 N 0.61 0.00 -0.03 1.90 3.08 -0.67 -1.93 114.38 117.32 1b7n h ARG 14 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 1b7n h ARG 14 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1b7n h ARG 14 CO -0.03 0.13 0.00 1.28 -1.07 0.00 0.00 179.97 180.28 1b7n n LEU 15 N -4.29 0.41 0.00 3.04 4.77 -0.71 -4.91 117.00 115.31 1b7n n LEU 15 Ca -0.03 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 1b7n n LEU 15 Cb 0.20 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 1b7n n LEU 15 CO 0.35 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.10 1b7n n GLY 16 N 0.91 0.64 0.11 -0.72 0.00 -0.73 -4.99 105.19 100.41 1b7n n GLY 16 Ca 0.16 -0.76 0.12 0.00 0.00 0.00 0.00 46.02 45.54 1b7n n GLY 16 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1b7n h MET 17 N 0.00 0.00 -6.12 1.61 2.86 -1.61 -3.40 114.93 108.27 1b7n h MET 17 Ca 0.00 0.00 -0.54 0.00 -2.06 0.00 0.00 59.70 57.10 1b7n h MET 17 Cb 0.32 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.94 1b7n h MET 17 CO 0.00 0.00 1.31 0.34 1.06 0.00 0.00 176.91 179.62 1b7n s ASP 18 N -5.20 5.57 0.00 1.22 -1.08 -1.26 -2.20 116.67 113.72 1b7n s ASP 18 Ca 0.01 0.81 0.00 0.00 -0.52 0.00 0.00 52.55 52.86 1b7n s ASP 18 Cb 0.10 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 39.03 1b7n s ASP 18 CO 0.77 -2.05 0.00 0.61 0.52 0.00 0.00 175.17 175.02 1b7n n GLY 19 N 5.55 0.60 3.67 2.66 0.00 0.81 -4.92 105.19 113.57 1b7n n GLY 19 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 1b7n n GLY 19 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1b7n n TYR 20 N -2.78 2.56 -3.31 1.61 9.36 -0.94 -1.06 117.16 122.60 1b7n n TYR 20 Ca 0.00 -0.33 -0.24 0.00 3.32 0.00 0.00 57.90 60.66 1b7n n TYR 20 Cb 0.00 -2.79 0.02 0.00 -0.63 0.00 0.00 39.34 35.94 1b7n n TYR 20 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1b7n n ARG 21 N 7.03 -4.46 -0.98 2.98 5.12 -1.26 -1.36 116.66 123.73 1b7n n ARG 21 Ca 0.19 0.68 0.00 0.00 -1.93 0.00 0.00 57.85 56.79 1b7n n ARG 21 Cb 0.40 -5.49 0.00 0.00 -1.16 0.00 0.00 32.46 26.21 1b7n n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1b7n n GLY 22 N -1.41 0.64 3.58 -0.13 0.00 -0.22 -4.99 105.19 102.66 1b7n n GLY 22 Ca -0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 1b7n n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1b7n s ILE 23 N -2.67 5.10 0.87 -0.61 1.01 -0.46 -4.90 121.20 119.55 1b7n s ILE 23 Ca 0.00 0.47 -0.11 0.00 0.00 0.00 0.00 60.65 61.01 1b7n s ILE 23 Cb 0.00 -3.83 0.12 0.00 0.01 0.00 0.00 42.46 38.75 1b7n s ILE 23 CO 0.00 -0.02 1.09 -0.94 0.00 0.00 0.00 174.94 175.07 1b7n s SER 24 N 1.68 3.61 0.22 3.58 1.04 -1.26 -0.13 113.70 122.44 1b7n s SER 24 Ca 0.17 1.68 -0.06 0.00 0.48 0.00 0.00 55.95 58.22 1b7n s SER 24 Cb -0.16 -2.34 0.20 0.00 0.10 0.00 0.00 66.02 63.82 1b7n s SER 24 CO 0.11 -2.58 1.73 0.25 0.98 0.00 0.00 173.24 173.73 1b7n h LEU 25 N -1.51 0.97 -1.38 2.42 5.85 -1.91 -2.41 115.31 117.34 1b7n h LEU 25 Ca -0.47 -0.22 0.04 0.00 0.84 0.00 0.00 57.88 58.07 1b7n h LEU 25 Cb 1.27 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 42.00 1b7n h LEU 25 CO 0.52 0.96 0.46 0.00 -0.34 0.00 0.00 178.44 180.04 1b7n h ALA 26 N 1.15 1.65 -0.40 1.25 0.00 -1.92 -0.49 119.26 120.50 1b7n h ALA 26 Ca 0.20 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.97 1b7n h ALA 26 Cb 0.40 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1b7n h ALA 26 CO 0.01 0.26 -0.18 -0.91 0.00 0.00 0.00 179.25 178.43 1b7n h ASN 27 N 0.79 0.84 -0.49 0.00 2.35 -1.78 -1.13 115.58 116.17 1b7n h ASN 27 Ca 0.29 -0.40 -0.09 0.00 -0.55 0.00 0.00 56.30 55.54 1b7n h ASN 27 Cb 0.14 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.25 1b7n h ASN 27 CO -0.09 1.05 -0.04 -0.50 -1.65 0.00 0.00 177.43 176.21 1b7n h TRP 28 N 0.63 1.02 -0.19 1.19 4.06 -1.10 -1.63 115.95 119.93 1b7n h TRP 28 Ca 0.09 -0.18 -0.02 0.00 2.06 0.00 0.00 58.89 60.85 1b7n h TRP 28 Cb 0.73 -0.27 -0.01 0.00 -1.00 0.00 0.00 29.16 28.61 1b7n h TRP 28 CO 0.06 0.94 0.06 0.52 -3.56 0.00 0.00 178.44 176.45 1b7n h MET 29 N 0.86 0.30 -0.99 0.49 2.86 -1.02 -1.14 114.93 116.29 1b7n h MET 29 Ca 0.15 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.74 1b7n h MET 29 Cb 0.56 -0.04 -0.05 0.00 0.06 0.00 0.00 31.60 32.12 1b7n h MET 29 CO 0.03 0.40 0.66 0.00 1.06 0.00 0.00 176.91 179.06 1b7n h LEU 31 N 1.34 -0.32 -0.98 0.00 5.85 -1.09 -2.20 115.31 117.91 1b7n h LEU 31 Ca 0.37 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.98 1b7n h LEU 31 Cb -0.14 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 1b7n h LEU 31 CO -0.08 -0.13 0.27 0.00 -0.34 0.00 0.00 178.44 178.16 1b7n h ALA 32 N 0.20 1.19 0.04 1.25 0.00 -1.04 0.18 119.26 121.08 1b7n h ALA 32 Ca -0.04 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1b7n h ALA 32 Cb 0.37 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1b7n h ALA 32 CO 0.06 0.59 -0.03 -0.22 0.00 0.00 0.00 179.25 179.65 1b7n h LYS 33 N 0.98 -0.07 -0.00 0.00 1.63 -1.03 -0.35 116.57 117.73 1b7n h LYS 33 Ca 0.23 0.00 -0.16 0.00 -0.85 0.00 0.00 60.65 59.88 1b7n h LYS 33 Cb 0.19 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 31.82 1b7n h LYS 33 CO -0.02 -0.05 -0.73 -1.49 -3.45 0.00 0.00 179.45 173.71 1b7n h TRP 34 N -0.07 0.05 -0.11 1.91 4.06 -1.27 -0.33 115.95 120.19 1b7n h TRP 34 Ca 0.00 -0.02 -0.21 0.00 2.06 0.00 0.00 58.89 60.72 1b7n h TRP 34 Cb 0.07 -0.01 0.01 0.00 -1.00 0.00 0.00 29.16 28.24 1b7n h TRP 34 CO -0.09 0.75 -0.74 1.25 -3.56 0.00 0.00 178.44 176.06 1b7n h LEU 35 N 0.02 0.83 -0.19 -4.49 5.85 -0.83 -3.42 115.31 113.08 1b7n h LEU 35 Ca -0.01 -0.66 0.00 0.00 0.84 0.00 0.00 57.88 58.05 1b7n h LEU 35 Cb 1.29 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 42.07 1b7n h LEU 35 CO 0.10 1.36 0.00 -1.54 -0.34 0.00 0.00 178.44 178.02 1b7n n SER 36 N -4.02 0.00 -1.91 1.25 3.41 -0.18 -4.83 113.62 107.33 1b7n n SER 36 Ca -0.08 -1.00 -0.17 0.00 -0.26 0.00 0.00 58.87 57.36 1b7n n SER 36 Cb 0.73 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.67 1b7n n SER 36 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1b7n n GLY 37 N 0.00 -0.32 2.33 5.00 0.00 -0.13 -1.85 105.19 110.21 1b7n n GLY 37 Ca 0.00 -0.18 -0.12 0.00 0.00 0.00 0.00 46.02 45.71 1b7n n GLY 37 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1b7n n TYR 38 N -4.01 -0.11 -3.43 1.61 0.53 -1.19 -4.75 117.16 105.80 1b7n n TYR 38 Ca -0.20 0.00 -0.40 0.00 -1.02 0.00 0.00 57.90 56.28 1b7n n TYR 38 Cb 0.65 -2.35 -0.10 0.00 -1.03 0.00 0.00 39.34 36.51 1b7n n TYR 38 CO 0.00 0.00 0.00 1.21 -1.02 0.00 0.00 176.86 177.05 1b7n s ASN 39 N -2.79 6.16 0.27 7.72 2.47 -0.77 -0.91 114.94 127.09 1b7n s ASN 39 Ca 0.00 -0.21 0.25 0.00 0.42 0.00 0.00 52.86 53.32 1b7n s ASN 39 Cb 0.00 -2.18 0.96 0.00 -1.45 0.00 0.00 41.25 38.58 1b7n s ASN 39 CO 0.00 -0.30 1.74 0.71 -3.72 0.00 0.00 177.10 175.54 1b7n h THR 40 N 5.51 0.00 -0.01 -5.21 1.35 -1.29 -2.90 112.91 110.36 1b7n h THR 40 Ca -0.30 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.24 1b7n h THR 40 Cb 1.15 1.13 0.00 0.00 -1.73 0.00 0.00 68.15 68.70 1b7n h THR 40 CO 0.67 0.00 -0.36 0.54 -0.25 0.00 0.00 175.52 176.12 1b7n n ARG 41 N -2.32 1.08 -1.66 4.72 1.74 -1.26 -3.96 116.66 115.01 1b7n n ARG 41 Ca 0.03 -0.80 -0.45 0.00 -0.77 0.00 0.00 57.85 55.86 1b7n n ARG 41 Cb 0.28 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.22 1b7n n ARG 41 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1b7n n ALA 42 N -0.26 0.80 -3.07 7.54 0.00 -1.10 -4.73 120.51 119.68 1b7n n ALA 42 Ca 0.11 0.41 -0.12 0.00 0.00 0.00 0.00 53.44 53.84 1b7n n ALA 42 Cb 0.42 -2.22 -0.12 0.00 0.00 0.00 0.00 19.45 17.53 1b7n n ALA 42 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1b7n s THR 43 N -0.23 0.03 -0.07 0.00 -4.23 -1.26 -0.59 115.64 109.28 1b7n s THR 43 Ca 0.67 -0.22 -0.02 0.00 -1.18 0.00 0.00 61.69 60.95 1b7n s THR 43 Cb -0.67 -0.30 0.03 0.00 1.34 0.00 0.00 72.50 72.90 1b7n s THR 43 CO 0.52 -0.12 0.02 0.21 -0.54 0.00 0.00 174.62 174.71 1b7n s ASN 44 N -0.37 1.54 -0.04 3.99 2.47 -0.88 -4.98 114.94 116.67 1b7n s ASN 44 Ca -0.05 -0.09 -0.17 0.00 0.42 0.00 0.00 52.86 52.97 1b7n s ASN 44 Cb -0.03 -0.35 -0.05 0.00 -1.45 0.00 0.00 41.25 39.37 1b7n s ASN 44 CO 0.01 -0.22 0.48 -0.47 -3.72 0.00 0.00 177.10 173.17 1b7n s TYR 45 N 2.03 3.65 -0.56 0.43 6.14 -1.26 -0.51 117.35 127.26 1b7n s TYR 45 Ca 0.05 1.01 -0.09 0.00 0.64 0.00 0.00 57.07 58.68 1b7n s TYR 45 Cb -0.13 -2.46 0.14 0.00 0.42 0.00 0.00 41.96 39.94 1b7n s TYR 45 CO -0.05 0.41 0.44 -0.80 0.64 0.00 0.00 175.55 176.19 1b7n s ASN 46 N -0.30 5.80 0.47 4.32 0.01 0.47 -4.93 114.94 120.77 1b7n s ASN 46 Ca 0.26 -2.22 0.13 0.00 -0.71 0.00 0.00 52.86 50.32 1b7n s ASN 46 Cb -0.17 -2.02 1.09 0.00 0.41 0.00 0.00 41.25 40.57 1b7n s ASN 46 CO 0.13 -0.61 2.08 0.00 -1.51 0.00 0.00 177.10 177.19 1b7n h ALA 47 N 8.07 1.93 -0.76 0.60 0.00 -1.97 0.13 119.26 127.27 1b7n h ALA 47 Ca -0.12 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 1b7n h ALA 47 Cb 1.04 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.73 1b7n h ALA 47 CO 0.82 0.03 0.38 0.78 0.00 0.00 0.00 179.25 181.25 1b7n h GLY 48 N 0.27 1.17 -0.14 0.00 0.00 -1.95 -3.29 103.07 99.12 1b7n h GLY 48 Ca 0.12 -0.57 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1b7n h GLY 48 CO -0.02 0.54 0.00 2.09 0.00 0.00 0.00 176.54 179.15 1b7n n ASP 49 N -4.40 1.74 -1.61 0.19 5.75 -1.08 -5.02 116.55 112.12 1b7n n ASP 49 Ca 0.07 -1.65 -0.15 0.00 -0.01 0.00 0.00 54.79 53.05 1b7n n ASP 49 Cb 0.13 -0.02 -0.02 0.00 -1.03 0.00 0.00 41.12 40.18 1b7n n ASP 49 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1b7n n ARG 50 N -0.21 -1.18 -4.02 0.11 1.74 0.43 -4.85 116.66 108.68 1b7n n ARG 50 Ca 0.01 0.80 -0.24 0.00 -0.77 0.00 0.00 57.85 57.64 1b7n n ARG 50 Cb 0.18 -5.10 -0.06 0.00 -1.02 0.00 0.00 32.46 26.47 1b7n n ARG 50 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1b7n s SER 51 N -2.42 4.55 -0.00 0.55 1.04 -1.15 -4.47 113.70 111.79 1b7n s SER 51 Ca 0.00 -1.06 0.00 0.00 0.48 0.00 0.00 55.95 55.37 1b7n s SER 51 Cb 0.00 -0.34 0.00 0.00 0.10 0.00 0.00 66.02 65.78 1b7n s SER 51 CO 0.00 -0.65 -0.01 -0.89 0.98 0.00 0.00 173.24 172.68 1b7n s THR 52 N -2.61 0.06 -0.16 2.02 2.01 -1.26 -0.39 115.64 115.30 1b7n s THR 52 Ca 0.40 -0.02 -0.14 0.00 0.31 0.00 0.00 61.69 62.24 1b7n s THR 52 Cb 0.02 -0.07 -0.05 0.00 0.01 0.00 0.00 72.50 72.41 1b7n s THR 52 CO 0.23 0.03 0.29 -1.81 -0.69 0.00 0.00 174.62 172.67 1b7n s ASP 53 N 0.08 6.43 -0.09 3.53 1.01 0.33 -0.86 116.67 127.11 1b7n s ASP 53 Ca -0.01 0.50 0.03 0.00 0.71 0.00 0.00 52.55 53.78 1b7n s ASP 53 Cb -0.02 -2.18 -0.02 0.00 1.01 0.00 0.00 42.92 41.72 1b7n s ASP 53 CO -0.00 0.09 -0.17 -0.31 0.21 0.00 0.00 175.17 174.99 1b7n s TYR 54 N 0.51 2.67 0.00 4.23 2.02 0.64 -2.08 117.35 125.34 1b7n s TYR 54 Ca 0.16 -0.54 0.00 0.00 -0.37 0.00 0.00 57.07 56.33 1b7n s TYR 54 Cb -0.13 -1.71 0.00 0.00 -0.40 0.00 0.00 41.96 39.72 1b7n s TYR 54 CO 0.04 -0.10 0.00 0.41 -1.57 0.00 0.00 175.55 174.33 1b7n n GLY 55 N 3.01 -1.13 0.34 0.71 0.00 0.24 -1.47 105.19 106.90 1b7n n GLY 55 Ca -0.18 -1.21 0.12 0.00 0.00 0.00 0.00 46.02 44.75 1b7n n GLY 55 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1b7n h ILE 56 N 0.00 0.91 -0.53 -0.61 2.10 -1.66 -1.37 117.51 116.34 1b7n h ILE 56 Ca 0.00 -0.11 0.00 0.00 1.08 0.00 0.00 64.86 65.83 1b7n h ILE 56 Cb 0.00 0.57 0.00 0.00 -1.09 0.00 0.00 36.82 36.30 1b7n h ILE 56 CO 0.00 0.06 0.00 0.49 -1.08 0.00 0.00 178.15 177.62 1b7n n PHE 57 N -4.47 0.83 -4.09 2.19 3.01 -1.26 -4.17 117.46 109.51 1b7n n PHE 57 Ca 0.07 -0.54 -0.44 0.00 1.01 0.00 0.00 57.45 57.55 1b7n n PHE 57 Cb 0.33 -0.07 0.01 0.00 -0.01 0.00 0.00 39.48 39.74 1b7n n PHE 57 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1b7n n GLN 58 N 0.96 -0.41 -2.58 -1.08 1.13 -0.52 -4.87 117.38 110.02 1b7n n GLN 58 Ca 0.19 0.09 -0.42 0.00 -1.94 0.00 0.00 57.00 54.93 1b7n n GLN 58 Cb 0.60 -2.74 -0.03 0.00 0.11 0.00 0.00 30.24 28.17 1b7n n GLN 58 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1b7n s ILE 59 N -3.64 4.40 0.10 5.09 1.01 -0.54 -4.36 121.20 123.27 1b7n s ILE 59 Ca 0.43 1.78 -0.29 0.00 0.00 0.00 0.00 60.65 62.57 1b7n s ILE 59 Cb -0.23 -4.14 -0.06 0.00 0.01 0.00 0.00 42.46 38.04 1b7n s ILE 59 CO 0.97 0.17 0.92 0.21 0.00 0.00 0.00 174.94 177.21 1b7n s ASN 60 N 0.81 7.44 0.57 3.58 3.84 -1.26 -0.26 114.94 129.66 1b7n s ASN 60 Ca 0.54 1.73 0.35 0.00 0.21 0.00 0.00 52.86 55.68 1b7n s ASN 60 Cb -0.25 -2.56 1.61 0.00 -0.55 0.00 0.00 41.25 39.50 1b7n s ASN 60 CO 0.29 -0.04 2.08 0.77 -2.79 0.00 0.00 177.10 177.42 1b7n h SER 61 N 5.52 0.00 -0.69 -4.21 4.64 -1.24 -1.99 113.55 115.59 1b7n h SER 61 Ca -0.43 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1b7n h SER 61 Cb 1.21 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.27 1b7n h SER 61 CO 0.71 0.03 0.43 -0.09 -0.87 0.00 0.00 176.83 177.04 1b7n h ARG 62 N 0.00 0.93 0.00 4.77 2.43 -1.84 -3.39 114.38 117.28 1b7n h ARG 62 Ca -0.00 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1b7n h ARG 62 Cb 0.38 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 1b7n h ARG 62 CO 0.00 0.64 -0.62 0.66 -1.51 0.00 0.00 179.97 179.15 1b7n n TYR 63 N -4.41 0.00 -0.07 2.20 4.02 -1.18 -0.01 117.16 117.71 1b7n n TYR 63 Ca 0.07 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.84 1b7n n TYR 63 Cb 0.06 0.00 -0.15 0.00 -0.02 0.00 0.00 39.34 39.23 1b7n n TYR 63 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76 1b7n n TRP 64 N -1.31 0.38 -4.12 -0.72 7.02 -0.76 -0.03 117.44 117.91 1b7n n TRP 64 Ca 0.00 0.12 -0.08 0.00 -1.02 0.00 0.00 57.50 56.52 1b7n n TRP 64 Cb 0.24 -1.06 -0.10 0.00 -2.42 0.00 0.00 31.31 27.97 1b7n n TRP 64 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1b7n s ASN 66 N -2.99 5.28 0.00 0.00 2.47 -0.44 -4.55 114.94 114.72 1b7n s ASN 66 Ca 0.16 -0.07 0.00 0.00 0.42 0.00 0.00 52.86 53.37 1b7n s ASN 66 Cb 0.08 -1.91 0.00 0.00 -1.45 0.00 0.00 41.25 37.96 1b7n s ASN 66 CO -0.04 0.10 0.56 -0.90 -3.72 0.00 0.00 177.10 173.10 1b7n n ASP 67 N 4.05 1.12 0.00 -4.21 5.68 -1.26 -1.08 116.55 120.85 1b7n n ASP 67 Ca -0.17 -1.13 0.00 0.00 -0.50 0.00 0.00 54.79 52.99 1b7n n ASP 67 Cb 0.52 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 1b7n n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1b7n n GLY 68 N -0.07 0.35 0.20 6.12 0.00 -1.26 -4.82 105.19 105.71 1b7n n GLY 68 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 1b7n n GLY 68 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1b7n n LYS 69 N -1.43 0.90 -3.90 1.61 2.85 -1.26 -5.00 118.16 111.93 1b7n n LYS 69 Ca 0.00 -1.58 -0.35 0.00 -1.05 0.00 0.00 58.31 55.33 1b7n n LYS 69 Cb 0.13 -0.94 -0.14 0.00 -0.65 0.00 0.00 35.03 33.44 1b7n n LYS 69 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1b7n s THR 70 N -1.20 3.08 -0.01 0.58 2.01 -1.26 -4.91 115.64 113.94 1b7n s THR 70 Ca 0.12 -1.27 -0.38 0.00 0.31 0.00 0.00 61.69 60.47 1b7n s THR 70 Cb 0.10 -2.72 -0.16 0.00 0.01 0.00 0.00 72.50 69.72 1b7n s THR 70 CO 0.01 -0.05 1.44 -2.65 -0.69 0.00 0.00 174.62 172.68 1b7n n PRO 71 N 4.66 1.14 -2.50 4.92 -0.02 -1.26 -2.44 135.00 139.51 1b7n n PRO 71 Ca -0.14 0.41 -0.10 0.00 -2.02 0.00 0.00 63.50 61.66 1b7n n PRO 71 Cb 0.44 -2.07 -0.00 0.00 -0.02 0.00 0.00 33.50 31.85 1b7n n PRO 71 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b7n n GLY 72 N 2.94 -0.50 3.87 -1.23 0.00 -1.26 -4.93 105.19 104.08 1b7n n GLY 72 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 1b7n n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b7n s ALA 73 N -2.47 3.21 0.52 4.61 0.00 -1.02 -5.04 121.76 121.56 1b7n s ALA 73 Ca 0.02 -0.13 0.05 0.00 0.00 0.00 0.00 51.96 51.91 1b7n s ALA 73 Cb -0.01 -2.90 0.02 0.00 0.00 0.00 0.00 23.12 20.23 1b7n s ALA 73 CO 0.02 -0.33 0.34 0.14 0.00 0.00 0.00 175.76 175.93 1b7n s VAL 74 N -2.74 1.75 -0.40 0.00 -7.23 0.99 -4.98 120.40 107.79 1b7n s VAL 74 Ca 0.54 -1.55 0.08 0.00 -1.81 0.00 0.00 61.98 59.23 1b7n s VAL 74 Cb -0.10 -2.30 0.25 0.00 0.56 0.00 0.00 36.38 34.78 1b7n s VAL 74 CO 0.40 0.00 0.52 -3.20 -0.31 0.00 0.00 175.10 172.51 1b7n n ASN 75 N -1.65 0.25 0.24 4.85 5.15 -1.19 -3.83 115.26 119.09 1b7n n ASN 75 Ca -0.03 -2.70 0.08 0.00 -0.60 0.00 0.00 54.58 51.34 1b7n n ASN 75 Cb 0.64 -0.64 0.61 0.00 -0.53 0.00 0.00 39.78 39.87 1b7n n ASN 75 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1b7n h ALA 76 N 4.08 1.59 -0.01 5.20 0.00 -0.47 -1.23 119.26 128.42 1b7n h ALA 76 Ca 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1b7n h ALA 76 Cb 0.87 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1b7n h ALA 76 CO 0.47 0.17 -0.22 0.00 0.00 0.00 0.00 179.25 179.67 1b7n n HIS 78 N -0.80 -1.88 -4.02 0.00 -0.00 -0.46 -4.94 115.22 103.12 1b7n n HIS 78 Ca 0.12 0.68 -0.09 0.00 -0.00 0.00 0.00 57.72 58.43 1b7n n HIS 78 Cb 0.33 -3.87 -0.11 0.00 -0.00 0.00 0.00 29.99 26.34 1b7n n HIS 78 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1b7n s LEU 79 N -6.59 2.30 0.38 2.41 1.43 -1.26 -5.07 118.68 112.27 1b7n s LEU 79 Ca 0.20 -0.62 -0.24 0.00 -1.03 0.00 0.00 54.13 52.43 1b7n s LEU 79 Cb -0.06 0.08 -0.09 0.00 0.03 0.00 0.00 46.19 46.14 1b7n s LEU 79 CO 0.84 -0.35 1.02 -0.55 0.23 0.00 0.00 176.35 177.54 1b7n s SER 80 N -1.82 6.92 0.61 2.29 0.15 -1.26 -1.32 113.70 119.27 1b7n s SER 80 Ca -0.10 1.97 0.38 0.00 0.70 0.00 0.00 55.95 58.90 1b7n s SER 80 Cb -0.06 -2.58 1.98 0.00 -1.71 0.00 0.00 66.02 63.65 1b7n s SER 80 CO -0.03 -0.37 2.23 0.00 1.20 0.00 0.00 173.24 176.27 1b7n h SER 82 N 0.00 0.49 0.10 0.00 0.87 -1.91 -0.78 113.55 112.33 1b7n h SER 82 Ca -0.00 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1b7n h SER 82 Cb 0.17 -0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 62.02 1b7n h SER 82 CO 0.00 0.33 -0.01 0.00 -0.53 0.00 0.00 176.83 176.62 1b7n h ALA 83 N 1.69 1.18 -0.49 6.23 0.00 -1.59 -0.55 119.26 125.74 1b7n h ALA 83 Ca 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1b7n h ALA 83 Cb 0.22 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1b7n h ALA 83 CO -0.07 0.01 0.00 1.28 0.00 0.00 0.00 179.25 180.48 1b7n n LEU 84 N -3.36 2.68 -0.18 0.00 4.77 -0.30 -3.70 117.00 116.90 1b7n n LEU 84 Ca -0.03 -1.34 0.06 0.00 -0.03 0.00 0.00 56.01 54.67 1b7n n LEU 84 Cb 0.10 -0.34 0.10 0.00 -2.33 0.00 0.00 43.42 40.96 1b7n n LEU 84 CO 0.24 0.65 0.56 0.18 -1.33 0.00 0.00 177.39 177.69 1b7n n LEU 85 N 0.92 2.44 -4.87 2.23 4.77 -0.21 -3.33 117.00 118.94 1b7n n LEU 85 Ca 0.16 -2.60 -0.30 0.00 -0.03 0.00 0.00 56.01 53.25 1b7n n LEU 85 Cb 0.43 -0.27 -0.03 0.00 -2.33 0.00 0.00 43.42 41.22 1b7n n LEU 85 CO 0.12 0.63 0.46 -1.10 -1.33 0.00 0.00 177.39 176.17 1b7n s GLN 86 N -2.04 3.77 0.29 3.23 -0.21 -1.24 -4.69 119.66 118.77 1b7n s GLN 86 Ca 0.21 0.49 0.02 0.00 0.02 0.00 0.00 55.36 56.10 1b7n s GLN 86 Cb 0.17 -2.37 0.43 0.00 1.00 0.00 0.00 33.01 32.24 1b7n s GLN 86 CO 0.04 -0.07 1.75 -0.44 -2.12 0.00 0.00 175.29 174.44 1b7n h ASP 87 N 1.14 0.51 -3.15 5.90 5.19 -1.94 -3.40 116.42 120.67 1b7n h ASP 87 Ca -0.47 -0.16 -0.56 0.00 -0.62 0.00 0.00 57.03 55.22 1b7n h ASP 87 Cb 1.19 -0.14 -0.04 0.00 0.18 0.00 0.00 39.33 40.52 1b7n h ASP 87 CO 0.63 0.72 0.68 0.21 -3.12 0.00 0.00 179.24 178.36 1b7n s ASN 88 N -6.79 7.15 -0.06 6.45 3.84 -1.26 -4.85 114.94 119.42 1b7n s ASN 88 Ca -0.07 1.55 0.13 0.00 0.21 0.00 0.00 52.86 54.69 1b7n s ASN 88 Cb 0.14 -2.55 0.49 0.00 -0.55 0.00 0.00 41.25 38.78 1b7n s ASN 88 CO 0.79 -0.56 1.37 2.30 -2.79 0.00 0.00 177.10 178.21 1b7n n ILE 89 N 4.83 1.11 -0.07 -5.21 -5.35 -1.26 -4.52 119.36 108.90 1b7n n ILE 89 Ca 0.10 -0.78 -0.07 0.00 -0.27 0.00 0.00 62.75 61.73 1b7n n ILE 89 Cb 0.47 0.09 -0.01 0.00 -1.74 0.00 0.00 39.64 38.45 1b7n n ILE 89 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1b7n h ALA 90 N 3.73 0.18 -0.38 -1.28 0.00 -1.95 0.31 119.26 119.88 1b7n h ALA 90 Ca 0.00 0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 1b7n h ALA 90 Cb 0.98 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1b7n h ALA 90 CO 0.12 -0.46 -0.20 -0.44 0.00 0.00 0.00 179.25 178.27 1b7n h ASP 91 N 0.01 0.72 -0.59 0.00 3.45 -1.86 -0.94 116.42 117.22 1b7n h ASP 91 Ca 0.13 -0.25 -0.08 0.00 0.43 0.00 0.00 57.03 57.26 1b7n h ASP 91 Cb 0.19 -0.20 -0.02 0.00 -0.56 0.00 0.00 39.33 38.74 1b7n h ASP 91 CO -0.27 0.92 0.06 0.00 -1.57 0.00 0.00 179.24 178.38 1b7n h ALA 92 N 1.14 0.96 -0.41 3.45 0.00 -1.69 -1.19 119.26 121.51 1b7n h ALA 92 Ca 0.09 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 1b7n h ALA 92 Cb 0.68 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1b7n h ALA 92 CO 0.05 0.64 -0.14 0.28 0.00 0.00 0.00 179.25 180.08 1b7n h VAL 93 N 0.95 1.28 -0.74 0.00 2.07 -0.68 0.21 116.25 119.34 1b7n h VAL 93 Ca 0.18 -1.26 0.01 0.00 0.82 0.00 0.00 66.70 66.45 1b7n h VAL 93 Cb 0.46 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 31.41 1b7n h VAL 93 CO 0.02 0.42 0.48 0.00 0.02 0.00 0.00 177.57 178.52 1b7n h ALA 94 N 0.84 0.94 -0.33 1.67 0.00 -0.91 0.18 119.26 121.64 1b7n h ALA 94 Ca 0.10 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 1b7n h ALA 94 Cb 0.68 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1b7n h ALA 94 CO 0.05 0.34 -0.25 0.00 0.00 0.00 0.00 179.25 179.39 1b7n h ALA 96 N 0.75 1.51 -0.49 0.00 0.00 -0.16 -0.01 119.26 120.86 1b7n h ALA 96 Ca 0.06 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1b7n h ALA 96 Cb 0.81 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 1b7n h ALA 96 CO 0.07 0.45 0.06 0.87 0.00 0.00 0.00 179.25 180.70 1b7n h LYS 97 N 0.95 0.81 -0.96 0.00 1.57 -0.77 -2.46 116.57 115.71 1b7n h LYS 97 Ca 0.27 -0.23 0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1b7n h LYS 97 Cb -0.08 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.09 1b7n h LYS 97 CO -0.06 0.83 0.64 -0.09 -0.57 0.00 0.00 179.45 180.19 1b7n h ARG 98 N 0.68 1.26 -0.23 3.15 9.65 -0.38 -2.46 114.38 126.06 1b7n h ARG 98 Ca 0.15 -0.08 -0.01 0.00 -1.10 0.00 0.00 59.98 58.94 1b7n h ARG 98 Cb 0.42 -0.28 -0.01 0.00 -1.39 0.00 0.00 29.97 28.70 1b7n h ARG 98 CO 0.01 0.83 0.10 0.28 2.80 0.00 0.00 179.97 183.99 1b7n h VAL 99 N 1.29 1.16 0.00 0.20 2.07 -0.74 -2.87 116.25 117.36 1b7n h VAL 99 Ca 0.36 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1b7n h VAL 99 Cb -0.13 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 1b7n h VAL 99 CO -0.08 0.15 0.00 1.33 0.02 0.00 0.00 177.57 178.99 1b7n n VAL 100 N -4.82 0.71 0.30 2.57 0.24 -0.95 -2.34 118.33 114.04 1b7n n VAL 100 Ca -0.03 0.18 0.15 0.00 -2.04 0.00 0.00 64.34 62.60 1b7n n VAL 100 Cb 0.12 -0.86 0.55 0.00 -1.47 0.00 0.00 33.84 32.18 1b7n n VAL 100 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1b7n h ARG 101 N 0.00 0.00 -7.41 7.34 3.08 -1.20 -3.34 114.38 112.86 1b7n h ARG 101 Ca 0.00 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 59.58 1b7n h ARG 101 Cb 0.32 0.00 0.13 0.00 0.08 0.00 0.00 29.97 30.51 1b7n h ARG 101 CO 0.00 0.00 0.28 -0.51 -1.07 0.00 0.00 179.97 178.67 1b7n s ASP 102 N -5.52 3.68 0.31 7.04 -0.00 -0.99 -4.92 116.67 116.26 1b7n s ASP 102 Ca 0.03 1.24 0.06 0.00 -0.00 0.00 0.00 52.55 53.88 1b7n s ASP 102 Cb 0.08 -1.91 0.83 0.00 -0.00 0.00 0.00 42.92 41.93 1b7n s ASP 102 CO 0.55 -2.48 1.63 -0.65 -0.00 0.00 0.00 175.17 174.22 1b7n h PRO 103 N -1.44 0.17 0.00 8.23 0.11 -1.88 -1.81 132.00 135.38 1b7n h PRO 103 Ca -0.50 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.55 1b7n h PRO 103 Cb 1.30 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 1b7n h PRO 103 CO 0.59 0.11 -0.26 1.96 -0.21 0.00 0.00 178.00 180.19 1b7n h GLN 104 N 0.17 0.00 0.00 1.05 4.20 -1.90 -3.49 115.11 115.14 1b7n h GLN 104 Ca 0.61 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.32 1b7n h GLN 104 Cb 1.32 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.10 1b7n h GLN 104 CO -0.70 0.26 0.00 0.41 -0.67 0.00 0.00 178.83 178.12 1b7n n GLY 105 N -0.18 0.54 0.28 3.46 0.00 -0.68 -2.36 105.19 106.24 1b7n n GLY 105 Ca -0.01 -0.79 0.16 0.00 0.00 0.00 0.00 46.02 45.38 1b7n n GLY 105 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1b7n h ILE 106 N 0.00 0.00 0.00 -0.61 6.09 -1.91 -1.79 117.51 119.29 1b7n h ILE 106 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1b7n h ILE 106 Cb 0.00 0.68 0.00 0.00 0.47 0.00 0.00 36.82 37.97 1b7n h ILE 106 CO 0.00 0.00 0.00 0.54 -3.07 0.00 0.00 178.15 175.62 1b7n n ARG 107 N -2.70 0.14 0.25 2.19 1.74 -1.00 -2.91 116.66 114.37 1b7n n ARG 107 Ca -0.02 0.19 0.09 0.00 -0.77 0.00 0.00 57.85 57.35 1b7n n ARG 107 Cb 0.21 -1.50 0.66 0.00 -1.02 0.00 0.00 32.46 30.81 1b7n n ARG 107 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1b7n h ALA 108 N 2.52 1.99 -2.56 7.54 0.00 -1.51 -3.38 119.26 123.86 1b7n h ALA 108 Ca 0.00 -0.00 -0.63 0.00 0.00 0.00 0.00 54.91 54.28 1b7n h ALA 108 Cb 0.11 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.76 1b7n h ALA 108 CO 0.00 -0.04 -0.09 -1.58 0.00 0.00 0.00 179.25 177.55 1b7n s TRP 109 N -5.03 3.22 0.40 0.00 0.51 -1.15 -4.93 118.94 111.97 1b7n s TRP 109 Ca -0.05 0.38 0.06 0.00 -2.12 0.00 0.00 56.10 54.37 1b7n s TRP 109 Cb 0.17 -2.77 0.82 0.00 -0.81 0.00 0.00 33.47 30.88 1b7n s TRP 109 CO 0.66 -0.38 2.04 0.28 -0.51 0.00 0.00 176.95 179.04 1b7n h VAL 110 N 5.49 1.12 -0.73 4.03 2.07 -1.90 -1.52 116.25 124.80 1b7n h VAL 110 Ca -0.29 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.01 1b7n h VAL 110 Cb 1.14 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 1b7n h VAL 110 CO 0.72 0.12 0.48 0.00 0.02 0.00 0.00 177.57 178.91 1b7n h ALA 111 N 1.71 1.56 -0.53 1.67 0.00 -1.94 -0.22 119.26 121.52 1b7n h ALA 111 Ca 0.15 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1b7n h ALA 111 Cb -0.04 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1b7n h ALA 111 CO -0.03 0.37 0.17 2.35 0.00 0.00 0.00 179.25 182.11 1b7n h TRP 112 N 0.90 0.85 -0.56 0.00 7.01 -1.59 0.91 115.95 123.48 1b7n h TRP 112 Ca 0.29 -0.08 -0.03 0.00 2.11 0.00 0.00 58.89 61.17 1b7n h TRP 112 Cb 0.03 -0.25 -0.02 0.00 -2.10 0.00 0.00 29.16 26.82 1b7n h TRP 112 CO -0.00 0.73 0.23 0.00 -2.79 0.00 0.00 178.44 176.60 1b7n h ARG 113 N 0.73 0.83 -0.24 2.65 3.08 -1.20 0.24 114.38 120.46 1b7n h ARG 113 Ca 0.17 -0.15 -0.07 0.00 0.07 0.00 0.00 59.98 60.00 1b7n h ARG 113 Cb 0.27 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1b7n h ARG 113 CO -0.01 0.71 -0.13 -0.91 -1.07 0.00 0.00 179.97 178.57 1b7n h ASN 114 N 0.76 0.54 -0.01 7.04 2.35 -0.78 -3.36 115.58 122.11 1b7n h ASN 114 Ca 0.19 -0.42 0.00 0.00 -0.55 0.00 0.00 56.30 55.52 1b7n h ASN 114 Cb 0.19 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 38.41 1b7n h ASN 114 CO -0.02 0.84 0.00 -2.11 -1.65 0.00 0.00 177.43 174.49 1b7n n ARG 115 N -4.48 1.84 0.00 0.81 0.00 0.29 -4.85 116.66 110.28 1b7n n ARG 115 Ca -0.04 -1.24 0.00 0.00 -0.00 0.00 0.00 57.85 56.57 1b7n n ARG 115 Cb 0.36 -1.01 0.00 0.00 -0.00 0.00 0.00 32.46 31.80 1b7n n ARG 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1b7n n GLN 117 N -2.11 2.16 -3.16 0.00 7.27 0.11 -2.08 117.38 119.57 1b7n n GLN 117 Ca 0.00 0.78 -0.22 0.00 0.07 0.00 0.00 57.00 57.63 1b7n n GLN 117 Cb 0.27 -2.55 0.01 0.00 2.41 0.00 0.00 30.24 30.38 1b7n n GLN 117 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1b7n n ASN 118 N 3.50 -4.76 -4.52 1.69 5.03 -1.26 -4.96 115.26 109.97 1b7n n ASN 118 Ca 0.17 -0.31 -0.25 0.00 0.87 0.00 0.00 54.58 55.05 1b7n n ASN 118 Cb 0.29 -3.90 -0.10 0.00 -1.02 0.00 0.00 39.78 35.05 1b7n n ASN 118 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1b7n s ARG 119 N -5.82 1.78 -0.68 3.52 1.81 -0.88 -5.07 118.95 113.60 1b7n s ARG 119 Ca 0.34 -1.89 -0.23 0.00 -1.72 0.00 0.00 55.73 52.22 1b7n s ARG 119 Cb -0.17 -1.71 0.06 0.00 -0.45 0.00 0.00 34.95 32.68 1b7n s ARG 119 CO 0.41 0.19 1.03 0.34 -0.68 0.00 0.00 175.30 176.59 1b7n s ASP 120 N -3.58 6.17 0.00 0.23 -1.08 -1.26 -4.86 116.67 112.29 1b7n s ASP 120 Ca 0.32 -0.89 0.23 0.00 -0.52 0.00 0.00 52.55 51.69 1b7n s ASP 120 Cb 0.01 -2.45 0.60 0.00 -1.46 0.00 0.00 42.92 39.62 1b7n s ASP 120 CO 0.16 -1.52 1.51 1.33 0.52 0.00 0.00 175.17 177.17 1b7n n VAL 121 N 6.01 0.87 -0.34 1.11 0.24 -1.26 -4.54 118.33 120.43 1b7n n VAL 121 Ca -0.02 -0.94 0.12 0.00 -2.04 0.00 0.00 64.34 61.46 1b7n n VAL 121 Cb 0.46 0.63 0.31 0.00 -1.47 0.00 0.00 33.84 33.77 1b7n n VAL 121 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1b7n h ARG 122 N 4.38 0.70 -0.73 7.34 3.08 -1.93 -1.77 114.38 125.45 1b7n h ARG 122 Ca 0.00 -0.04 0.21 0.00 0.07 0.00 0.00 59.98 60.22 1b7n h ARG 122 Cb 1.00 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.86 1b7n h ARG 122 CO 0.00 0.46 0.60 -0.56 -1.07 0.00 0.00 179.97 179.40 1b7n h GLN 123 N 0.72 0.00 0.00 0.04 3.07 -1.98 -2.58 115.11 114.39 1b7n h GLN 123 Ca 0.57 0.00 -0.09 0.00 0.09 0.00 0.00 58.65 59.21 1b7n h GLN 123 Cb 0.89 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.44 1b7n h GLN 123 CO -0.39 0.00 -0.44 1.88 0.09 0.00 0.00 178.83 179.96 1b7n h TYR 124 N 0.00 0.00 -0.01 0.06 0.05 -1.67 -3.28 116.97 112.12 1b7n h TYR 124 Ca 0.34 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.12 1b7n h TYR 124 Cb 1.54 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.28 1b7n h TYR 124 CO 0.00 0.44 0.00 1.33 -1.05 0.00 0.00 178.16 178.88 1b7n n VAL 125 N -3.62 0.02 -1.96 -2.88 0.24 -0.99 -4.79 118.33 104.35 1b7n n VAL 125 Ca -0.01 -0.51 -0.42 0.00 -2.04 0.00 0.00 64.34 61.36 1b7n n VAL 125 Cb 0.54 1.13 -0.03 0.00 -1.47 0.00 0.00 33.84 34.01 1b7n n VAL 125 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1b7n s GLN 126 N -0.59 4.20 0.00 7.34 -1.52 -1.10 -2.24 119.66 125.76 1b7n s GLN 126 Ca 0.08 2.28 0.00 0.00 -1.95 0.00 0.00 55.36 55.78 1b7n s GLN 126 Cb 0.06 -3.63 0.00 0.00 -0.22 0.00 0.00 33.01 29.22 1b7n s GLN 126 CO 0.09 -0.73 0.00 0.41 -0.25 0.00 0.00 175.29 174.81 1b7n n GLY 127 N 3.97 0.83 0.14 3.09 0.00 -1.26 -4.93 105.19 107.03 1b7n n GLY 127 Ca 0.16 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.31 1b7n n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b7n n GLY 129 N 1.35 0.05 0.23 0.00 0.00 -1.26 -4.79 105.19 100.76 1b7n n GLY 129 Ca 0.12 -0.50 0.03 0.00 0.00 0.00 0.00 46.02 45.67 1b7n n GLY 129 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65