#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n7y h ILE 17 N 0.00 1.15 -2.17 -0.61 2.04 -1.97 -3.47 117.51 112.49 1n7y h ILE 17 Ca 0.00 -2.85 -0.60 0.00 1.00 0.00 0.00 64.86 62.41 1n7y h ILE 17 Cb 0.00 2.68 0.06 0.00 -0.74 0.00 0.00 36.82 38.82 1n7y h ILE 17 CO 0.00 0.78 0.75 0.41 0.00 0.00 0.00 178.15 180.09 1n7y n THR 18 N -3.35 0.02 0.00 -0.27 -1.04 -1.26 -4.78 114.28 103.60 1n7y n THR 18 Ca -0.15 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.86 1n7y n THR 18 Cb 1.03 -1.43 0.00 0.00 -1.82 0.00 0.00 70.33 68.11 1n7y n THR 18 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1n7y n GLY 19 N 3.30 0.93 3.78 3.41 0.00 0.54 -5.00 105.19 112.16 1n7y n GLY 19 Ca 0.17 -1.94 -0.36 0.00 0.00 0.00 0.00 46.02 43.90 1n7y n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n7y s THR 20 N -2.04 5.40 -0.02 2.61 2.01 -1.26 -2.01 115.64 120.32 1n7y s THR 20 Ca 0.00 0.31 0.06 0.00 0.31 0.00 0.00 61.69 62.37 1n7y s THR 20 Cb 0.00 -3.50 -0.01 0.00 0.01 0.00 0.00 72.50 69.00 1n7y s THR 20 CO 0.00 0.49 -0.20 0.26 -0.69 0.00 0.00 174.62 174.48 1n7y s TRP 21 N -0.11 1.83 -0.13 4.92 0.52 0.02 -4.66 118.94 121.32 1n7y s TRP 21 Ca 0.13 -0.36 -0.01 0.00 0.02 0.00 0.00 56.10 55.87 1n7y s TRP 21 Cb -0.12 -1.18 -0.02 0.00 -1.15 0.00 0.00 33.47 31.00 1n7y s TRP 21 CO 0.02 -0.05 -0.09 0.71 0.02 0.00 0.00 176.95 177.56 1n7y s TYR 22 N -0.43 2.90 0.39 -1.98 2.02 -0.38 -1.14 117.35 118.73 1n7y s TYR 22 Ca 0.07 -0.45 -0.01 0.00 -0.37 0.00 0.00 57.07 56.31 1n7y s TYR 22 Cb -0.08 -1.87 -0.03 0.00 -0.40 0.00 0.00 41.96 39.58 1n7y s TYR 22 CO -0.00 -0.10 0.61 -2.00 -1.57 0.00 0.00 175.55 172.49 1n7y s GLU 23 N 0.24 3.45 0.28 -0.62 -6.30 0.17 -1.55 118.70 114.38 1n7y s GLU 23 Ca -0.06 -0.24 0.08 0.00 -2.50 0.00 0.00 54.97 52.25 1n7y s GLU 23 Cb -0.15 -2.59 0.83 0.00 0.00 0.00 0.00 34.13 32.22 1n7y s GLU 23 CO 0.04 0.03 1.31 1.04 0.02 0.00 0.00 175.26 177.71 1n7y n GLN 24 N -1.92 -0.06 -1.16 4.30 6.02 -0.96 -2.17 117.38 121.44 1n7y n GLN 24 Ca -0.03 1.21 -0.04 0.00 -0.01 0.00 0.00 57.00 58.13 1n7y n GLN 24 Cb 0.56 -2.02 0.14 0.00 1.02 0.00 0.00 30.24 29.93 1n7y n GLN 24 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1n7y n LEU 25 N -5.08 3.39 0.00 1.08 7.99 -1.26 -5.00 117.00 118.12 1n7y n LEU 25 Ca 0.24 -4.12 0.00 0.00 -0.01 0.00 0.00 56.01 52.13 1n7y n LEU 25 Cb 0.81 -0.43 0.00 0.00 -0.11 0.00 0.00 43.42 43.69 1n7y n LEU 25 CO -0.04 1.61 0.00 0.61 -1.51 0.00 0.00 177.39 178.07 1n7y n GLY 26 N -0.92 3.67 3.63 -0.72 0.00 -0.92 -5.08 105.19 104.84 1n7y n GLY 26 Ca 0.27 -0.94 -0.37 0.00 0.00 0.00 0.00 46.02 44.98 1n7y n GLY 26 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1n7y n SER 27 N 0.00 0.77 -3.93 1.61 7.64 -1.26 -4.77 113.62 113.68 1n7y n SER 27 Ca 0.00 0.74 -0.15 0.00 1.01 0.00 0.00 58.87 60.47 1n7y n SER 27 Cb 0.00 -1.41 -0.15 0.00 -1.01 0.00 0.00 64.21 61.64 1n7y n SER 27 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1n7y s THR 28 N -1.63 0.33 0.03 0.44 2.01 -0.99 -0.65 115.64 115.18 1n7y s THR 28 Ca 0.76 -0.16 0.03 0.00 0.31 0.00 0.00 61.69 62.63 1n7y s THR 28 Cb -0.38 -0.29 -0.02 0.00 0.01 0.00 0.00 72.50 71.82 1n7y s THR 28 CO 0.47 0.10 -0.08 0.72 -0.69 0.00 0.00 174.62 175.14 1n7y s PHE 29 N 0.03 0.73 -0.19 4.92 -0.12 -0.29 -0.69 117.98 122.38 1n7y s PHE 29 Ca 0.00 -0.34 -0.04 0.00 -0.05 0.00 0.00 56.93 56.50 1n7y s PHE 29 Cb -0.03 -0.44 -0.02 0.00 -0.63 0.00 0.00 43.02 41.89 1n7y s PHE 29 CO -0.00 -0.03 -0.03 0.42 -0.05 0.00 0.00 175.22 175.53 1n7y s ILE 30 N -0.89 3.74 0.01 -4.49 -1.09 -0.62 -0.80 121.20 117.07 1n7y s ILE 30 Ca -0.04 -0.39 0.04 0.00 -2.23 0.00 0.00 60.65 58.03 1n7y s ILE 30 Cb -0.07 -2.67 -0.01 0.00 -1.58 0.00 0.00 42.46 38.12 1n7y s ILE 30 CO 0.00 0.45 -0.12 0.54 -1.23 0.00 0.00 174.94 174.59 1n7y s VAL 31 N 0.90 0.91 -0.20 2.92 0.11 -0.85 -1.00 120.40 123.19 1n7y s VAL 31 Ca -0.00 -0.71 -0.02 0.00 -2.93 0.00 0.00 61.98 58.32 1n7y s VAL 31 Cb -0.14 -0.80 -0.00 0.00 -1.53 0.00 0.00 36.38 33.90 1n7y s VAL 31 CO 0.01 0.09 -0.10 -0.89 -3.33 0.00 0.00 175.10 170.89 1n7y s THR 32 N -0.57 2.96 -0.46 5.04 2.01 0.59 -0.34 115.64 124.87 1n7y s THR 32 Ca 0.02 -0.64 -0.17 0.00 0.31 0.00 0.00 61.69 61.21 1n7y s THR 32 Cb -0.06 -2.31 0.05 0.00 0.01 0.00 0.00 72.50 70.19 1n7y s THR 32 CO 0.00 0.47 0.46 0.00 -0.69 0.00 0.00 174.62 174.86 1n7y s ALA 33 N 1.27 3.47 0.50 7.40 0.00 -1.26 -1.38 121.76 131.76 1n7y s ALA 33 Ca 0.03 -1.83 -0.17 0.00 0.00 0.00 0.00 51.96 49.99 1n7y s ALA 33 Cb -0.14 -3.13 -0.09 0.00 0.00 0.00 0.00 23.12 19.76 1n7y s ALA 33 CO -0.05 -1.75 0.98 0.20 0.00 0.00 0.00 175.76 175.14 1n7y s GLY 34 N 2.35 2.13 0.50 0.00 0.00 0.85 -4.89 107.32 108.25 1n7y s GLY 34 Ca 0.09 0.23 0.17 0.00 0.00 0.00 0.00 44.72 45.21 1n7y s GLY 34 CO 0.10 0.50 2.08 0.00 0.00 0.00 0.00 173.10 175.78 1n7y h ALA 35 N 1.12 2.10 0.00 3.20 0.00 -1.98 0.56 119.26 124.27 1n7y h ALA 35 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1n7y h ALA 35 Cb 1.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1n7y h ALA 35 CO 0.61 -0.17 0.00 -0.40 0.00 0.00 0.00 179.25 179.30 1n7y n ASP 36 N -4.48 0.00 0.00 0.00 5.75 -1.26 -4.91 116.55 111.65 1n7y n ASP 36 Ca 0.03 -0.93 0.00 0.00 -0.01 0.00 0.00 54.79 53.88 1n7y n ASP 36 Cb 0.26 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.33 1n7y n ASP 36 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1n7y n GLY 37 N 1.00 0.72 3.81 6.12 0.00 0.19 -4.99 105.19 112.05 1n7y n GLY 37 Ca 0.23 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.90 1n7y n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n7y s ALA 38 N -2.38 3.31 -0.17 4.61 0.00 -1.24 -0.87 121.76 125.01 1n7y s ALA 38 Ca 0.00 0.27 0.01 0.00 0.00 0.00 0.00 51.96 52.24 1n7y s ALA 38 Cb 0.00 -2.95 0.01 0.00 0.00 0.00 0.00 23.12 20.18 1n7y s ALA 38 CO 0.00 0.27 -0.18 -0.51 0.00 0.00 0.00 175.76 175.34 1n7y s LEU 39 N -2.26 2.27 0.01 0.00 1.02 0.15 -0.11 118.68 119.76 1n7y s LEU 39 Ca 0.48 -0.58 0.01 0.00 0.02 0.00 0.00 54.13 54.06 1n7y s LEU 39 Cb -0.16 -1.51 -0.01 0.00 0.02 0.00 0.00 46.19 44.53 1n7y s LEU 39 CO 0.20 0.03 -0.04 0.42 0.02 0.00 0.00 176.35 176.99 1n7y s THR 40 N 1.10 0.27 -1.59 5.49 -4.23 -0.48 -0.76 115.64 115.45 1n7y s THR 40 Ca 0.00 -0.44 0.00 0.00 -1.18 0.00 0.00 61.69 60.07 1n7y s THR 40 Cb -0.14 -0.29 0.00 0.00 1.34 0.00 0.00 72.50 73.41 1n7y s THR 40 CO -0.07 -0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.51 1n7y n GLY 41 N 2.48 -0.56 2.98 3.99 0.00 -0.99 -0.30 105.19 112.80 1n7y n GLY 41 Ca -0.16 -0.72 -0.16 0.00 0.00 0.00 0.00 46.02 44.97 1n7y n GLY 41 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1n7y s THR 42 N -3.11 0.50 -0.03 2.61 2.01 -0.17 -0.44 115.64 117.02 1n7y s THR 42 Ca 0.00 -0.33 0.05 0.00 0.31 0.00 0.00 61.69 61.72 1n7y s THR 42 Cb 0.00 -0.44 -0.03 0.00 0.01 0.00 0.00 72.50 72.05 1n7y s THR 42 CO 0.00 0.11 -0.17 -0.47 -0.69 0.00 0.00 174.62 173.40 1n7y s TYR 43 N -0.23 2.62 -0.16 4.92 6.14 0.17 -1.58 117.35 129.22 1n7y s TYR 43 Ca 0.02 -0.22 -0.01 0.00 0.64 0.00 0.00 57.07 57.50 1n7y s TYR 43 Cb -0.03 -1.58 0.04 0.00 0.42 0.00 0.00 41.96 40.82 1n7y s TYR 43 CO -0.00 0.17 -0.04 -1.21 0.64 0.00 0.00 175.55 175.10 1n7y s GLU 44 N -0.87 1.35 0.17 4.97 2.02 0.14 0.09 118.70 126.57 1n7y s GLU 44 Ca 0.12 -0.49 -0.11 0.00 0.02 0.00 0.00 54.97 54.51 1n7y s GLU 44 Cb -0.10 -1.98 0.05 0.00 0.10 0.00 0.00 34.13 32.19 1n7y s GLU 44 CO 0.01 -0.44 1.63 0.66 0.02 0.00 0.00 175.26 177.15 1n7y h SER 45 N 8.13 0.95 0.42 -0.19 4.64 -1.47 -2.62 113.55 123.41 1n7y h SER 45 Ca -0.23 -0.29 0.00 0.00 -0.47 0.00 0.00 61.79 60.79 1n7y h SER 45 Cb 1.11 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 1n7y h SER 45 CO 0.39 1.01 0.00 0.00 -0.87 0.00 0.00 176.83 177.36 1n7y n ALA 50 N -2.45 1.50 0.23 5.18 0.00 -1.26 -4.21 120.51 119.49 1n7y n ALA 50 Ca 0.02 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.52 1n7y n ALA 50 Cb 0.31 -1.23 0.53 0.00 0.00 0.00 0.00 19.45 19.06 1n7y n ALA 50 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1n7y h GLU 51 N 0.00 0.01 -0.46 0.00 4.81 -2.03 -2.64 114.58 114.28 1n7y h GLU 51 Ca 0.00 -0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 1n7y h GLU 51 Cb 0.21 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 1n7y h GLU 51 CO 0.00 0.15 0.04 0.43 -0.73 0.00 0.00 179.01 178.90 1n7y n SER 52 N -4.37 4.71 -4.61 1.04 7.64 -1.26 -4.71 113.62 112.05 1n7y n SER 52 Ca -0.02 -3.06 -0.34 0.00 1.01 0.00 0.00 58.87 56.45 1n7y n SER 52 Cb 0.21 -0.64 -0.10 0.00 -1.01 0.00 0.00 64.21 62.67 1n7y n SER 52 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1n7y s ARG 53 N -2.86 3.66 0.05 1.43 0.52 -1.00 -1.28 118.95 119.47 1n7y s ARG 53 Ca 0.49 -0.40 0.04 0.00 -0.52 0.00 0.00 55.73 55.34 1n7y s ARG 53 Cb 0.39 -3.03 -0.02 0.00 0.52 0.00 0.00 34.95 32.80 1n7y s ARG 53 CO 0.12 0.38 -0.11 0.71 0.02 0.00 0.00 175.30 176.41 1n7y s TYR 54 N 0.04 0.98 0.14 -0.53 2.02 0.11 -4.83 117.35 115.30 1n7y s TYR 54 Ca 0.03 -0.42 -0.30 0.00 -0.37 0.00 0.00 57.07 56.01 1n7y s TYR 54 Cb -0.13 -0.57 -0.07 0.00 -0.40 0.00 0.00 41.96 40.79 1n7y s TYR 54 CO 0.02 0.00 1.23 0.08 -1.57 0.00 0.00 175.55 175.30 1n7y s VAL 55 N -1.12 3.65 0.07 0.71 1.01 -1.26 0.42 120.40 123.88 1n7y s VAL 55 Ca -0.03 1.30 0.06 0.00 0.00 0.00 0.00 61.98 63.30 1n7y s VAL 55 Cb -0.09 -3.83 -0.04 0.00 0.00 0.00 0.00 36.38 32.42 1n7y s VAL 55 CO 0.01 0.16 -0.10 -1.48 0.00 0.00 0.00 175.10 173.69 1n7y s LEU 56 N 0.32 3.03 -0.08 3.92 0.05 0.42 -4.40 118.68 121.94 1n7y s LEU 56 Ca 0.56 -0.33 -0.06 0.00 0.05 0.00 0.00 54.13 54.35 1n7y s LEU 56 Cb -0.32 -1.80 0.02 0.00 -2.05 0.00 0.00 46.19 42.03 1n7y s LEU 56 CO 0.34 0.21 0.19 0.28 -0.55 0.00 0.00 176.35 176.82 1n7y s THR 57 N -1.14 -0.01 0.02 5.48 -1.32 -0.82 -2.34 115.64 115.52 1n7y s THR 57 Ca 0.20 0.03 -0.02 0.00 -1.21 0.00 0.00 61.69 60.69 1n7y s THR 57 Cb -0.11 -0.28 0.01 0.00 -1.51 0.00 0.00 72.50 70.60 1n7y s THR 57 CO 0.12 0.01 0.08 0.61 -2.21 0.00 0.00 174.62 173.22 1n7y n GLY 58 N 3.22 1.41 3.00 6.08 0.00 0.06 -1.01 105.19 117.95 1n7y n GLY 58 Ca -0.15 -0.96 -0.09 0.00 0.00 0.00 0.00 46.02 44.82 1n7y n GLY 58 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1n7y s ARG 59 N -2.00 0.36 0.14 1.61 1.81 -0.95 0.30 118.95 120.21 1n7y s ARG 59 Ca 0.02 -0.70 -0.13 0.00 -1.72 0.00 0.00 55.73 53.20 1n7y s ARG 59 Cb -0.00 0.12 0.01 0.00 -0.45 0.00 0.00 34.95 34.63 1n7y s ARG 59 CO 0.01 -0.06 0.35 1.52 -0.68 0.00 0.00 175.30 176.44 1n7y s TYR 60 N -1.80 0.05 -0.44 -0.53 1.13 -0.05 -1.28 117.35 114.43 1n7y s TYR 60 Ca -0.13 -0.41 -0.29 0.00 -1.41 0.00 0.00 57.07 54.83 1n7y s TYR 60 Cb -0.07 0.14 0.02 0.00 -1.10 0.00 0.00 41.96 40.94 1n7y s TYR 60 CO -0.02 -0.72 1.23 0.34 -2.51 0.00 0.00 175.55 173.86 1n7y s ASP 61 N -2.88 6.55 0.00 -0.18 2.15 0.46 -4.65 116.67 118.13 1n7y s ASP 61 Ca 0.09 0.63 0.22 0.00 0.43 0.00 0.00 52.55 53.92 1n7y s ASP 61 Cb 0.02 -2.55 1.01 0.00 -0.30 0.00 0.00 42.92 41.11 1n7y s ASP 61 CO -0.06 -1.29 1.69 -1.54 -0.17 0.00 0.00 175.17 173.79 1n7y n SER 62 N 8.10 0.96 -3.05 -0.34 3.41 -1.26 -4.14 113.62 117.30 1n7y n SER 62 Ca 0.13 -1.52 -0.17 0.00 -0.26 0.00 0.00 58.87 57.06 1n7y n SER 62 Cb 0.49 -0.05 -0.01 0.00 -0.26 0.00 0.00 64.21 64.38 1n7y n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1n7y n ALA 63 N -0.17 1.17 -1.46 7.33 0.00 -1.26 -5.03 120.51 121.10 1n7y n ALA 63 Ca 0.17 -2.79 -0.29 0.00 0.00 0.00 0.00 53.44 50.52 1n7y n ALA 63 Cb 0.23 -0.99 0.12 0.00 0.00 0.00 0.00 19.45 18.81 1n7y n ALA 63 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1n7y s PRO 64 N -1.26 1.44 0.64 0.00 0.04 -1.26 -5.03 135.00 129.57 1n7y s PRO 64 Ca 0.34 0.52 -0.15 0.00 0.04 0.00 0.00 61.00 61.75 1n7y s PRO 64 Cb 0.28 -1.85 -0.01 0.00 0.04 0.00 0.00 34.50 32.96 1n7y s PRO 64 CO -0.10 -2.04 1.10 0.00 0.04 0.00 0.00 177.00 176.00 1n7y s ALA 65 N -3.15 2.54 -0.71 8.56 0.00 -1.26 -4.98 121.76 122.75 1n7y s ALA 65 Ca 0.63 0.52 0.12 0.00 0.00 0.00 0.00 51.96 53.22 1n7y s ALA 65 Cb -0.15 -3.30 0.36 0.00 0.00 0.00 0.00 23.12 20.02 1n7y s ALA 65 CO 0.55 -1.16 1.29 0.25 0.00 0.00 0.00 175.76 176.69 1n7y n THR 66 N -2.31 1.33 0.21 0.00 -2.24 -1.26 -4.53 114.28 105.48 1n7y n THR 66 Ca 0.10 -1.23 -0.01 0.00 -2.27 0.00 0.00 64.05 60.64 1n7y n THR 66 Cb 0.52 0.31 0.13 0.00 -2.10 0.00 0.00 70.33 69.19 1n7y n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1n7y n ASP 67 N 0.23 3.01 0.00 3.42 5.68 -1.26 -4.77 116.55 122.86 1n7y n ASP 67 Ca 0.14 -2.45 0.00 0.00 -0.50 0.00 0.00 54.79 51.98 1n7y n ASP 67 Cb 0.54 -0.59 0.00 0.00 -1.14 0.00 0.00 41.12 39.93 1n7y n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1n7y n GLY 68 N 0.12 0.75 3.76 6.12 0.00 -1.26 -5.05 105.19 109.63 1n7y n GLY 68 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 1n7y n GLY 68 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1n7y s SER 69 N -2.95 5.67 0.97 1.61 0.01 -1.26 -5.03 113.70 112.72 1n7y s SER 69 Ca 0.00 2.46 -0.16 0.00 1.31 0.00 0.00 55.95 59.56 1n7y s SER 69 Cb 0.00 -2.61 0.20 0.00 0.21 0.00 0.00 66.02 63.82 1n7y s SER 69 CO 0.00 -1.27 1.31 -0.83 0.41 0.00 0.00 173.24 172.86 1n7y s GLY 70 N -1.29 1.77 -0.24 3.44 0.00 -1.26 -4.86 107.32 104.88 1n7y s GLY 70 Ca 0.69 -1.18 -0.08 0.00 0.00 0.00 0.00 44.72 44.16 1n7y s GLY 70 CO 0.38 -0.41 0.08 -1.59 0.00 0.00 0.00 173.10 171.57 1n7y s THR 71 N -3.84 4.49 0.39 0.90 2.01 0.45 -4.84 115.64 115.20 1n7y s THR 71 Ca 0.74 -0.11 -0.24 0.00 0.31 0.00 0.00 61.69 62.38 1n7y s THR 71 Cb -0.04 -3.09 -0.10 0.00 0.01 0.00 0.00 72.50 69.28 1n7y s THR 71 CO 0.53 0.35 1.00 0.00 -0.69 0.00 0.00 174.62 175.81 1n7y s ALA 72 N 1.42 3.10 0.17 7.40 0.00 -1.26 -1.02 121.76 131.57 1n7y s ALA 72 Ca 0.06 0.58 -0.24 0.00 0.00 0.00 0.00 51.96 52.36 1n7y s ALA 72 Cb -0.15 -3.22 0.06 0.00 0.00 0.00 0.00 23.12 19.81 1n7y s ALA 72 CO 0.04 -0.04 0.79 -0.48 0.00 0.00 0.00 175.76 176.07 1n7y s LEU 73 N -2.64 -0.33 0.13 0.00 2.34 -1.07 -0.41 118.68 116.71 1n7y s LEU 73 Ca 0.57 -0.31 -0.19 0.00 0.06 0.00 0.00 54.13 54.26 1n7y s LEU 73 Cb -0.18 2.42 0.05 0.00 -0.56 0.00 0.00 46.19 47.92 1n7y s LEU 73 CO 0.23 -1.02 0.48 -0.83 -1.06 0.00 0.00 176.35 174.16 1n7y s GLY 74 N -2.81 -0.42 0.19 -3.48 0.00 -0.40 -1.53 107.32 98.87 1n7y s GLY 74 Ca 0.08 0.20 -0.13 0.00 0.00 0.00 0.00 44.72 44.87 1n7y s GLY 74 CO -0.02 -0.09 0.42 0.66 0.00 0.00 0.00 173.10 174.08 1n7y s TRP 75 N -3.68 0.16 -0.00 1.90 -2.14 0.10 -2.24 118.94 113.03 1n7y s TRP 75 Ca 0.02 -0.52 0.03 0.00 2.66 0.00 0.00 56.10 58.29 1n7y s TRP 75 Cb 0.01 0.18 -0.01 0.00 -3.10 0.00 0.00 33.47 30.55 1n7y s TRP 75 CO -0.12 -0.85 -0.10 0.99 -2.66 0.00 0.00 176.95 174.21 1n7y s THR 76 N -3.93 0.79 -0.14 0.66 2.01 -0.18 0.01 115.64 114.86 1n7y s THR 76 Ca 0.14 -0.47 0.01 0.00 0.31 0.00 0.00 61.69 61.68 1n7y s THR 76 Cb 0.01 -0.67 0.02 0.00 0.01 0.00 0.00 72.50 71.87 1n7y s THR 76 CO 0.00 0.19 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.29 1n7y s VAL 77 N -0.29 1.55 -0.18 3.82 1.01 -0.24 -1.94 120.40 124.13 1n7y s VAL 77 Ca 0.03 -0.63 -0.17 0.00 0.00 0.00 0.00 61.98 61.21 1n7y s VAL 77 Cb -0.04 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 1n7y s VAL 77 CO -0.00 0.45 0.46 0.00 0.00 0.00 0.00 175.10 176.01 1n7y s ALA 78 N 1.40 3.53 -0.69 5.51 0.00 -1.26 -1.21 121.76 129.04 1n7y s ALA 78 Ca 0.03 -0.40 -0.07 0.00 0.00 0.00 0.00 51.96 51.51 1n7y s ALA 78 Cb -0.13 -2.71 -0.17 0.00 0.00 0.00 0.00 23.12 20.12 1n7y s ALA 78 CO -0.09 -0.29 3.28 0.91 0.00 0.00 0.00 175.76 179.57 1n7y n TRP 79 N 4.42 1.11 -4.55 0.00 7.02 -0.77 -4.75 117.44 119.92 1n7y n TRP 79 Ca -0.07 -2.18 -0.22 0.00 -1.02 0.00 0.00 57.50 54.01 1n7y n TRP 79 Cb 0.51 -1.93 -0.16 0.00 -2.42 0.00 0.00 31.31 27.31 1n7y n TRP 79 CO 0.00 0.00 0.00 0.21 -2.02 0.00 0.00 177.69 175.88 1n7y s LYS 80 N 1.17 1.23 0.05 -0.99 2.20 -1.26 -1.13 119.74 121.00 1n7y s LYS 80 Ca 0.67 -0.41 0.01 0.00 -0.36 0.00 0.00 55.97 55.88 1n7y s LYS 80 Cb 0.27 -1.12 -0.00 0.00 -1.51 0.00 0.00 37.83 35.47 1n7y s LYS 80 CO -0.04 0.17 0.04 0.27 -0.36 0.00 0.00 175.35 175.43 1n7y n ASN 81 N 3.20 -0.10 0.00 1.43 0.23 -0.54 -4.76 115.26 114.72 1n7y n ASN 81 Ca -0.18 -1.30 0.12 0.00 -0.53 0.00 0.00 54.58 52.70 1n7y n ASN 81 Cb 0.54 0.23 0.63 0.00 -2.08 0.00 0.00 39.78 39.11 1n7y n ASN 81 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1n7y n ASN 82 N -2.78 0.00 -0.04 0.53 4.13 -1.26 -3.71 115.26 112.13 1n7y n ASN 82 Ca 0.01 -0.17 -0.04 0.00 1.68 0.00 0.00 54.58 56.06 1n7y n ASN 82 Cb 0.08 -0.24 -0.05 0.00 -1.54 0.00 0.00 39.78 38.03 1n7y n ASN 82 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1n7y n TYR 83 N -1.24 0.00 -4.19 3.10 4.01 -1.26 -5.08 117.16 112.50 1n7y n TYR 83 Ca 0.13 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.74 1n7y n TYR 83 Cb 0.18 -0.33 -0.10 0.00 -0.31 0.00 0.00 39.34 38.78 1n7y n TYR 83 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1n7y s ARG 84 N -2.16 0.88 -0.28 -0.72 0.52 -1.24 -5.14 118.95 110.81 1n7y s ARG 84 Ca -0.06 -1.30 -0.02 0.00 -0.52 0.00 0.00 55.73 53.83 1n7y s ARG 84 Cb 0.02 -0.40 0.16 0.00 0.52 0.00 0.00 34.95 35.26 1n7y s ARG 84 CO 0.25 0.03 0.52 1.21 0.02 0.00 0.00 175.30 177.33 1n7y s ASN 85 N -2.86 -0.76 0.00 0.23 3.84 -1.25 -1.46 114.94 112.67 1n7y s ASN 85 Ca 0.11 0.69 0.24 0.00 0.21 0.00 0.00 52.86 54.11 1n7y s ASN 85 Cb 0.02 1.77 0.86 0.00 -0.55 0.00 0.00 41.25 43.35 1n7y s ASN 85 CO -0.02 -0.27 1.62 0.00 -2.79 0.00 0.00 177.10 175.64 1n7y n ALA 86 N 5.41 2.54 -3.82 1.71 0.00 -0.29 -4.94 120.51 121.11 1n7y n ALA 86 Ca -0.03 -0.51 -0.24 0.00 0.00 0.00 0.00 53.44 52.67 1n7y n ALA 86 Cb 0.51 -1.11 0.01 0.00 0.00 0.00 0.00 19.45 18.86 1n7y n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1n7y n HIS 87 N 0.34 -1.81 -3.63 0.00 8.25 -1.26 -4.81 115.22 112.29 1n7y n HIS 87 Ca 0.18 0.80 -0.10 0.00 -0.26 0.00 0.00 57.72 58.34 1n7y n HIS 87 Cb 0.36 -4.08 -0.02 0.00 1.12 0.00 0.00 29.99 27.37 1n7y n HIS 87 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1n7y s SER 88 N -4.31 -0.40 -0.02 0.41 1.04 -1.26 -0.42 113.70 108.74 1n7y s SER 88 Ca 0.04 -0.30 -0.08 0.00 0.48 0.00 0.00 55.95 56.08 1n7y s SER 88 Cb -0.02 0.64 0.01 0.00 0.10 0.00 0.00 66.02 66.75 1n7y s SER 88 CO 0.85 -1.12 0.18 0.00 0.98 0.00 0.00 173.24 174.12 1n7y s ALA 89 N -3.83 -0.44 0.00 5.32 0.00 0.28 -1.85 121.76 121.23 1n7y s ALA 89 Ca 0.06 0.12 0.08 0.00 0.00 0.00 0.00 51.96 52.22 1n7y s ALA 89 Cb -0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.06 1n7y s ALA 89 CO -0.04 -0.19 -0.25 0.99 0.00 0.00 0.00 175.76 176.27 1n7y s THR 90 N -1.00 1.98 -0.08 0.00 2.01 -0.35 0.25 115.64 118.45 1n7y s THR 90 Ca -0.11 -1.14 0.03 0.00 0.31 0.00 0.00 61.69 60.78 1n7y s THR 90 Cb -0.06 -1.66 0.01 0.00 0.01 0.00 0.00 72.50 70.80 1n7y s THR 90 CO 0.02 0.49 -0.17 0.42 -0.69 0.00 0.00 174.62 174.68 1n7y s THR 91 N -0.65 1.51 -0.16 -0.82 -4.23 -0.52 -1.08 115.64 109.71 1n7y s THR 91 Ca 0.10 -0.70 -0.05 0.00 -1.18 0.00 0.00 61.69 59.86 1n7y s THR 91 Cb -0.10 -1.34 -0.03 0.00 1.34 0.00 0.00 72.50 72.37 1n7y s THR 91 CO -0.00 0.44 -0.01 0.26 -0.54 0.00 0.00 174.62 174.77 1n7y s TRP 92 N 0.50 3.10 -0.08 3.99 0.51 0.10 -1.74 118.94 125.32 1n7y s TRP 92 Ca -0.16 -0.15 0.04 0.00 -2.12 0.00 0.00 56.10 53.72 1n7y s TRP 92 Cb -0.16 -1.98 -0.00 0.00 -0.81 0.00 0.00 33.47 30.51 1n7y s TRP 92 CO 0.06 0.06 -0.22 0.45 -0.51 0.00 0.00 176.95 176.78 1n7y s SER 93 N 0.27 2.87 0.00 2.95 0.15 -0.13 -0.73 113.70 119.08 1n7y s SER 93 Ca -0.01 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.14 1n7y s SER 93 Cb -0.13 -1.16 0.00 0.00 -1.71 0.00 0.00 66.02 63.02 1n7y s SER 93 CO 0.02 0.16 0.00 0.61 1.20 0.00 0.00 173.24 175.23 1n7y n GLY 94 N 3.40 -0.82 3.40 9.45 0.00 -0.58 -1.40 105.19 118.65 1n7y n GLY 94 Ca -0.19 -0.26 -0.16 0.00 0.00 0.00 0.00 46.02 45.41 1n7y n GLY 94 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1n7y s GLN 95 N -0.10 0.91 -0.12 1.61 -2.07 -0.05 -2.59 119.66 117.25 1n7y s GLN 95 Ca 0.00 0.04 -0.16 0.00 -1.82 0.00 0.00 55.36 53.42 1n7y s GLN 95 Cb 0.00 0.42 -0.05 0.00 -1.09 0.00 0.00 33.01 32.29 1n7y s GLN 95 CO 0.00 -0.28 0.40 -0.47 -1.32 0.00 0.00 175.29 173.63 1n7y s TYR 96 N -1.35 3.53 -0.25 9.60 5.04 -0.19 -0.67 117.35 133.06 1n7y s TYR 96 Ca -0.11 0.80 0.03 0.00 -2.44 0.00 0.00 57.07 55.35 1n7y s TYR 96 Cb -0.02 -2.44 0.05 0.00 0.35 0.00 0.00 41.96 39.90 1n7y s TYR 96 CO 0.07 0.26 -0.12 0.08 -1.34 0.00 0.00 175.55 174.50 1n7y s VAL 97 N 0.31 2.14 0.51 3.14 1.01 -0.19 -0.41 120.40 126.91 1n7y s VAL 97 Ca 0.22 -1.53 -0.09 0.00 0.00 0.00 0.00 61.98 60.59 1n7y s VAL 97 Cb -0.15 -2.21 0.12 0.00 0.00 0.00 0.00 36.38 34.14 1n7y s VAL 97 CO 0.09 0.05 0.57 0.61 0.00 0.00 0.00 175.10 176.42 1n7y n GLY 98 N 4.46 -1.85 0.00 4.51 0.00 -1.26 -1.72 105.19 109.33 1n7y n GLY 98 Ca -0.15 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.27 1n7y n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1n7y n GLY 99 N 0.17 0.08 0.23 -0.02 0.00 -1.26 -4.47 105.19 99.93 1n7y n GLY 99 Ca 0.07 -2.29 0.09 0.00 0.00 0.00 0.00 46.02 43.90 1n7y n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n7y h ALA 100 N 0.00 1.23 -1.60 4.61 0.00 -2.07 -2.99 119.26 118.45 1n7y h ALA 100 Ca 0.00 -0.19 -0.73 0.00 0.00 0.00 0.00 54.91 53.98 1n7y h ALA 100 Cb 0.00 -0.03 -0.32 0.00 0.00 0.00 0.00 17.79 17.43 1n7y h ALA 100 CO 0.00 0.27 0.46 0.39 0.00 0.00 0.00 179.25 180.37 1n7y n GLU 101 N -3.67 4.66 -2.27 0.00 -0.58 -1.26 -5.03 120.64 112.49 1n7y n GLU 101 Ca -0.01 -4.72 -0.41 0.00 -0.42 0.00 0.00 57.16 51.60 1n7y n GLU 101 Cb 0.33 -2.39 -0.03 0.00 -0.57 0.00 0.00 31.44 28.79 1n7y n GLU 101 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1n7y s ALA 102 N -4.04 3.47 0.04 0.62 0.00 -1.13 -4.85 121.76 115.87 1n7y s ALA 102 Ca 0.43 1.09 -0.17 0.00 0.00 0.00 0.00 51.96 53.31 1n7y s ALA 102 Cb 0.23 -3.43 0.03 0.00 0.00 0.00 0.00 23.12 19.95 1n7y s ALA 102 CO -0.14 -0.45 0.38 -0.98 0.00 0.00 0.00 175.76 174.57 1n7y s ARG 103 N -1.12 0.87 -0.25 0.00 3.03 -0.70 -4.13 118.95 116.65 1n7y s ARG 103 Ca 0.50 -0.37 0.00 0.00 2.03 0.00 0.00 55.73 57.89 1n7y s ARG 103 Cb -0.36 0.39 0.04 0.00 -1.03 0.00 0.00 34.95 33.98 1n7y s ARG 103 CO 0.44 -0.29 -0.09 0.42 -1.13 0.00 0.00 175.30 174.65 1n7y s ILE 104 N -2.36 2.53 -0.16 4.99 1.01 -0.34 -1.02 121.20 125.84 1n7y s ILE 104 Ca -0.06 -1.25 -0.15 0.00 0.00 0.00 0.00 60.65 59.19 1n7y s ILE 104 Cb -0.01 -2.33 -0.04 0.00 0.01 0.00 0.00 42.46 40.08 1n7y s ILE 104 CO -0.02 0.14 0.34 0.20 0.00 0.00 0.00 174.94 175.60 1n7y s ASN 105 N 1.24 6.47 0.11 3.58 0.01 0.15 -1.93 114.94 124.57 1n7y s ASN 105 Ca -0.03 0.56 0.03 0.00 -0.71 0.00 0.00 52.86 52.71 1n7y s ASN 105 Cb -0.17 -2.21 -0.04 0.00 0.41 0.00 0.00 41.25 39.24 1n7y s ASN 105 CO -0.06 0.06 -0.08 0.42 -1.51 0.00 0.00 177.10 175.93 1n7y s THR 106 N 0.63 0.85 0.01 1.60 -4.23 0.26 -0.87 115.64 113.88 1n7y s THR 106 Ca 0.18 -1.85 0.08 0.00 -1.18 0.00 0.00 61.69 58.92 1n7y s THR 106 Cb -0.14 -1.59 -0.03 0.00 1.34 0.00 0.00 72.50 72.09 1n7y s THR 106 CO 0.06 -0.74 -0.23 -1.10 -0.54 0.00 0.00 174.62 172.06 1n7y s GLN 107 N -3.45 2.04 0.24 3.99 -0.21 -0.49 -1.93 119.66 119.85 1n7y s GLN 107 Ca 0.10 -0.97 0.09 0.00 0.02 0.00 0.00 55.36 54.60 1n7y s GLN 107 Cb 0.02 -2.08 -0.05 0.00 1.00 0.00 0.00 33.01 31.90 1n7y s GLN 107 CO -0.02 0.55 -0.15 1.67 -2.12 0.00 0.00 175.29 175.21 1n7y s TRP 108 N -0.75 1.94 -0.11 0.91 1.48 -0.49 -0.95 118.94 120.98 1n7y s TRP 108 Ca 0.12 -0.50 0.02 0.00 -1.06 0.00 0.00 56.10 54.67 1n7y s TRP 108 Cb -0.10 -0.90 0.02 0.00 -1.16 0.00 0.00 33.47 31.32 1n7y s TRP 108 CO 0.01 0.48 -0.14 -0.51 -4.06 0.00 0.00 176.95 172.73 1n7y s LEU 109 N -3.40 1.67 -0.30 -4.66 1.43 -0.71 -2.23 118.68 110.49 1n7y s LEU 109 Ca 0.26 -0.41 -0.08 0.00 -1.03 0.00 0.00 54.13 52.87 1n7y s LEU 109 Cb -0.02 -1.05 -0.00 0.00 0.03 0.00 0.00 46.19 45.15 1n7y s LEU 109 CO 0.10 0.00 0.11 -0.22 0.23 0.00 0.00 176.35 176.57 1n7y s LEU 110 N 1.04 3.91 -0.11 1.79 2.96 0.46 -1.43 118.68 127.30 1n7y s LEU 110 Ca -0.06 -0.57 0.03 0.00 -0.22 0.00 0.00 54.13 53.31 1n7y s LEU 110 Cb -0.15 -1.94 -0.01 0.00 0.50 0.00 0.00 46.19 44.60 1n7y s LEU 110 CO -0.02 -0.17 -0.20 -0.89 -1.32 0.00 0.00 176.35 173.75 1n7y s THR 111 N 1.56 2.48 0.17 3.68 2.01 0.14 -0.63 115.64 125.05 1n7y s THR 111 Ca 0.04 -0.88 0.05 0.00 0.31 0.00 0.00 61.69 61.22 1n7y s THR 111 Cb -0.17 -1.98 -0.04 0.00 0.01 0.00 0.00 72.50 70.32 1n7y s THR 111 CO 0.04 0.55 0.13 -0.44 -0.69 0.00 0.00 174.62 174.21 1n7y s SER 112 N 0.27 5.46 0.09 3.53 0.01 -1.01 0.10 113.70 122.15 1n7y s SER 112 Ca -0.14 -0.16 -0.30 0.00 1.31 0.00 0.00 55.95 56.66 1n7y s SER 112 Cb -0.17 -1.40 -0.06 0.00 0.21 0.00 0.00 66.02 64.60 1n7y s SER 112 CO 0.07 0.06 1.18 -0.83 0.41 0.00 0.00 173.24 174.14 1n7y s GLY 113 N -3.13 2.50 0.18 3.44 0.00 0.44 -4.90 107.32 105.85 1n7y s GLY 113 Ca 0.31 0.85 -0.01 0.00 0.00 0.00 0.00 44.72 45.87 1n7y s GLY 113 CO 0.23 1.97 0.10 -0.51 0.00 0.00 0.00 173.10 174.90 1n7y s THR 114 N 0.80 0.06 0.82 0.90 -4.23 -1.26 -5.02 115.64 107.70 1n7y s THR 114 Ca 0.57 -1.97 -0.12 0.00 -1.18 0.00 0.00 61.69 58.99 1n7y s THR 114 Cb -0.30 -2.37 0.08 0.00 1.34 0.00 0.00 72.50 71.26 1n7y s THR 114 CO 0.31 -0.14 1.15 0.42 -0.54 0.00 0.00 174.62 175.82 1n7y s THR 115 N -4.10 2.27 0.50 3.99 -4.23 -1.26 -4.86 115.64 107.94 1n7y s THR 115 Ca 0.34 0.09 0.24 0.00 -1.18 0.00 0.00 61.69 61.19 1n7y s THR 115 Cb 0.07 -3.01 0.29 0.00 1.34 0.00 0.00 72.50 71.19 1n7y s THR 115 CO 0.09 -0.12 2.13 -0.33 -0.54 0.00 0.00 174.62 175.85 1n7y h GLU 116 N -1.11 0.00 0.00 3.99 4.39 -2.01 -1.19 114.58 118.64 1n7y h GLU 116 Ca -0.47 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.23 1n7y h GLU 116 Cb 1.32 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.97 1n7y h GLU 116 CO 0.64 0.08 0.00 0.00 -1.16 0.00 0.00 179.01 178.57 1n7y h ALA 117 N 1.92 1.00 -0.11 3.43 0.00 -2.06 -3.03 119.26 120.41 1n7y h ALA 117 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1n7y h ALA 117 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1n7y h ALA 117 CO 0.01 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.35 1n7y n ASN 118 N -3.09 2.74 0.27 0.00 3.02 -0.51 -4.64 115.26 113.06 1n7y n ASN 118 Ca 0.03 -2.72 0.16 0.00 -0.03 0.00 0.00 54.58 52.02 1n7y n ASN 118 Cb 0.47 -0.35 0.67 0.00 -0.61 0.00 0.00 39.78 39.97 1n7y n ASN 118 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1n7y h ALA 119 N 0.70 1.02 0.00 5.41 0.00 -1.27 -2.28 119.26 122.84 1n7y h ALA 119 Ca 0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1n7y h ALA 119 Cb 0.98 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 1n7y h ALA 119 CO 0.06 0.05 -0.19 0.11 0.00 0.00 0.00 179.25 179.27 1n7y h TRP 120 N 0.00 0.00 -0.37 0.00 5.08 -1.82 -2.64 115.95 116.20 1n7y h TRP 120 Ca -0.00 0.00 -0.12 0.00 1.08 0.00 0.00 58.89 59.85 1n7y h TRP 120 Cb 0.52 0.00 -0.07 0.00 -3.00 0.00 0.00 29.16 26.61 1n7y h TRP 120 CO 0.00 0.19 0.03 0.36 -1.28 0.00 0.00 178.44 177.74 1n7y n LYS 121 N -4.19 2.50 0.09 0.12 2.85 -0.86 -4.68 118.16 113.99 1n7y n LYS 121 Ca -0.02 -3.01 0.12 0.00 -1.05 0.00 0.00 58.31 54.35 1n7y n LYS 121 Cb 0.26 -1.88 0.25 0.00 -0.65 0.00 0.00 35.03 33.01 1n7y n LYS 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1n7y h SER 122 N 1.49 0.00 -3.31 -5.58 4.64 -1.42 -3.46 113.55 105.90 1n7y h SER 122 Ca 0.15 -0.10 -0.56 0.00 -0.47 0.00 0.00 61.79 60.81 1n7y h SER 122 Cb 1.68 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 63.43 1n7y h SER 122 CO 0.38 0.05 -0.83 -0.89 -0.87 0.00 0.00 176.83 174.67 1n7y s THR 123 N -3.15 1.33 0.14 2.95 2.01 -1.26 -2.40 115.64 115.26 1n7y s THR 123 Ca 0.08 -0.55 0.03 0.00 0.31 0.00 0.00 61.69 61.55 1n7y s THR 123 Cb 0.12 -1.23 -0.04 0.00 0.01 0.00 0.00 72.50 71.37 1n7y s THR 123 CO 0.67 0.41 0.22 -0.76 -0.69 0.00 0.00 174.62 174.47 1n7y s LEU 124 N 0.93 4.14 0.03 4.42 1.43 0.20 -4.94 118.68 124.89 1n7y s LEU 124 Ca -0.09 0.07 0.04 0.00 -1.03 0.00 0.00 54.13 53.13 1n7y s LEU 124 Cb -0.15 -2.73 -0.02 0.00 0.03 0.00 0.00 46.19 43.32 1n7y s LEU 124 CO -0.00 0.07 -0.13 0.54 0.23 0.00 0.00 176.35 177.06 1n7y s VAL 125 N -1.71 1.03 0.00 -1.59 0.11 -1.26 -0.40 120.40 116.57 1n7y s VAL 125 Ca 0.33 -0.89 0.00 0.00 -2.93 0.00 0.00 61.98 58.49 1n7y s VAL 125 Cb -0.11 -0.93 0.00 0.00 -1.53 0.00 0.00 36.38 33.81 1n7y s VAL 125 CO 0.26 0.03 0.00 0.61 -3.33 0.00 0.00 175.10 172.68 1n7y n GLY 126 N 2.06 2.47 3.23 6.54 0.00 -0.94 -5.01 105.19 113.54 1n7y n GLY 126 Ca -0.17 -0.85 -0.11 0.00 0.00 0.00 0.00 46.02 44.89 1n7y n GLY 126 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1n7y s HIS 127 N -5.14 -0.04 -0.04 1.61 -3.43 -1.26 -1.39 115.29 105.59 1n7y s HIS 127 Ca 0.00 -0.15 -0.11 0.00 -0.80 0.00 0.00 55.06 53.99 1n7y s HIS 127 Cb 0.00 0.05 0.02 0.00 -1.43 0.00 0.00 32.58 31.22 1n7y s HIS 127 CO 0.00 -0.49 0.26 0.34 -2.00 0.00 0.00 174.74 172.85 1n7y s ASP 128 N -2.16 -0.18 -0.10 7.38 -1.08 -0.82 -4.95 116.67 114.77 1n7y s ASP 128 Ca -0.04 0.19 0.04 0.00 -0.52 0.00 0.00 52.55 52.22 1n7y s ASP 128 Cb -0.00 0.38 -0.00 0.00 -1.46 0.00 0.00 42.92 41.84 1n7y s ASP 128 CO -0.04 -0.31 -0.24 -0.89 0.52 0.00 0.00 175.17 174.21 1n7y s THR 129 N -0.82 2.02 -0.03 1.71 2.01 -1.26 -0.58 115.64 118.69 1n7y s THR 129 Ca -0.09 -1.00 0.06 0.00 0.31 0.00 0.00 61.69 60.97 1n7y s THR 129 Cb -0.05 -1.74 -0.02 0.00 0.01 0.00 0.00 72.50 70.70 1n7y s THR 129 CO 0.02 0.55 -0.19 -0.36 -0.69 0.00 0.00 174.62 173.95 1n7y s PHE 130 N 0.31 2.54 0.27 4.92 0.40 -0.81 -2.27 117.98 123.34 1n7y s PHE 130 Ca -0.18 -0.28 0.02 0.00 -0.60 0.00 0.00 56.93 55.89 1n7y s PHE 130 Cb -0.18 -1.57 -0.05 0.00 0.51 0.00 0.00 43.02 41.73 1n7y s PHE 130 CO 0.08 0.09 0.07 0.95 0.70 0.00 0.00 175.22 177.12 1n7y s THR 131 N -0.69 0.80 -1.08 0.64 -4.23 -0.59 -1.19 115.64 109.29 1n7y s THR 131 Ca 0.11 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 58.88 1n7y s THR 131 Cb -0.10 -2.64 0.09 0.00 1.34 0.00 0.00 72.50 71.18 1n7y s THR 131 CO 0.00 -0.05 1.53 0.29 -0.54 0.00 0.00 174.62 175.86 1n7y n LYS 132 N -0.52 0.09 -4.30 3.99 5.02 -1.26 -1.25 118.16 119.94 1n7y n LYS 132 Ca -0.01 -0.05 -0.19 0.00 -2.02 0.00 0.00 58.31 56.04 1n7y n LYS 132 Cb 0.66 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 34.06 1n7y n LYS 132 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1n7y s VAL 133 N -2.94 1.56 0.00 -0.18 1.01 -1.26 -4.84 120.40 113.75 1n7y s VAL 133 Ca 0.13 -1.95 0.00 0.00 0.00 0.00 0.00 61.98 60.16 1n7y s VAL 133 Cb 0.18 -1.80 0.00 0.00 0.00 0.00 0.00 36.38 34.76 1n7y s VAL 133 CO 0.65 -0.48 0.00 0.29 0.00 0.00 0.00 175.10 175.56