#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nl3 s SER -14 N 0.00 5.26 0.67 1.67 0.01 -1.26 -4.97 113.70 115.07 1nl3 s SER -14 Ca 0.00 -0.35 -0.02 0.00 1.31 0.00 0.00 55.95 56.89 1nl3 s SER -14 Cb 0.00 -1.25 0.09 0.00 0.21 0.00 0.00 66.02 65.06 1nl3 s SER -14 CO 0.00 -0.02 0.94 -2.16 0.41 0.00 0.00 173.24 172.40 1nl3 s PRO -13 N -3.77 2.01 0.00 12.44 0.04 -1.26 -4.34 135.00 140.12 1nl3 s PRO -13 Ca 0.32 -0.83 0.00 0.00 0.04 0.00 0.00 61.00 60.53 1nl3 s PRO -13 Cb -0.08 -2.34 0.00 0.00 0.04 0.00 0.00 34.50 32.13 1nl3 s PRO -13 CO 0.23 -1.21 0.00 -3.47 0.04 0.00 0.00 177.00 172.60 1nl3 n ASP -12 N -2.72 2.61 -4.67 6.66 2.03 -1.26 -4.62 116.55 114.58 1nl3 n ASP -12 Ca 0.11 0.00 -0.44 0.00 0.52 0.00 0.00 54.79 54.98 1nl3 n ASP -12 Cb 0.60 0.43 -0.04 0.00 -0.72 0.00 0.00 41.12 41.40 1nl3 n ASP -12 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1nl3 n LEU -11 N -0.96 3.90 -0.84 -2.67 4.77 -1.26 -1.60 117.00 118.34 1nl3 n LEU -11 Ca 0.00 0.94 -0.08 0.00 -0.03 0.00 0.00 56.01 56.84 1nl3 n LEU -11 Cb 0.09 -1.48 -0.01 0.00 -2.33 0.00 0.00 43.42 39.69 1nl3 n LEU -11 CO 0.00 0.11 -0.10 0.61 -1.33 0.00 0.00 177.39 176.68 1nl3 n GLY -10 N 4.42 0.33 3.10 -0.72 0.00 -1.26 -5.00 105.19 106.05 1nl3 n GLY -10 Ca 0.20 -0.58 -0.33 0.00 0.00 0.00 0.00 46.02 45.32 1nl3 n GLY -10 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nl3 s THR -9 N -2.38 2.16 0.09 2.61 2.01 -0.63 -5.04 115.64 114.47 1nl3 s THR -9 Ca 0.00 -1.27 -0.30 0.00 0.31 0.00 0.00 61.69 60.43 1nl3 s THR -9 Cb 0.00 -2.09 -0.13 0.00 0.01 0.00 0.00 72.50 70.29 1nl3 s THR -9 CO 0.00 0.25 1.63 0.25 -0.69 0.00 0.00 174.62 176.07 1nl3 h LEU -8 N 7.86 -0.79 -9.23 4.42 5.85 -1.95 -3.41 115.31 118.07 1nl3 h LEU -8 Ca -0.33 0.06 -0.59 0.00 0.84 0.00 0.00 57.88 57.87 1nl3 h LEU -8 Cb 1.09 0.26 -0.10 0.00 0.37 0.00 0.00 40.66 42.28 1nl3 h LEU -8 CO 0.55 -0.44 -0.14 -0.69 -0.34 0.00 0.00 178.44 177.38 1nl3 s VAL -7 N -6.04 5.18 -0.20 1.05 1.01 -1.26 -4.77 120.40 115.36 1nl3 s VAL -7 Ca -0.16 0.86 -0.36 0.00 0.00 0.00 0.00 61.98 62.31 1nl3 s VAL -7 Cb 0.06 -3.79 -0.13 0.00 0.00 0.00 0.00 36.38 32.52 1nl3 s VAL -7 CO 0.64 0.28 1.91 -0.81 0.00 0.00 0.00 175.10 177.11 1nl3 n PRO -6 N 4.14 1.64 0.10 2.72 -0.04 -1.26 -4.87 135.00 137.42 1nl3 n PRO -6 Ca -0.07 0.58 -0.11 0.00 -0.04 0.00 0.00 63.50 63.86 1nl3 n PRO -6 Cb 0.51 -2.45 -0.07 0.00 -0.04 0.00 0.00 33.50 31.45 1nl3 n PRO -6 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1nl3 h ARG -5 N 9.33 -0.31 0.00 0.54 2.47 -1.91 -3.42 114.38 121.08 1nl3 h ARG -5 Ca -0.44 0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.30 1nl3 h ARG -5 Cb 1.30 0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.69 1nl3 h ARG -5 CO 0.97 0.05 0.00 0.41 0.56 0.00 0.00 179.97 181.95 1nl3 n GLY -4 N 0.43 -1.82 0.05 0.04 0.00 -1.26 -4.82 105.19 97.80 1nl3 n GLY -4 Ca -0.08 0.60 -0.12 0.00 0.00 0.00 0.00 46.02 46.43 1nl3 n GLY -4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1nl3 h SER -3 N 0.00 0.02 -0.13 1.61 0.02 -1.94 -2.58 113.55 110.55 1nl3 h SER -3 Ca 0.00 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 1nl3 h SER -3 Cb 0.00 -0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1nl3 h SER -3 CO 0.00 0.13 0.08 -0.03 -1.14 0.00 0.00 176.83 175.87 1nl3 h MET -2 N -0.09 0.17 -0.38 3.45 -1.53 -1.91 -2.85 114.93 111.77 1nl3 h MET -2 Ca 0.01 -0.01 -0.05 0.00 -3.44 0.00 0.00 59.70 56.20 1nl3 h MET -2 Cb 0.12 -0.04 -0.01 0.00 -0.55 0.00 0.00 31.60 31.12 1nl3 h MET -2 CO -0.00 0.11 0.04 0.00 0.14 0.00 0.00 176.91 177.20 1nl3 h ALA -1 N 1.92 0.51 -0.40 0.39 0.00 -1.76 -2.78 119.26 117.14 1nl3 h ALA -1 Ca 0.05 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.80 1nl3 h ALA -1 Cb -0.02 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.57 1nl3 h ALA -1 CO -0.01 0.25 0.04 -0.44 0.00 0.00 0.00 179.25 179.09 1nl3 h ASP 0 N 0.49 -0.07 -0.79 0.00 5.19 -1.25 0.83 116.42 120.81 1nl3 h ASP 0 Ca 0.11 0.08 0.09 0.00 -0.62 0.00 0.00 57.03 56.70 1nl3 h ASP 0 Cb 0.40 0.13 -0.05 0.00 0.18 0.00 0.00 39.33 39.99 1nl3 h ASP 0 CO 0.01 -0.00 0.52 0.40 -3.12 0.00 0.00 179.24 177.05 1nl3 h ILE 1 N 0.16 0.96 0.02 0.35 2.04 -1.36 -2.53 117.51 117.14 1nl3 h ILE 1 Ca 0.20 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.78 1nl3 h ILE 1 Cb 0.26 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 36.49 1nl3 h ILE 1 CO -0.29 0.14 -0.10 -0.07 0.00 0.00 0.00 178.15 177.82 1nl3 h LEU 2 N 0.74 0.06 -0.49 1.44 3.38 -1.16 -2.27 115.31 117.02 1nl3 h LEU 2 Ca 0.36 -0.96 0.00 0.00 0.09 0.00 0.00 57.88 57.37 1nl3 h LEU 2 Cb 0.42 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1nl3 h LEU 2 CO -0.14 1.02 0.00 -0.24 0.09 0.00 0.00 178.44 179.17 1nl3 n SER 3 N -4.56 0.08 0.00 -0.43 2.88 0.28 -2.19 113.62 109.67 1nl3 n SER 3 Ca -0.10 -0.31 0.00 0.00 -1.33 0.00 0.00 58.87 57.13 1nl3 n SER 3 Cb 0.51 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 63.93 1nl3 n SER 3 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1nl3 n LYS 4 N -0.05 0.00 0.00 -1.46 5.02 -1.07 -4.57 118.16 116.03 1nl3 n LYS 4 Ca 0.00 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.33 1nl3 n LYS 4 Cb 0.02 -0.18 0.23 0.00 -0.02 0.00 0.00 35.03 35.08 1nl3 n LYS 4 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1nl3 n LEU 5 N -0.69 0.00 0.01 -0.35 7.94 -0.85 -3.20 117.00 119.86 1nl3 n LEU 5 Ca 0.00 0.00 -0.01 0.00 -1.11 0.00 0.00 56.01 54.89 1nl3 n LEU 5 Cb 0.00 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 43.95 1nl3 n LEU 5 CO 0.00 0.00 0.32 0.25 -1.11 0.00 0.00 177.39 176.85 1nl3 h LEU 6 N 0.00 -0.03 -0.80 -1.96 5.85 -1.69 -3.02 115.31 113.67 1nl3 h LEU 6 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1nl3 h LEU 6 Cb 0.00 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1nl3 h LEU 6 CO 0.00 -0.01 0.59 0.03 -0.34 0.00 0.00 178.44 178.71 1nl3 h ARG 7 N -0.05 0.00 -0.02 1.25 2.47 -1.84 0.27 114.38 116.46 1nl3 h ARG 7 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1nl3 h ARG 7 Cb 0.03 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.35 1nl3 h ARG 7 CO 0.01 0.00 -0.04 1.28 0.56 0.00 0.00 179.97 181.78 1nl3 n LEU 8 N -2.36 1.86 -3.58 3.04 4.32 -1.15 -4.99 117.00 114.14 1nl3 n LEU 8 Ca -0.01 -0.62 -0.20 0.00 -0.02 0.00 0.00 56.01 55.17 1nl3 n LEU 8 Cb 0.61 -0.01 0.06 0.00 -1.62 0.00 0.00 43.42 42.45 1nl3 n LEU 8 CO 0.05 0.31 0.00 0.61 -1.22 0.00 0.00 177.39 177.15 1nl3 n GLY 9 N 1.24 -0.36 0.07 -0.72 0.00 0.96 -4.93 105.19 101.45 1nl3 n GLY 9 Ca 0.17 0.14 -0.07 0.00 0.00 0.00 0.00 46.02 46.25 1nl3 n GLY 9 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nl3 n GLU 10 N -4.17 1.55 -2.78 1.61 -0.58 -1.24 -5.05 120.64 109.97 1nl3 n GLU 10 Ca -0.28 -0.01 -0.08 0.00 -0.42 0.00 0.00 57.16 56.37 1nl3 n GLU 10 Cb 0.67 -1.38 0.03 0.00 -0.57 0.00 0.00 31.44 30.19 1nl3 n GLU 10 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1nl3 n GLY 11 N 2.07 0.32 0.11 0.62 0.00 -1.26 -4.96 105.19 102.10 1nl3 n GLY 11 Ca -0.24 -0.31 -0.15 0.00 0.00 0.00 0.00 46.02 45.31 1nl3 n GLY 11 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1nl3 h ARG 12 N -0.90 0.28 -0.51 1.61 1.12 -1.94 -2.96 114.38 111.08 1nl3 h ARG 12 Ca -0.21 -0.44 0.07 0.00 -1.11 0.00 0.00 59.98 58.29 1nl3 h ARG 12 Cb 1.13 0.16 -0.06 0.00 -0.01 0.00 0.00 29.97 31.19 1nl3 h ARG 12 CO 0.20 1.19 0.18 1.98 -3.11 0.00 0.00 179.97 180.41 1nl3 h MET 13 N 0.10 0.34 -0.36 0.20 4.05 -1.93 0.49 114.93 117.82 1nl3 h MET 13 Ca -0.12 -0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 59.25 1nl3 h MET 13 Cb 1.89 -0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 32.60 1nl3 h MET 13 CO 0.19 0.23 0.12 0.28 0.23 0.00 0.00 176.91 177.96 1nl3 h VAL 14 N 0.35 1.20 -0.62 -5.77 2.07 -1.94 0.47 116.25 112.02 1nl3 h VAL 14 Ca 0.25 -0.65 0.06 0.00 0.82 0.00 0.00 66.70 67.18 1nl3 h VAL 14 Cb 0.28 0.96 -0.05 0.00 -1.52 0.00 0.00 31.29 30.96 1nl3 h VAL 14 CO -0.26 0.23 0.33 0.50 0.02 0.00 0.00 177.57 178.38 1nl3 h LYS 15 N 0.43 0.59 0.97 1.57 3.64 -1.21 0.36 116.57 122.93 1nl3 h LYS 15 Ca 0.12 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 1nl3 h LYS 15 Cb 0.23 -0.13 0.01 0.00 -0.41 0.00 0.00 32.23 31.93 1nl3 h LYS 15 CO -0.01 0.39 -0.47 -0.09 -2.27 0.00 0.00 179.45 177.01 1nl3 h ARG 16 N 0.61 -1.26 -1.01 1.90 9.65 0.26 -1.80 114.38 122.73 1nl3 h ARG 16 Ca 0.28 0.09 0.24 0.00 -1.10 0.00 0.00 59.98 59.48 1nl3 h ARG 16 Cb 0.18 0.29 -0.12 0.00 -1.39 0.00 0.00 29.97 28.93 1nl3 h ARG 16 CO -0.18 -0.84 0.61 -0.07 2.80 0.00 0.00 179.97 182.29 1nl3 h LEU 17 N -1.32 0.67 -0.75 3.80 3.38 0.21 0.12 115.31 121.41 1nl3 h LEU 17 Ca -0.13 0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1nl3 h LEU 17 Cb 1.00 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.74 1nl3 h LEU 17 CO 0.22 0.13 0.17 0.50 0.09 0.00 0.00 178.44 179.55 1nl3 h LYS 18 N 0.59 1.11 -0.10 1.13 3.64 -0.08 -1.56 116.57 121.30 1nl3 h LYS 18 Ca 0.63 -0.27 0.00 0.00 -1.27 0.00 0.00 60.65 59.74 1nl3 h LYS 18 Cb 1.20 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 32.87 1nl3 h LYS 18 CO -0.44 0.98 0.06 0.87 -2.27 0.00 0.00 179.45 178.66 1nl3 h LYS 19 N 1.05 0.13 -0.33 1.90 1.57 0.09 -0.02 116.57 120.95 1nl3 h LYS 19 Ca 0.22 -0.01 0.07 0.00 -1.87 0.00 0.00 60.65 59.06 1nl3 h LYS 19 Cb 0.37 -0.03 -0.08 0.00 0.08 0.00 0.00 32.23 32.57 1nl3 h LYS 19 CO 0.00 0.11 -0.25 0.28 -0.57 0.00 0.00 179.45 179.03 1nl3 h VAL 20 N 0.11 0.36 -0.37 0.50 2.07 -1.25 -0.76 116.25 116.92 1nl3 h VAL 20 Ca 0.04 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.63 1nl3 h VAL 20 Cb 0.01 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 30.08 1nl3 h VAL 20 CO -0.01 0.00 -0.05 0.00 0.02 0.00 0.00 177.57 177.53 1nl3 h ALA 21 N 0.91 0.29 0.22 1.67 0.00 -1.05 -0.46 119.26 120.85 1nl3 h ALA 21 Ca 0.17 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.21 1nl3 h ALA 21 Cb 0.47 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1nl3 h ALA 21 CO -0.46 -0.43 -0.26 -0.44 0.00 0.00 0.00 179.25 177.66 1nl3 h ASP 22 N 0.05 -0.72 -0.63 0.00 3.32 -0.40 -1.25 116.42 116.78 1nl3 h ASP 22 Ca 0.18 0.07 0.10 0.00 0.02 0.00 0.00 57.03 57.40 1nl3 h ASP 22 Cb 0.27 0.25 -0.08 0.00 0.22 0.00 0.00 39.33 39.99 1nl3 h ASP 22 CO -0.34 -0.37 0.23 0.22 -1.72 0.00 0.00 179.24 177.25 1nl3 h TYR 23 N -0.53 0.39 -0.38 4.55 3.20 -0.85 -0.11 116.97 123.23 1nl3 h TYR 23 Ca 0.00 0.03 0.07 0.00 3.14 0.00 0.00 58.73 61.98 1nl3 h TYR 23 Cb 0.51 -0.08 -0.07 0.00 1.54 0.00 0.00 36.73 38.64 1nl3 h TYR 23 CO -0.19 0.08 -0.04 0.28 -1.64 0.00 0.00 178.16 176.64 1nl3 h VAL 24 N 0.40 0.67 -0.87 1.81 2.07 -0.59 -1.60 116.25 118.14 1nl3 h VAL 24 Ca 0.33 -0.02 0.19 0.00 0.82 0.00 0.00 66.70 68.02 1nl3 h VAL 24 Cb 0.43 0.61 -0.11 0.00 -1.52 0.00 0.00 31.29 30.69 1nl3 h VAL 24 CO -0.33 0.01 0.40 1.23 0.02 0.00 0.00 177.57 178.90 1nl3 h GLY 25 N 0.05 1.46 1.34 2.17 0.00 0.15 0.16 103.07 108.40 1nl3 h GLY 25 Ca 0.19 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1nl3 h GLY 25 CO -0.35 -0.18 0.00 -1.30 0.00 0.00 0.00 176.54 174.71 1nl3 n THR 26 N -4.98 0.54 0.61 4.70 -2.24 -0.60 -1.82 114.28 110.48 1nl3 n THR 26 Ca 0.20 0.13 0.12 0.00 -2.27 0.00 0.00 64.05 62.23 1nl3 n THR 26 Cb 0.56 -1.03 0.20 0.00 -2.10 0.00 0.00 70.33 67.96 1nl3 n THR 26 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1nl3 n LEU 27 N -1.17 3.17 0.11 3.22 4.77 0.56 -4.62 117.00 123.04 1nl3 n LEU 27 Ca 0.04 -1.27 -0.02 0.00 -0.03 0.00 0.00 56.01 54.72 1nl3 n LEU 27 Cb 0.04 -0.16 0.20 0.00 -2.33 0.00 0.00 43.42 41.17 1nl3 n LEU 27 CO 0.04 0.64 0.57 -1.28 -1.33 0.00 0.00 177.39 176.03 1nl3 h SER 28 N 4.36 0.17 -0.03 -1.43 0.87 -1.47 -2.54 113.55 113.47 1nl3 h SER 28 Ca 0.00 -0.08 -0.00 0.00 -1.23 0.00 0.00 61.79 60.48 1nl3 h SER 28 Cb 0.95 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.86 1nl3 h SER 28 CO 0.00 0.65 0.01 0.44 -0.53 0.00 0.00 176.83 177.40 1nl3 h ASP 29 N 0.12 0.04 -0.91 6.23 3.32 -1.82 -1.82 116.42 121.59 1nl3 h ASP 29 Ca 0.00 -0.19 0.14 0.00 0.02 0.00 0.00 57.03 57.01 1nl3 h ASP 29 Cb 0.94 -0.01 -0.09 0.00 0.22 0.00 0.00 39.33 40.39 1nl3 h ASP 29 CO 0.07 0.22 0.52 0.44 -1.72 0.00 0.00 179.24 178.77 1nl3 h ASP 30 N -0.13 0.69 0.45 6.45 5.19 -1.78 -1.01 116.42 126.28 1nl3 h ASP 30 Ca 0.01 0.08 -0.31 0.00 -0.62 0.00 0.00 57.03 56.19 1nl3 h ASP 30 Cb 0.19 -0.05 0.01 0.00 0.18 0.00 0.00 39.33 39.66 1nl3 h ASP 30 CO -0.00 0.31 -1.43 -0.37 -3.12 0.00 0.00 179.24 174.64 1nl3 h VAL 31 N 0.75 1.30 -1.00 -1.35 -1.51 -1.58 -3.32 116.25 109.56 1nl3 h VAL 31 Ca 0.48 -2.85 0.12 0.00 -1.23 0.00 0.00 66.70 63.23 1nl3 h VAL 31 Cb 0.63 2.91 -0.09 0.00 -2.13 0.00 0.00 31.29 32.61 1nl3 h VAL 31 CO -0.33 0.85 0.62 -0.33 -1.23 0.00 0.00 177.57 177.15 1nl3 h GLU 32 N 0.09 0.94 0.00 5.19 5.08 -0.38 -2.09 114.58 123.41 1nl3 h GLU 32 Ca -0.21 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 1nl3 h GLU 32 Cb 2.05 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 31.09 1nl3 h GLU 32 CO 0.21 0.62 0.00 1.63 -1.00 0.00 0.00 179.01 180.47 1nl3 n LYS 33 N -4.64 0.31 -4.18 2.33 5.02 -0.48 -4.83 118.16 111.69 1nl3 n LYS 33 Ca 0.19 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 56.16 1nl3 n LYS 33 Cb 0.37 -1.47 -0.08 0.00 -0.02 0.00 0.00 35.03 33.83 1nl3 n LYS 33 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1nl3 s LEU 34 N -1.93 3.65 0.90 -0.35 1.43 -0.79 -5.11 118.68 116.48 1nl3 s LEU 34 Ca 0.14 0.01 -0.11 0.00 -1.03 0.00 0.00 54.13 53.15 1nl3 s LEU 34 Cb 0.06 -2.17 0.14 0.00 0.03 0.00 0.00 46.19 44.25 1nl3 s LEU 34 CO 0.11 0.25 1.10 0.42 0.23 0.00 0.00 176.35 178.47 1nl3 s THR 35 N -1.18 2.52 0.39 5.49 -4.23 -1.26 -4.77 115.64 112.61 1nl3 s THR 35 Ca 0.22 0.17 0.14 0.00 -1.18 0.00 0.00 61.69 61.05 1nl3 s THR 35 Cb -0.12 -2.42 0.36 0.00 1.34 0.00 0.00 72.50 71.66 1nl3 s THR 35 CO 0.14 -0.22 1.86 0.44 -0.54 0.00 0.00 174.62 176.29 1nl3 h ASP 36 N -1.70 0.50 1.38 3.99 5.19 -1.98 -0.75 116.42 123.03 1nl3 h ASP 36 Ca -0.47 0.04 -0.09 0.00 -0.62 0.00 0.00 57.03 55.90 1nl3 h ASP 36 Cb 1.27 -0.05 -0.01 0.00 0.18 0.00 0.00 39.33 40.72 1nl3 h ASP 36 CO 0.48 0.21 -0.42 0.00 -3.12 0.00 0.00 179.24 176.39 1nl3 h ALA 37 N 1.61 0.77 0.16 3.45 0.00 -1.97 -3.24 119.26 120.05 1nl3 h ALA 37 Ca 0.46 -0.38 -0.31 0.00 0.00 0.00 0.00 54.91 54.69 1nl3 h ALA 37 Cb 1.01 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.74 1nl3 h ALA 37 CO -0.20 0.53 -1.45 0.93 0.00 0.00 0.00 179.25 179.06 1nl3 h GLU 38 N 0.00 0.33 -7.20 0.00 5.08 -1.58 -3.15 114.58 108.06 1nl3 h GLU 38 Ca -0.00 -0.57 -0.52 0.00 -1.00 0.00 0.00 59.36 57.27 1nl3 h GLU 38 Cb 1.22 0.21 0.14 0.00 0.50 0.00 0.00 28.75 30.82 1nl3 h GLU 38 CO 0.05 1.24 0.37 -1.17 -1.00 0.00 0.00 179.01 178.50 1nl3 s LEU 39 N -7.19 3.29 0.00 1.33 2.96 -0.41 -3.24 118.68 115.42 1nl3 s LEU 39 Ca -0.08 2.20 0.00 0.00 -0.22 0.00 0.00 54.13 56.03 1nl3 s LEU 39 Cb 0.06 -4.57 0.00 0.00 0.50 0.00 0.00 46.19 42.18 1nl3 s LEU 39 CO 0.88 -2.11 0.00 -2.11 -1.32 0.00 0.00 176.35 171.70 1nl3 n ARG 40 N -2.77 0.00 0.15 1.98 -4.01 -1.26 -4.33 116.66 106.41 1nl3 n ARG 40 Ca 0.12 0.00 0.02 0.00 -1.04 0.00 0.00 57.85 56.95 1nl3 n ARG 40 Cb 0.51 0.00 0.21 0.00 -3.04 0.00 0.00 32.46 30.14 1nl3 n ARG 40 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 1nl3 h ALA 41 N 0.00 0.89 -0.36 2.89 0.00 -1.59 -3.26 119.26 117.83 1nl3 h ALA 41 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1nl3 h ALA 41 Cb 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1nl3 h ALA 41 CO 0.00 0.65 0.24 0.87 0.00 0.00 0.00 179.25 181.01 1nl3 h LYS 42 N 0.00 0.47 -0.28 0.00 1.79 -1.74 -0.33 116.57 116.48 1nl3 h LYS 42 Ca -0.01 -0.03 0.05 0.00 -2.18 0.00 0.00 60.65 58.49 1nl3 h LYS 42 Cb 1.10 -0.11 -0.05 0.00 -1.58 0.00 0.00 32.23 31.60 1nl3 h LYS 42 CO 0.07 0.31 -0.01 1.15 -1.08 0.00 0.00 179.45 179.89 1nl3 h THR 43 N 0.48 0.79 -0.07 -0.16 2.02 -1.81 0.20 112.91 114.37 1nl3 h THR 43 Ca 0.13 -0.02 -0.09 0.00 0.77 0.00 0.00 66.41 67.20 1nl3 h THR 43 Cb -0.06 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 1nl3 h THR 43 CO -0.03 0.01 -0.36 0.44 0.37 0.00 0.00 175.52 175.95 1nl3 h ASP 44 N 0.07 0.14 0.53 4.18 3.32 -1.35 0.37 116.42 123.68 1nl3 h ASP 44 Ca 0.13 -0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.11 1nl3 h ASP 44 Cb 0.18 -0.04 0.01 0.00 0.22 0.00 0.00 39.33 39.70 1nl3 h ASP 44 CO -0.23 0.50 -0.26 -0.08 -1.72 0.00 0.00 179.24 177.45 1nl3 h GLU 45 N 0.12 -0.69 -0.48 3.56 4.81 -0.52 -2.13 114.58 119.24 1nl3 h GLU 45 Ca 0.01 0.05 0.05 0.00 -0.13 0.00 0.00 59.36 59.34 1nl3 h GLU 45 Cb 0.70 0.16 -0.05 0.00 0.63 0.00 0.00 28.75 30.19 1nl3 h GLU 45 CO 0.05 -0.39 0.21 0.74 -0.73 0.00 0.00 179.01 178.89 1nl3 h PHE 46 N -0.91 0.37 -0.79 0.92 0.04 -0.48 0.01 116.94 116.10 1nl3 h PHE 46 Ca -0.07 0.02 0.07 0.00 2.80 0.00 0.00 57.97 60.79 1nl3 h PHE 46 Cb 0.62 -0.10 -0.05 0.00 2.20 0.00 0.00 35.95 38.62 1nl3 h PHE 46 CO -0.00 0.16 0.52 0.87 -0.60 0.00 0.00 178.31 179.25 1nl3 h LYS 47 N 0.41 0.80 0.05 1.51 1.57 -0.90 -1.00 116.57 119.01 1nl3 h LYS 47 Ca 0.22 -0.05 -0.25 0.00 -1.87 0.00 0.00 60.65 58.70 1nl3 h LYS 47 Cb 0.19 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 1nl3 h LYS 47 CO -0.20 0.53 -1.22 0.07 -0.57 0.00 0.00 179.45 178.06 1nl3 h ARG 48 N 0.83 0.11 0.00 3.15 0.11 -0.62 -3.09 114.38 114.87 1nl3 h ARG 48 Ca 0.34 -0.19 0.00 0.00 0.10 0.00 0.00 59.98 60.24 1nl3 h ARG 48 Cb 0.28 0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.43 1nl3 h ARG 48 CO -0.12 1.02 0.00 0.00 0.10 0.00 0.00 179.97 180.97 1nl3 h ARG 49 N 0.03 0.00 0.00 0.08 3.08 -0.01 -2.32 114.38 115.25 1nl3 h ARG 49 Ca -0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1nl3 h ARG 49 Cb 1.89 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.94 1nl3 h ARG 49 CO 0.15 0.00 -0.44 -0.07 -1.07 0.00 0.00 179.97 178.54 1nl3 h LEU 50 N 0.00 0.00 0.00 3.04 3.38 -1.13 -3.26 115.31 117.34 1nl3 h LEU 50 Ca 0.00 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1nl3 h LEU 50 Cb 0.38 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 1nl3 h LEU 50 CO 0.00 0.05 -1.29 0.00 0.09 0.00 0.00 178.44 177.29 1nl3 n ALA 51 N -1.92 2.15 -1.88 1.53 0.00 -0.98 -4.77 120.51 114.63 1nl3 n ALA 51 Ca 0.03 -0.18 -0.42 0.00 0.00 0.00 0.00 53.44 52.87 1nl3 n ALA 51 Cb 0.47 -0.14 -0.03 0.00 0.00 0.00 0.00 19.45 19.75 1nl3 n ALA 51 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1nl3 s ASP 52 N -2.86 6.48 0.16 0.00 2.15 -0.91 -4.88 116.67 116.81 1nl3 s ASP 52 Ca -0.02 2.28 0.26 0.00 0.43 0.00 0.00 52.55 55.50 1nl3 s ASP 52 Cb 0.03 -2.53 0.66 0.00 -0.30 0.00 0.00 42.92 40.79 1nl3 s ASP 52 CO 0.24 -1.07 1.62 0.00 -0.17 0.00 0.00 175.17 175.78 1nl3 n GLN 53 N 7.43 0.25 -0.03 4.34 3.00 -1.26 -3.61 117.38 127.51 1nl3 n GLN 53 Ca 0.19 0.15 -0.13 0.00 -0.01 0.00 0.00 57.00 57.20 1nl3 n GLN 53 Cb 0.43 -1.74 -0.10 0.00 0.00 0.00 0.00 30.24 28.83 1nl3 n GLN 53 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.06 177.93 1nl3 h LYS 54 N 0.00 0.09 -2.54 -1.09 1.57 -2.01 -3.38 116.57 109.21 1nl3 h LYS 54 Ca 0.00 -0.06 -0.61 0.00 -1.87 0.00 0.00 60.65 58.12 1nl3 h LYS 54 Cb 0.72 0.01 -0.42 0.00 0.08 0.00 0.00 32.23 32.62 1nl3 h LYS 54 CO 0.00 0.64 -0.62 0.09 -0.57 0.00 0.00 179.45 178.99 1nl3 n ASN 55 N -4.73 3.20 -4.76 0.86 3.02 -1.24 -5.09 115.26 106.52 1nl3 n ASN 55 Ca -0.08 -3.29 -0.41 0.00 -0.03 0.00 0.00 54.58 50.76 1nl3 n ASN 55 Cb 0.32 -0.70 -0.02 0.00 -0.61 0.00 0.00 39.78 38.77 1nl3 n ASN 55 CO 0.00 0.00 0.00 -2.84 -2.62 0.00 0.00 177.26 171.80 1nl3 s PRO 56 N -1.96 4.34 0.05 3.52 0.02 -1.24 -4.89 135.00 134.84 1nl3 s PRO 56 Ca 0.34 2.22 0.04 0.00 0.02 0.00 0.00 61.00 63.61 1nl3 s PRO 56 Cb 0.07 -3.09 -0.02 0.00 0.02 0.00 0.00 34.50 31.47 1nl3 s PRO 56 CO -0.08 -0.25 -0.11 -1.21 -0.33 0.00 0.00 177.00 175.01 1nl3 s GLU 57 N -1.25 0.71 0.57 5.54 2.02 -1.23 -5.11 118.70 119.94 1nl3 s GLU 57 Ca 0.52 -0.77 0.07 0.00 0.02 0.00 0.00 54.97 54.82 1nl3 s GLU 57 Cb -0.40 -0.63 0.06 0.00 0.10 0.00 0.00 34.13 33.27 1nl3 s GLU 57 CO 0.49 0.14 0.56 0.95 0.02 0.00 0.00 175.26 177.42 1nl3 s THR 58 N -1.10 1.76 0.18 3.63 -4.23 -1.26 -4.58 115.64 110.04 1nl3 s THR 58 Ca -0.04 -1.31 -0.11 0.00 -1.18 0.00 0.00 61.69 59.06 1nl3 s THR 58 Cb -0.09 -2.07 0.08 0.00 1.34 0.00 0.00 72.50 71.77 1nl3 s THR 58 CO 0.01 0.00 1.72 -0.07 -0.54 0.00 0.00 174.62 175.74 1nl3 h LEU 59 N 0.50 0.90 -0.62 4.79 3.38 -1.98 -1.40 115.31 120.87 1nl3 h LEU 59 Ca -0.33 -0.20 0.08 0.00 0.09 0.00 0.00 57.88 57.52 1nl3 h LEU 59 Cb 1.30 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.75 1nl3 h LEU 59 CO 0.51 0.86 0.29 0.44 0.09 0.00 0.00 178.44 180.62 1nl3 h ASP 60 N 0.89 0.36 -0.71 -0.43 3.32 -2.00 -0.36 116.42 117.50 1nl3 h ASP 60 Ca 0.20 0.06 0.09 0.00 0.02 0.00 0.00 57.03 57.40 1nl3 h ASP 60 Cb 0.27 -0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.75 1nl3 h ASP 60 CO -0.01 0.22 0.36 0.44 -1.72 0.00 0.00 179.24 178.54 1nl3 h ASP 61 N 0.51 0.48 1.15 6.45 3.32 -1.81 -2.62 116.42 123.90 1nl3 h ASP 61 Ca 0.30 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.41 1nl3 h ASP 61 Cb 0.30 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.82 1nl3 h ASP 61 CO -0.25 0.28 -0.03 0.18 -1.72 0.00 0.00 179.24 177.71 1nl3 n LEU 62 N -4.85 0.31 0.00 1.55 4.77 -0.47 -4.41 117.00 113.90 1nl3 n LEU 62 Ca 0.11 0.51 -0.09 0.00 -0.03 0.00 0.00 56.01 56.50 1nl3 n LEU 62 Cb 0.26 -0.43 -0.03 0.00 -2.33 0.00 0.00 43.42 40.89 1nl3 n LEU 62 CO 0.25 -0.06 0.77 0.25 -1.33 0.00 0.00 177.39 177.28 1nl3 h LEU 63 N 0.00 -0.41 -0.17 2.23 6.46 -0.72 0.25 115.31 122.95 1nl3 h LEU 63 Ca 0.00 0.08 0.04 0.00 -0.12 0.00 0.00 57.88 57.88 1nl3 h LEU 63 Cb 0.59 0.20 -0.07 0.00 -0.73 0.00 0.00 40.66 40.65 1nl3 h LEU 63 CO 0.00 -0.18 -0.51 -0.65 -0.62 0.00 0.00 178.44 176.48 1nl3 h PRO 64 N -0.17 -0.52 -0.50 5.25 0.11 -1.79 -0.73 132.00 133.65 1nl3 h PRO 64 Ca 0.09 0.04 -0.05 0.00 0.11 0.00 0.00 66.00 66.18 1nl3 h PRO 64 Cb 0.29 0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.50 1nl3 h PRO 64 CO -0.22 -0.34 0.12 0.93 -0.21 0.00 0.00 178.00 178.28 1nl3 h GLU 65 N -0.53 0.81 -0.47 1.05 5.08 -1.73 -1.13 114.58 117.66 1nl3 h GLU 65 Ca 0.05 -0.20 -0.11 0.00 -1.00 0.00 0.00 59.36 58.11 1nl3 h GLU 65 Cb 0.66 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 1nl3 h GLU 65 CO -0.45 0.78 -0.12 0.00 -1.00 0.00 0.00 179.01 178.22 1nl3 h ALA 66 N 0.99 0.64 -0.57 3.43 0.00 -0.30 -0.92 119.26 122.53 1nl3 h ALA 66 Ca 0.16 -0.34 0.03 0.00 0.00 0.00 0.00 54.91 54.75 1nl3 h ALA 66 Cb 0.34 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1nl3 h ALA 66 CO 0.00 0.55 0.35 0.74 0.00 0.00 0.00 179.25 180.89 1nl3 h PHE 67 N 0.75 0.65 -0.22 0.00 -1.00 -1.06 0.25 116.94 116.31 1nl3 h PHE 67 Ca 0.12 0.02 0.04 0.00 2.81 0.00 0.00 57.97 60.96 1nl3 h PHE 67 Cb 0.67 -0.21 -0.04 0.00 3.61 0.00 0.00 35.95 39.98 1nl3 h PHE 67 CO 0.05 0.37 -0.03 0.00 -1.61 0.00 0.00 178.31 177.09 1nl3 h ALA 68 N 1.25 0.16 -0.52 2.45 0.00 -0.89 0.10 119.26 121.82 1nl3 h ALA 68 Ca 0.23 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.22 1nl3 h ALA 68 Cb 0.02 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1nl3 h ALA 68 CO -0.10 -0.46 0.34 0.28 0.00 0.00 0.00 179.25 179.32 1nl3 h VAL 69 N 0.03 1.13 -0.31 0.00 2.07 -0.62 -0.85 116.25 117.69 1nl3 h VAL 69 Ca 0.10 -0.24 -0.12 0.00 0.82 0.00 0.00 66.70 67.26 1nl3 h VAL 69 Cb 0.15 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 1nl3 h VAL 69 CO -0.20 0.13 -0.31 0.00 0.02 0.00 0.00 177.57 177.20 1nl3 h ALA 70 N 1.20 0.87 -0.27 1.67 0.00 -0.25 -1.25 119.26 121.23 1nl3 h ALA 70 Ca 0.19 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 1nl3 h ALA 70 Cb -0.07 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1nl3 h ALA 70 CO -0.05 0.63 0.01 -0.09 0.00 0.00 0.00 179.25 179.75 1nl3 h ARG 71 N 0.57 0.48 -0.49 0.00 2.43 -0.51 -0.25 114.38 116.61 1nl3 h ARG 71 Ca 0.07 -0.15 -0.12 0.00 -0.81 0.00 0.00 59.98 58.96 1nl3 h ARG 71 Cb 0.81 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.31 1nl3 h ARG 71 CO 0.07 0.63 -0.19 1.49 -1.51 0.00 0.00 179.97 180.47 1nl3 h GLU 72 N 0.27 0.97 0.10 0.20 4.57 -1.06 -1.83 114.58 117.80 1nl3 h GLU 72 Ca 0.08 -0.40 0.01 0.00 -1.18 0.00 0.00 59.36 57.88 1nl3 h GLU 72 Cb 0.41 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.94 1nl3 h GLU 72 CO 0.01 1.07 -0.17 0.00 -1.18 0.00 0.00 179.01 178.74 1nl3 h ALA 73 N 0.93 -0.29 -0.88 2.92 0.00 -1.04 -0.69 119.26 120.22 1nl3 h ALA 73 Ca 0.12 -0.03 0.20 0.00 0.00 0.00 0.00 54.91 55.20 1nl3 h ALA 73 Cb 0.75 0.27 -0.12 0.00 0.00 0.00 0.00 17.79 18.70 1nl3 h ALA 73 CO 0.06 -0.70 0.40 0.00 0.00 0.00 0.00 179.25 179.02 1nl3 h ALA 74 N 0.50 1.38 0.04 0.00 0.00 -0.78 0.74 119.26 121.14 1nl3 h ALA 74 Ca 0.02 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1nl3 h ALA 74 Cb 0.35 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1nl3 h ALA 74 CO -0.09 -0.27 -0.02 2.35 0.00 0.00 0.00 179.25 181.22 1nl3 h TRP 75 N 0.46 -0.05 -0.26 0.00 2.91 -0.57 -0.19 115.95 118.26 1nl3 h TRP 75 Ca 0.53 -0.00 -0.06 0.00 1.13 0.00 0.00 58.89 60.49 1nl3 h TRP 75 Cb 0.94 0.02 -0.02 0.00 -0.51 0.00 0.00 29.16 29.59 1nl3 h TRP 75 CO -0.12 0.22 -0.08 0.00 -1.03 0.00 0.00 178.44 177.42 1nl3 h ARG 76 N -0.32 0.42 0.02 2.65 3.08 -0.42 0.39 114.38 120.19 1nl3 h ARG 76 Ca -0.01 -0.10 -0.23 0.00 0.07 0.00 0.00 59.98 59.71 1nl3 h ARG 76 Cb 0.29 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 1nl3 h ARG 76 CO 0.01 0.51 -1.27 0.28 -1.07 0.00 0.00 179.97 178.44 1nl3 h VAL 77 N 0.40 0.94 0.00 2.04 2.07 -0.78 -3.39 116.25 117.52 1nl3 h VAL 77 Ca 0.08 -2.21 0.00 0.00 0.82 0.00 0.00 66.70 65.39 1nl3 h VAL 77 Cb 0.40 2.32 0.00 0.00 -1.52 0.00 0.00 31.29 32.49 1nl3 h VAL 77 CO 0.02 0.39 -1.11 0.18 0.02 0.00 0.00 177.57 177.08 1nl3 n LEU 78 N -4.34 0.59 -1.03 2.57 4.77 -0.09 -4.91 117.00 114.56 1nl3 n LEU 78 Ca -0.31 0.05 -0.11 0.00 -0.03 0.00 0.00 56.01 55.61 1nl3 n LEU 78 Cb 0.71 -0.08 -0.03 0.00 -2.33 0.00 0.00 43.42 41.69 1nl3 n LEU 78 CO 0.22 -0.00 -0.12 0.47 -1.33 0.00 0.00 177.39 176.63 1nl3 n ASP 79 N -2.12 -4.08 -3.88 -1.43 8.00 0.13 -5.01 116.55 108.15 1nl3 n ASP 79 Ca 0.01 0.16 -0.27 0.00 0.71 0.00 0.00 54.79 55.41 1nl3 n ASP 79 Cb 0.47 -2.86 -0.17 0.00 -0.02 0.00 0.00 41.12 38.54 1nl3 n ASP 79 CO 0.00 0.00 0.00 -1.58 -0.39 0.00 0.00 177.20 175.23 1nl3 s GLN 80 N -3.60 1.37 -0.29 -1.24 2.00 -1.23 -4.99 119.66 111.69 1nl3 s GLN 80 Ca 0.00 -0.28 -0.12 0.00 -2.00 0.00 0.00 55.36 52.96 1nl3 s GLN 80 Cb 0.00 -1.63 -0.04 0.00 0.80 0.00 0.00 33.01 32.14 1nl3 s GLN 80 CO 0.00 -0.32 0.25 0.50 -0.50 0.00 0.00 175.29 175.22 1nl3 s ARG 81 N 1.73 3.91 -0.03 1.67 3.52 -1.26 -2.72 118.95 125.77 1nl3 s ARG 81 Ca 0.04 -0.25 -0.38 0.00 -0.13 0.00 0.00 55.73 55.00 1nl3 s ARG 81 Cb -0.13 -3.68 -0.17 0.00 -1.56 0.00 0.00 34.95 29.41 1nl3 s ARG 81 CO -0.08 -0.25 1.42 -2.30 -0.81 0.00 0.00 175.30 173.29 1nl3 n PRO 82 N 5.15 1.00 -1.20 5.12 -0.02 -1.26 -4.96 135.00 138.83 1nl3 n PRO 82 Ca -0.12 0.36 -0.30 0.00 -2.02 0.00 0.00 63.50 61.43 1nl3 n PRO 82 Cb 0.51 -2.00 0.14 0.00 -0.02 0.00 0.00 33.50 32.13 1nl3 n PRO 82 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1nl3 s PHE 83 N 1.27 2.31 0.21 6.00 0.08 -1.26 -4.86 117.98 121.73 1nl3 s PHE 83 Ca 0.89 1.26 -0.09 0.00 0.12 0.00 0.00 56.93 59.11 1nl3 s PHE 83 Cb -1.03 -3.16 0.26 0.00 -0.57 0.00 0.00 43.02 38.52 1nl3 s PHE 83 CO 0.54 -2.40 1.79 -0.44 -0.10 0.00 0.00 175.22 174.61 1nl3 h ASP 84 N -1.55 0.49 0.38 1.36 3.32 -1.97 0.11 116.42 118.56 1nl3 h ASP 84 Ca -0.49 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 56.59 1nl3 h ASP 84 Cb 1.28 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.78 1nl3 h ASP 84 CO 0.54 0.31 -0.02 -0.37 -1.72 0.00 0.00 179.24 177.99 1nl3 h VAL 85 N 0.63 0.10 -0.03 -1.35 -1.51 -1.93 -0.64 116.25 111.52 1nl3 h VAL 85 Ca 0.31 -0.24 -0.24 0.00 -1.23 0.00 0.00 66.70 65.30 1nl3 h VAL 85 Cb 0.24 1.21 0.01 0.00 -2.13 0.00 0.00 31.29 30.63 1nl3 h VAL 85 CO -0.21 0.02 -0.93 1.56 -1.23 0.00 0.00 177.57 176.77 1nl3 h GLN 86 N 0.00 0.58 -0.18 5.19 4.20 -1.13 -2.85 115.11 120.93 1nl3 h GLN 86 Ca -0.00 -0.59 -0.11 0.00 0.06 0.00 0.00 58.65 58.02 1nl3 h GLN 86 Cb 0.21 0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 1nl3 h GLN 86 CO 0.00 1.20 -0.35 0.28 -0.67 0.00 0.00 178.83 179.29 1nl3 h VAL 87 N 0.35 1.29 0.78 -0.54 2.07 -0.49 0.11 116.25 119.82 1nl3 h VAL 87 Ca -0.09 -1.43 -0.04 0.00 0.82 0.00 0.00 66.70 65.97 1nl3 h VAL 87 Cb 1.57 1.54 0.01 0.00 -1.52 0.00 0.00 31.29 32.89 1nl3 h VAL 87 CO 0.18 0.44 -0.37 0.24 0.02 0.00 0.00 177.57 178.07 1nl3 h MET 88 N 0.31 -1.01 -0.91 1.57 2.86 -1.28 -1.44 114.93 115.03 1nl3 h MET 88 Ca 0.04 0.07 0.17 0.00 -2.06 0.00 0.00 59.70 57.91 1nl3 h MET 88 Cb 0.77 0.23 -0.07 0.00 0.06 0.00 0.00 31.60 32.59 1nl3 h MET 88 CO 0.06 -0.66 0.59 0.78 1.06 0.00 0.00 176.91 178.73 1nl3 h GLY 89 N -1.11 1.18 0.94 8.32 0.00 -1.24 -0.98 103.07 110.18 1nl3 h GLY 89 Ca -0.11 -0.27 -0.02 0.00 0.00 0.00 0.00 47.33 46.93 1nl3 h GLY 89 CO 0.18 0.04 -0.24 0.00 0.00 0.00 0.00 176.54 176.52 1nl3 h ALA 90 N 1.61 -0.63 -0.46 3.60 0.00 -0.46 -1.57 119.26 121.35 1nl3 h ALA 90 Ca 0.47 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.35 1nl3 h ALA 90 Cb 0.88 0.28 -0.09 0.00 0.00 0.00 0.00 17.79 18.86 1nl3 h ALA 90 CO -0.22 -0.86 -0.18 0.00 0.00 0.00 0.00 179.25 177.99 1nl3 h ALA 91 N -0.08 0.19 -0.97 0.00 0.00 -0.13 -0.57 119.26 117.70 1nl3 h ALA 91 Ca -0.05 0.17 0.17 0.00 0.00 0.00 0.00 54.91 55.19 1nl3 h ALA 91 Cb 0.50 0.46 -0.10 0.00 0.00 0.00 0.00 17.79 18.66 1nl3 h ALA 91 CO 0.07 -0.52 0.58 0.00 0.00 0.00 0.00 179.25 179.38 1nl3 h ALA 92 N 1.29 1.55 -0.00 0.00 0.00 -1.10 -0.08 119.26 120.92 1nl3 h ALA 92 Ca 0.22 0.07 -0.20 0.00 0.00 0.00 0.00 54.91 55.00 1nl3 h ALA 92 Cb 0.42 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1nl3 h ALA 92 CO -0.52 -0.00 -0.87 -0.07 0.00 0.00 0.00 179.25 177.79 1nl3 h LEU 93 N 0.78 0.29 -1.15 0.00 3.38 -0.22 -2.03 115.31 116.36 1nl3 h LEU 93 Ca 0.54 -0.23 -0.05 0.00 0.09 0.00 0.00 57.88 58.23 1nl3 h LEU 93 Cb 0.76 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 1nl3 h LEU 93 CO -0.36 1.03 0.07 -0.74 0.09 0.00 0.00 178.44 178.53 1nl3 h HIS 94 N 0.13 0.68 0.00 1.13 2.76 -0.21 -2.44 115.15 117.20 1nl3 h HIS 94 Ca -0.05 -0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.06 1nl3 h HIS 94 Cb 1.49 -0.20 0.00 0.00 1.55 0.00 0.00 27.41 30.25 1nl3 h HIS 94 CO 0.03 0.61 0.00 1.28 -1.30 0.00 0.00 177.93 178.55 1nl3 n LEU 95 N -4.28 0.13 -0.61 0.26 4.77 -0.13 -4.88 117.00 112.25 1nl3 n LEU 95 Ca 0.03 -0.06 -0.06 0.00 -0.03 0.00 0.00 56.01 55.88 1nl3 n LEU 95 Cb 0.23 -0.06 -0.01 0.00 -2.33 0.00 0.00 43.42 41.24 1nl3 n LEU 95 CO 0.39 0.03 -0.07 0.61 -1.33 0.00 0.00 177.39 177.02 1nl3 n GLY 96 N 0.28 0.37 3.74 -0.72 0.00 -0.92 -5.04 105.19 102.90 1nl3 n GLY 96 Ca 0.00 -0.69 -0.23 0.00 0.00 0.00 0.00 46.02 45.10 1nl3 n GLY 96 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nl3 s ASN 97 N -2.80 4.61 -0.24 1.61 0.01 -0.78 -4.54 114.94 112.81 1nl3 s ASN 97 Ca 0.00 -0.86 -0.27 0.00 -0.71 0.00 0.00 52.86 51.01 1nl3 s ASN 97 Cb 0.00 -0.64 0.01 0.00 0.41 0.00 0.00 41.25 41.02 1nl3 s ASN 97 CO 0.00 -0.38 0.97 -0.69 -1.51 0.00 0.00 177.10 175.49 1nl3 s VAL 98 N -2.48 4.72 -0.47 1.60 1.01 0.45 -2.97 120.40 122.26 1nl3 s VAL 98 Ca 0.39 1.84 -0.22 0.00 0.00 0.00 0.00 61.98 64.00 1nl3 s VAL 98 Cb -0.01 -4.25 0.03 0.00 0.00 0.00 0.00 36.38 32.15 1nl3 s VAL 98 CO 0.23 -0.17 0.72 0.00 0.00 0.00 0.00 175.10 175.88 1nl3 s ALA 99 N 3.11 3.31 -0.51 5.51 0.00 0.32 -0.96 121.76 132.55 1nl3 s ALA 99 Ca 0.41 -1.24 -0.28 0.00 0.00 0.00 0.00 51.96 50.84 1nl3 s ALA 99 Cb -0.15 -3.42 0.03 0.00 0.00 0.00 0.00 23.12 19.59 1nl3 s ALA 99 CO 0.07 -1.94 1.14 -2.00 0.00 0.00 0.00 175.76 173.03 1nl3 s GLU 100 N 3.07 3.64 -0.13 0.00 2.12 0.39 -3.12 118.70 124.68 1nl3 s GLU 100 Ca 0.24 0.43 0.01 0.00 0.36 0.00 0.00 54.97 56.01 1nl3 s GLU 100 Cb -0.14 -3.94 0.02 0.00 0.26 0.00 0.00 34.13 30.33 1nl3 s GLU 100 CO 0.19 -1.46 -0.14 -1.64 -0.54 0.00 0.00 175.26 171.67 1nl3 s MET 101 N 4.54 2.19 0.76 4.30 -1.94 0.32 -1.38 119.30 128.08 1nl3 s MET 101 Ca 0.45 -0.53 -0.14 0.00 -1.71 0.00 0.00 55.69 53.77 1nl3 s MET 101 Cb -0.07 -1.96 0.06 0.00 2.01 0.00 0.00 34.83 34.86 1nl3 s MET 101 CO 0.30 -0.16 1.17 0.15 -0.01 0.00 0.00 175.02 176.47 1nl3 s LYS 102 N 1.28 2.00 0.19 2.03 -0.14 -1.26 -2.53 119.74 121.31 1nl3 s LYS 102 Ca -0.00 1.63 -0.33 0.00 -1.36 0.00 0.00 55.97 55.91 1nl3 s LYS 102 Cb -0.14 -1.83 -0.13 0.00 -1.68 0.00 0.00 37.83 34.05 1nl3 s LYS 102 CO -0.06 -1.91 1.67 2.41 -0.76 0.00 0.00 175.35 176.69 1nl3 n THR 103 N -3.05 0.01 -0.66 2.17 -1.04 -1.26 -1.48 114.28 108.97 1nl3 n THR 103 Ca 0.12 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.13 1nl3 n THR 103 Cb 0.51 -1.81 0.00 0.00 -1.82 0.00 0.00 70.33 67.21 1nl3 n THR 103 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1nl3 n GLY 104 N 3.75 0.59 0.17 3.41 0.00 -1.26 -4.64 105.19 107.21 1nl3 n GLY 104 Ca 0.16 -0.70 0.11 0.00 0.00 0.00 0.00 46.02 45.59 1nl3 n GLY 104 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nl3 n GLU 105 N -2.66 0.44 -0.57 1.61 -0.58 -0.55 -4.33 120.64 113.99 1nl3 n GLU 105 Ca 0.00 -0.35 0.00 0.00 -0.42 0.00 0.00 57.16 56.39 1nl3 n GLU 105 Cb 0.00 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.38 1nl3 n GLU 105 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1nl3 n GLY 106 N 1.46 1.48 0.18 0.62 0.00 -1.26 -4.84 105.19 102.84 1nl3 n GLY 106 Ca 0.06 -0.24 -0.05 0.00 0.00 0.00 0.00 46.02 45.79 1nl3 n GLY 106 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1nl3 n LYS 107 N -0.90 -0.19 -0.35 1.61 4.81 -1.26 -0.76 118.16 121.11 1nl3 n LYS 107 Ca 0.00 0.71 0.02 0.00 -0.87 0.00 0.00 58.31 58.17 1nl3 n LYS 107 Cb 0.14 -1.05 0.16 0.00 0.02 0.00 0.00 35.03 34.31 1nl3 n LYS 107 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 1nl3 h THR 108 N 0.00 1.06 0.08 3.15 2.02 -1.99 -2.12 112.91 115.12 1nl3 h THR 108 Ca 0.07 -0.37 -0.16 0.00 0.77 0.00 0.00 66.41 66.72 1nl3 h THR 108 Cb 0.18 -0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.47 1nl3 h THR 108 CO -0.41 0.20 -0.77 0.25 0.37 0.00 0.00 175.52 175.15 1nl3 h LEU 109 N 1.09 0.27 -1.00 2.58 5.85 -1.54 -3.35 115.31 119.22 1nl3 h LEU 109 Ca 0.41 -0.90 0.09 0.00 0.84 0.00 0.00 57.88 58.33 1nl3 h LEU 109 Cb 0.18 -0.09 -0.12 0.00 0.37 0.00 0.00 40.66 41.00 1nl3 h LEU 109 CO -0.18 1.35 -0.58 0.41 -0.34 0.00 0.00 178.44 179.10 1nl3 n THR 110 N -4.24 -0.67 -0.13 1.05 -1.04 0.06 -0.08 114.28 109.22 1nl3 n THR 110 Ca -0.17 2.41 0.10 0.00 -2.04 0.00 0.00 64.05 64.35 1nl3 n THR 110 Cb 0.73 -2.99 0.19 0.00 -1.82 0.00 0.00 70.33 66.45 1nl3 n THR 110 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nl3 h VAL 112 N 0.00 0.98 0.90 0.00 2.07 -0.63 -2.10 116.25 117.47 1nl3 h VAL 112 Ca 0.30 -0.31 -0.04 0.00 0.82 0.00 0.00 66.70 67.47 1nl3 h VAL 112 Cb 0.76 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 1nl3 h VAL 112 CO -0.33 0.17 -0.49 -0.07 0.02 0.00 0.00 177.57 176.86 1nl3 h LEU 113 N 0.91 -1.21 -1.84 2.57 4.07 -1.27 0.05 115.31 118.58 1nl3 h LEU 113 Ca 0.40 0.06 -0.02 0.00 0.08 0.00 0.00 57.88 58.39 1nl3 h LEU 113 Cb 0.28 0.34 -0.00 0.00 1.08 0.00 0.00 40.66 42.36 1nl3 h LEU 113 CO -0.21 -0.79 -0.11 1.55 -1.08 0.00 0.00 178.44 177.80 1nl3 h PRO 114 N -1.29 0.00 -0.13 1.13 0.13 -1.73 -1.83 132.00 128.28 1nl3 h PRO 114 Ca -0.12 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.96 1nl3 h PRO 114 Cb 1.01 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.14 1nl3 h PRO 114 CO 0.16 0.11 -0.11 0.00 -0.23 0.00 0.00 178.00 177.93 1nl3 h ALA 115 N 1.89 0.19 0.23 -0.56 0.00 -1.03 -2.26 119.26 117.72 1nl3 h ALA 115 Ca -0.00 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.62 1nl3 h ALA 115 Cb 0.20 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1nl3 h ALA 115 CO 0.01 0.03 -0.31 -0.92 0.00 0.00 0.00 179.25 178.06 1nl3 h TYR 116 N -0.07 -0.83 0.06 0.00 3.20 -0.87 -1.18 116.97 117.28 1nl3 h TYR 116 Ca 0.02 0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.93 1nl3 h TYR 116 Cb 0.61 0.34 -0.04 0.00 1.54 0.00 0.00 36.73 39.18 1nl3 h TYR 116 CO 0.08 -0.43 -0.26 1.25 -1.64 0.00 0.00 178.16 177.15 1nl3 h LEU 117 N -0.60 -0.77 -1.44 2.82 5.85 -1.33 -1.73 115.31 118.12 1nl3 h LEU 117 Ca 0.00 0.10 -0.05 0.00 0.84 0.00 0.00 57.88 58.77 1nl3 h LEU 117 Cb 0.58 0.30 -0.01 0.00 0.37 0.00 0.00 40.66 41.90 1nl3 h LEU 117 CO -0.11 -0.34 -0.22 0.78 -0.34 0.00 0.00 178.44 178.21 1nl3 h ASN 118 N -0.44 0.00 0.45 1.25 4.21 -1.46 -2.66 115.58 116.93 1nl3 h ASN 118 Ca 0.05 0.00 -0.04 0.00 1.21 0.00 0.00 56.30 57.51 1nl3 h ASN 118 Cb 0.50 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.69 1nl3 h ASN 118 CO -0.19 0.22 -0.21 0.00 -1.29 0.00 0.00 177.43 175.96 1nl3 h ALA 119 N 1.78 1.29 -0.57 -0.83 0.00 -0.28 -2.67 119.26 117.97 1nl3 h ALA 119 Ca -0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1nl3 h ALA 119 Cb 0.59 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1nl3 h ALA 119 CO 0.03 0.26 0.26 -0.07 0.00 0.00 0.00 179.25 179.73 1nl3 h LEU 120 N 0.00 0.73 -1.98 0.00 3.38 -1.19 -1.90 115.31 114.34 1nl3 h LEU 120 Ca -0.00 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1nl3 h LEU 120 Cb 0.49 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1nl3 h LEU 120 CO 0.03 0.63 0.30 0.00 0.09 0.00 0.00 178.44 179.48 1nl3 h ALA 121 N 1.49 1.29 0.00 1.53 0.00 -1.63 -3.46 119.26 118.47 1nl3 h ALA 121 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1nl3 h ALA 121 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1nl3 h ALA 121 CO -0.02 -0.29 0.00 0.41 0.00 0.00 0.00 179.25 179.35 1nl3 n GLY 122 N -1.21 0.44 0.44 0.00 0.00 -0.72 -4.97 105.19 99.17 1nl3 n GLY 122 Ca -0.02 -0.98 0.07 0.00 0.00 0.00 0.00 46.02 45.08 1nl3 n GLY 122 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1nl3 n ASN 123 N 1.79 1.83 0.00 1.61 5.03 -1.26 -5.09 115.26 119.17 1nl3 n ASN 123 Ca 0.00 -1.41 0.00 0.00 0.87 0.00 0.00 54.58 54.04 1nl3 n ASN 123 Cb 0.00 0.22 0.00 0.00 -1.02 0.00 0.00 39.78 38.98 1nl3 n ASN 123 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1nl3 n GLY 124 N 0.90 2.54 3.04 7.41 0.00 -1.26 -4.83 105.19 113.00 1nl3 n GLY 124 Ca 0.07 -1.68 -0.25 0.00 0.00 0.00 0.00 46.02 44.16 1nl3 n GLY 124 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nl3 s VAL 125 N -1.66 1.17 -0.17 1.61 1.01 -1.07 -4.24 120.40 117.05 1nl3 s VAL 125 Ca 0.00 -0.52 -0.08 0.00 0.00 0.00 0.00 61.98 61.39 1nl3 s VAL 125 Cb 0.00 -1.05 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 1nl3 s VAL 125 CO 0.00 0.36 0.09 -1.00 0.00 0.00 0.00 175.10 174.55 1nl3 s HIS 126 N 0.52 3.37 -0.26 5.22 3.76 0.77 -0.70 115.29 127.97 1nl3 s HIS 126 Ca -0.12 0.26 -0.02 0.00 -0.15 0.00 0.00 55.06 55.04 1nl3 s HIS 126 Cb -0.15 -2.05 0.03 0.00 1.11 0.00 0.00 32.58 31.52 1nl3 s HIS 126 CO 0.03 0.35 -0.05 0.42 -0.85 0.00 0.00 174.74 174.65 1nl3 s ILE 127 N -0.05 2.91 -0.25 0.60 -1.09 0.11 -0.28 121.20 123.16 1nl3 s ILE 127 Ca 0.08 -1.06 -0.12 0.00 -2.23 0.00 0.00 60.65 57.32 1nl3 s ILE 127 Cb -0.12 -2.51 -0.05 0.00 -1.58 0.00 0.00 42.46 38.21 1nl3 s ILE 127 CO 0.00 0.16 0.21 -0.69 -1.23 0.00 0.00 174.94 173.39 1nl3 s VAL 128 N 1.32 5.31 0.39 2.92 1.01 0.00 -1.88 120.40 129.48 1nl3 s VAL 128 Ca -0.01 0.27 0.08 0.00 0.00 0.00 0.00 61.98 62.32 1nl3 s VAL 128 Cb -0.17 -3.55 -0.07 0.00 0.00 0.00 0.00 36.38 32.59 1nl3 s VAL 128 CO -0.04 0.29 0.05 0.42 0.00 0.00 0.00 175.10 175.83 1nl3 s THR 129 N 1.38 2.24 0.08 3.92 -4.23 0.45 -0.25 115.64 119.23 1nl3 s THR 129 Ca 0.09 -1.92 0.15 0.00 -1.18 0.00 0.00 61.69 58.84 1nl3 s THR 129 Cb -0.15 -2.93 0.06 0.00 1.34 0.00 0.00 72.50 70.82 1nl3 s THR 129 CO 0.07 -0.06 1.58 0.58 -0.54 0.00 0.00 174.62 176.26 1nl3 h VAL 130 N 1.69 1.03 -3.60 2.29 2.07 -1.86 -3.34 116.25 114.53 1nl3 h VAL 130 Ca -0.43 -2.01 -0.05 0.00 0.82 0.00 0.00 66.70 65.03 1nl3 h VAL 130 Cb 1.25 2.20 -0.10 0.00 -1.52 0.00 0.00 31.29 33.12 1nl3 h VAL 130 CO 0.74 0.50 -0.12 0.54 0.02 0.00 0.00 177.57 179.25 1nl3 s ASN 131 N -6.51 -0.11 0.30 0.57 2.20 -1.26 -4.94 114.94 105.19 1nl3 s ASN 131 Ca 0.01 -0.79 -0.01 0.00 -0.94 0.00 0.00 52.86 51.14 1nl3 s ASN 131 Cb 0.10 0.55 0.49 0.00 -2.00 0.00 0.00 41.25 40.39 1nl3 s ASN 131 CO 0.73 -1.07 1.95 0.44 -2.94 0.00 0.00 177.10 176.20 1nl3 h ASP 132 N 2.30 0.92 -0.33 3.54 5.19 -1.94 -1.22 116.42 124.88 1nl3 h ASP 132 Ca -0.28 -0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.11 1nl3 h ASP 132 Cb 1.25 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 40.53 1nl3 h ASP 132 CO 0.38 0.64 0.18 0.22 -3.12 0.00 0.00 179.24 177.54 1nl3 h TYR 133 N 1.07 0.45 -0.07 4.55 3.20 -1.99 -1.21 116.97 122.98 1nl3 h TYR 133 Ca 0.34 -0.01 -0.12 0.00 3.14 0.00 0.00 58.73 62.08 1nl3 h TYR 133 Cb 0.01 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.12 1nl3 h TYR 133 CO -0.00 0.36 -0.48 -0.07 -1.64 0.00 0.00 178.16 176.33 1nl3 h LEU 134 N 0.41 0.19 0.19 2.82 3.38 -1.84 -0.79 115.31 119.67 1nl3 h LEU 134 Ca 0.12 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1nl3 h LEU 134 Cb 0.06 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1nl3 h LEU 134 CO -0.02 0.64 -0.09 0.00 0.09 0.00 0.00 178.44 179.06 1nl3 h ALA 135 N 1.37 -0.26 -0.54 1.53 0.00 -0.85 0.24 119.26 120.76 1nl3 h ALA 135 Ca 0.01 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.79 1nl3 h ALA 135 Cb 0.90 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.74 1nl3 h ALA 135 CO 0.07 -0.48 0.28 -0.22 0.00 0.00 0.00 179.25 178.90 1nl3 h LYS 136 N -0.58 0.52 0.43 0.00 3.64 -1.21 -0.10 116.57 119.27 1nl3 h LYS 136 Ca -0.03 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 1nl3 h LYS 136 Cb 0.43 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.14 1nl3 h LYS 136 CO 0.04 0.34 -0.20 -0.09 -2.27 0.00 0.00 179.45 177.27 1nl3 h ARG 137 N 0.54 -0.55 -0.63 1.90 2.43 -1.06 -1.52 114.38 115.49 1nl3 h ARG 137 Ca 0.24 0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.42 1nl3 h ARG 137 Cb 0.14 0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.79 1nl3 h ARG 137 CO -0.16 -0.33 0.27 -0.44 -1.51 0.00 0.00 179.97 177.80 1nl3 h ASP 138 N -0.65 0.82 -0.75 -3.80 3.32 -0.80 0.16 116.42 114.72 1nl3 h ASP 138 Ca -0.06 -0.10 -0.04 0.00 0.02 0.00 0.00 57.03 56.86 1nl3 h ASP 138 Cb 0.48 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.79 1nl3 h ASP 138 CO 0.10 0.72 0.33 0.77 -1.72 0.00 0.00 179.24 179.43 1nl3 h SER 139 N 0.89 1.01 0.03 6.45 4.64 -0.87 0.37 113.55 126.07 1nl3 h SER 139 Ca 0.21 -0.16 -0.22 0.00 -0.47 0.00 0.00 61.79 61.16 1nl3 h SER 139 Cb 0.14 -0.26 0.02 0.00 -0.31 0.00 0.00 62.40 61.99 1nl3 h SER 139 CO -0.02 0.89 -0.87 -0.33 -0.87 0.00 0.00 176.83 175.62 1nl3 h GLU 140 N 1.07 0.54 0.93 4.77 5.08 -0.71 -1.08 114.58 125.19 1nl3 h GLU 140 Ca 0.25 -0.62 -0.05 0.00 -1.00 0.00 0.00 59.36 57.95 1nl3 h GLU 140 Cb 0.17 0.18 0.01 0.00 0.50 0.00 0.00 28.75 29.61 1nl3 h GLU 140 CO -0.03 1.24 -0.45 2.35 -1.00 0.00 0.00 179.01 181.12 1nl3 h TRP 141 N 0.11 -1.16 0.00 4.33 2.91 -0.64 -3.22 115.95 118.28 1nl3 h TRP 141 Ca -0.12 -0.03 -0.19 0.00 1.13 0.00 0.00 58.89 59.69 1nl3 h TRP 141 Cb 1.57 0.38 -0.03 0.00 -0.51 0.00 0.00 29.16 30.57 1nl3 h TRP 141 CO 0.13 -0.72 -1.09 0.52 -1.03 0.00 0.00 178.44 176.25 1nl3 h MET 142 N -1.27 0.00 0.00 2.65 2.86 -1.07 -3.13 114.93 114.97 1nl3 h MET 142 Ca -0.13 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.51 1nl3 h MET 142 Cb 0.96 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.62 1nl3 h MET 142 CO 0.21 0.62 0.21 0.78 1.06 0.00 0.00 176.91 179.80 1nl3 h GLY 143 N 3.38 0.00 0.94 8.32 0.00 -1.25 0.24 103.07 114.69 1nl3 h GLY 143 Ca -0.09 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 1nl3 h GLY 143 CO 0.09 0.00 -0.10 3.21 0.00 0.00 0.00 176.54 179.73 1nl3 h ARG 144 N 0.00 -0.27 -0.39 4.80 3.08 -1.55 0.11 114.38 120.16 1nl3 h ARG 144 Ca 0.00 0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 1nl3 h ARG 144 Cb 0.43 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.52 1nl3 h ARG 144 CO 0.00 -0.13 0.23 0.28 -1.07 0.00 0.00 179.97 179.27 1nl3 h VAL 145 N -0.35 1.13 -0.66 2.04 2.07 -0.75 -0.17 116.25 119.56 1nl3 h VAL 145 Ca -0.03 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.16 1nl3 h VAL 145 Cb 0.27 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 1nl3 h VAL 145 CO 0.05 0.13 0.36 0.45 0.02 0.00 0.00 177.57 178.58 1nl3 h HIS 146 N 0.50 0.90 -0.46 1.57 3.86 -1.50 -2.93 115.15 117.10 1nl3 h HIS 146 Ca 0.14 -0.02 -0.07 0.00 -1.16 0.00 0.00 60.37 59.25 1nl3 h HIS 146 Cb 0.02 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.18 1nl3 h HIS 146 CO -0.03 0.64 -0.01 0.00 0.86 0.00 0.00 177.93 179.39 1nl3 h ARG 147 N 0.90 0.81 -0.27 2.45 3.08 -0.52 -1.44 114.38 119.39 1nl3 h ARG 147 Ca 0.23 -0.26 0.08 0.00 0.07 0.00 0.00 59.98 60.10 1nl3 h ARG 147 Cb 0.04 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1nl3 h ARG 147 CO -0.04 0.87 0.36 0.35 -1.07 0.00 0.00 179.97 180.45 1nl3 h PHE 148 N 0.65 0.00 -0.56 3.04 3.04 -0.90 -1.31 116.94 120.89 1nl3 h PHE 148 Ca 0.13 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.08 1nl3 h PHE 148 Cb 0.51 0.00 0.00 0.00 2.56 0.00 0.00 35.95 39.02 1nl3 h PHE 148 CO 0.04 0.00 0.00 1.28 -2.02 0.00 0.00 178.31 177.61 1nl3 n LEU 149 N -3.53 4.09 0.00 0.59 4.77 -0.62 -4.69 117.00 117.62 1nl3 n LEU 149 Ca 0.04 -2.30 0.00 0.00 -0.03 0.00 0.00 56.01 53.72 1nl3 n LEU 149 Cb 0.50 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 1nl3 n LEU 149 CO 0.24 0.82 0.00 0.61 -1.33 0.00 0.00 177.39 177.73 1nl3 n GLY 150 N 0.95 3.23 3.84 -0.72 0.00 -0.50 -4.61 105.19 107.39 1nl3 n GLY 150 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.93 1nl3 n GLY 150 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nl3 s LEU 151 N 0.00 3.26 -0.17 0.99 1.43 -0.75 -4.95 118.68 118.49 1nl3 s LEU 151 Ca 0.00 1.55 -0.05 0.00 -1.03 0.00 0.00 54.13 54.60 1nl3 s LEU 151 Cb 0.00 -4.49 -0.03 0.00 0.03 0.00 0.00 46.19 41.70 1nl3 s LEU 151 CO 0.00 -1.09 -0.01 -1.58 0.23 0.00 0.00 176.35 173.90 1nl3 s GLN 152 N -4.91 3.70 -0.07 1.70 0.74 -1.26 -3.64 119.66 115.92 1nl3 s GLN 152 Ca 0.57 -0.50 0.02 0.00 0.05 0.00 0.00 55.36 55.51 1nl3 s GLN 152 Cb -0.12 -3.01 -0.03 0.00 1.10 0.00 0.00 33.01 30.95 1nl3 s GLN 152 CO 0.50 0.18 -0.12 0.08 -0.55 0.00 0.00 175.29 175.38 1nl3 s VAL 153 N 0.56 3.29 0.30 1.34 1.01 -1.26 -0.41 120.40 125.23 1nl3 s VAL 153 Ca -0.01 -0.63 0.10 0.00 0.00 0.00 0.00 61.98 61.44 1nl3 s VAL 153 Cb -0.14 -2.32 -0.06 0.00 0.00 0.00 0.00 36.38 33.87 1nl3 s VAL 153 CO 0.02 0.58 -0.15 -0.83 0.00 0.00 0.00 175.10 174.73 1nl3 s GLY 154 N -0.62 1.97 -0.02 4.51 0.00 0.47 -4.98 107.32 108.66 1nl3 s GLY 154 Ca 0.09 -1.95 -0.01 0.00 0.00 0.00 0.00 44.72 42.86 1nl3 s GLY 154 CO 0.01 -1.97 0.03 0.14 0.00 0.00 0.00 173.10 171.31 1nl3 s VAL 155 N -2.61 -0.03 -0.02 1.40 1.01 -1.26 -1.25 120.40 117.64 1nl3 s VAL 155 Ca 0.30 0.10 -0.05 0.00 0.00 0.00 0.00 61.98 62.33 1nl3 s VAL 155 Cb -0.01 -0.07 -0.04 0.00 0.00 0.00 0.00 36.38 36.25 1nl3 s VAL 155 CO 0.15 0.04 0.22 0.27 0.00 0.00 0.00 175.10 175.78 1nl3 s ILE 156 N 0.53 5.38 0.08 2.22 -4.36 -0.56 -4.85 121.20 119.64 1nl3 s ILE 156 Ca -0.04 0.06 -0.02 0.00 -0.26 0.00 0.00 60.65 60.39 1nl3 s ILE 156 Cb -0.06 -3.53 -0.04 0.00 1.25 0.00 0.00 42.46 40.08 1nl3 s ILE 156 CO -0.02 0.39 0.01 -0.76 0.24 0.00 0.00 174.94 174.81 1nl3 s LEU 157 N -1.71 2.21 0.49 0.37 1.43 -1.26 -4.52 118.68 115.69 1nl3 s LEU 157 Ca 0.25 -1.03 0.24 0.00 -1.03 0.00 0.00 54.13 52.56 1nl3 s LEU 157 Cb -0.13 0.29 1.30 0.00 0.03 0.00 0.00 46.19 47.68 1nl3 s LEU 157 CO 0.15 -0.65 1.93 0.00 0.23 0.00 0.00 176.35 178.01 1nl3 h ALA 158 N 3.04 2.46 0.00 4.21 0.00 -1.99 -2.70 119.26 124.28 1nl3 h ALA 158 Ca -0.34 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.51 1nl3 h ALA 158 Cb 1.16 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 1nl3 h ALA 158 CO 0.63 -0.67 -0.68 1.79 0.00 0.00 0.00 179.25 180.32 1nl3 h THR 159 N 0.15 0.25 -4.20 0.00 1.35 -2.03 -3.48 112.91 104.95 1nl3 h THR 159 Ca 0.36 -1.40 -0.53 0.00 -0.55 0.00 0.00 66.41 64.28 1nl3 h THR 159 Cb 1.18 1.92 0.17 0.00 -1.73 0.00 0.00 68.15 69.69 1nl3 h THR 159 CO -0.06 0.14 0.35 -0.04 -0.25 0.00 0.00 175.52 175.67 1nl3 s MET 160 N -3.17 1.80 0.47 4.72 -1.94 -1.02 -5.03 119.30 115.14 1nl3 s MET 160 Ca 0.02 1.72 -0.00 0.00 -1.71 0.00 0.00 55.69 55.72 1nl3 s MET 160 Cb 0.08 -1.80 -0.00 0.00 2.01 0.00 0.00 34.83 35.12 1nl3 s MET 160 CO 0.75 -2.08 0.70 0.95 -0.01 0.00 0.00 175.02 175.32 1nl3 s THR 161 N -2.15 3.92 0.38 2.05 -4.23 -1.26 -4.89 115.64 109.45 1nl3 s THR 161 Ca 0.73 -0.45 0.13 0.00 -1.18 0.00 0.00 61.69 60.91 1nl3 s THR 161 Cb -0.28 -3.46 0.35 0.00 1.34 0.00 0.00 72.50 70.45 1nl3 s THR 161 CO 0.49 -0.34 1.86 -0.65 -0.54 0.00 0.00 174.62 175.45 1nl3 h PRO 162 N 0.33 0.54 -0.22 3.99 0.11 -1.96 -0.39 132.00 134.40 1nl3 h PRO 162 Ca -0.46 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 65.49 1nl3 h PRO 162 Cb 1.25 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1nl3 h PRO 162 CO 0.57 0.36 -0.43 -0.44 -0.21 0.00 0.00 178.00 177.85 1nl3 h ASP 163 N 0.55 0.56 -0.11 -2.05 3.32 -1.95 -1.98 116.42 114.77 1nl3 h ASP 163 Ca 0.46 -0.26 -0.13 0.00 0.02 0.00 0.00 57.03 57.12 1nl3 h ASP 163 Cb 0.93 -0.16 0.01 0.00 0.22 0.00 0.00 39.33 40.32 1nl3 h ASP 163 CO -0.20 0.92 -0.44 -0.33 -1.72 0.00 0.00 179.24 177.47 1nl3 h GLU 164 N 0.43 0.49 -0.14 3.56 5.08 -1.55 -2.89 114.58 119.57 1nl3 h GLU 164 Ca 0.03 -0.38 0.04 0.00 -1.00 0.00 0.00 59.36 58.06 1nl3 h GLU 164 Cb 0.92 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 30.20 1nl3 h GLU 164 CO 0.08 1.01 -0.14 0.00 -1.00 0.00 0.00 179.01 178.96 1nl3 h ARG 165 N 0.08 -0.16 -0.79 2.33 3.08 -1.13 -2.34 114.38 115.44 1nl3 h ARG 165 Ca -0.02 0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.11 1nl3 h ARG 165 Cb 1.07 0.04 -0.10 0.00 0.08 0.00 0.00 29.97 31.05 1nl3 h ARG 165 CO 0.09 -0.11 -0.56 -0.09 -1.07 0.00 0.00 179.97 178.23 1nl3 h ARG 166 N -0.17 -0.12 -0.91 0.04 2.43 -1.24 0.11 114.38 114.53 1nl3 h ARG 166 Ca 0.09 0.01 0.18 0.00 -0.81 0.00 0.00 59.98 59.46 1nl3 h ARG 166 Cb 0.30 0.03 -0.11 0.00 -0.42 0.00 0.00 29.97 29.77 1nl3 h ARG 166 CO -0.24 -0.08 0.47 0.28 -1.51 0.00 0.00 179.97 178.90 1nl3 h VAL 167 N -0.12 0.64 -0.47 0.20 2.07 -1.29 0.56 116.25 117.85 1nl3 h VAL 167 Ca 0.13 -0.20 -0.12 0.00 0.82 0.00 0.00 66.70 67.33 1nl3 h VAL 167 Cb 0.45 -0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 1nl3 h VAL 167 CO -0.81 0.11 -0.16 0.00 0.02 0.00 0.00 177.57 176.73 1nl3 h ALA 168 N 1.63 0.65 0.00 1.67 0.00 -0.44 -2.28 119.26 120.50 1nl3 h ALA 168 Ca 0.53 -0.36 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1nl3 h ALA 168 Cb 0.86 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1nl3 h ALA 168 CO -0.42 0.59 -0.29 1.88 0.00 0.00 0.00 179.25 181.02 1nl3 h TYR 169 N 0.78 0.00 -0.00 0.00 0.05 0.07 -2.77 116.97 115.10 1nl3 h TYR 169 Ca 0.11 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.89 1nl3 h TYR 169 Cb 0.73 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.47 1nl3 h TYR 169 CO 0.05 0.29 -0.04 0.09 -1.05 0.00 0.00 178.16 177.50 1nl3 n ASN 170 N -3.56 0.05 -4.62 3.88 3.02 0.10 -4.78 115.26 109.35 1nl3 n ASN 170 Ca -0.01 0.34 -0.30 0.00 -0.03 0.00 0.00 54.58 54.59 1nl3 n ASN 170 Cb 0.43 -0.41 0.19 0.00 -0.61 0.00 0.00 39.78 39.38 1nl3 n ASN 170 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1nl3 s ALA 171 N -2.94 0.78 0.30 5.41 0.00 -0.92 -4.94 121.76 119.45 1nl3 s ALA 171 Ca 0.16 0.17 0.13 0.00 0.00 0.00 0.00 51.96 52.42 1nl3 s ALA 171 Cb 0.19 -3.31 0.57 0.00 0.00 0.00 0.00 23.12 20.57 1nl3 s ALA 171 CO 0.53 -3.05 1.72 -0.44 0.00 0.00 0.00 175.76 174.53 1nl3 h ASP 172 N -2.06 0.00 -3.72 0.00 3.32 -1.05 -3.43 116.42 109.48 1nl3 h ASP 172 Ca -0.51 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.27 1nl3 h ASP 172 Cb 1.29 0.00 -0.29 0.00 0.22 0.00 0.00 39.33 40.55 1nl3 h ASP 172 CO 0.48 0.48 -0.73 -0.63 -1.72 0.00 0.00 179.24 177.12 1nl3 s ILE 173 N -3.85 0.07 -0.08 0.35 1.01 -1.12 -2.59 121.20 114.99 1nl3 s ILE 173 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.64 1nl3 s ILE 173 Cb 0.13 -0.09 0.02 0.00 0.01 0.00 0.00 42.46 42.53 1nl3 s ILE 173 CO 0.73 0.04 -0.08 -0.89 0.00 0.00 0.00 174.94 174.75 1nl3 s THR 174 N 0.19 0.92 0.35 2.92 2.01 0.12 -0.39 115.64 121.75 1nl3 s THR 174 Ca -0.02 -0.28 -0.00 0.00 0.31 0.00 0.00 61.69 61.71 1nl3 s THR 174 Cb -0.03 -0.92 -0.03 0.00 0.01 0.00 0.00 72.50 71.53 1nl3 s THR 174 CO -0.01 0.33 0.56 -0.31 -0.69 0.00 0.00 174.62 174.51 1nl3 s TYR 175 N 1.32 3.50 0.00 4.92 1.51 -0.38 0.10 117.35 128.32 1nl3 s TYR 175 Ca -0.03 0.40 0.00 0.00 -1.01 0.00 0.00 57.07 56.43 1nl3 s TYR 175 Cb -0.14 -1.94 0.00 0.00 -0.11 0.00 0.00 41.96 39.78 1nl3 s TYR 175 CO -0.03 0.10 0.00 0.41 -1.11 0.00 0.00 175.55 174.92 1nl3 n GLY 176 N -1.75 0.28 3.92 0.71 0.00 -0.79 -1.49 105.19 106.08 1nl3 n GLY 176 Ca -0.04 -1.09 -0.26 0.00 0.00 0.00 0.00 46.02 44.63 1nl3 n GLY 176 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nl3 s THR 177 N -2.00 5.06 0.33 2.61 -4.23 -1.25 -0.41 115.64 115.74 1nl3 s THR 177 Ca 0.00 -0.20 0.05 0.00 -1.18 0.00 0.00 61.69 60.36 1nl3 s THR 177 Cb 0.00 -3.82 0.30 0.00 1.34 0.00 0.00 72.50 70.32 1nl3 s THR 177 CO 0.00 -0.51 1.89 -0.55 -0.54 0.00 0.00 174.62 174.91 1nl3 h ASN 178 N 1.02 0.77 0.35 3.99 7.08 -1.93 -1.22 115.58 125.65 1nl3 h ASN 178 Ca -0.49 0.03 -0.00 0.00 -3.08 0.00 0.00 56.30 52.76 1nl3 h ASN 178 Cb 1.21 -0.13 -0.03 0.00 -2.08 0.00 0.00 38.32 37.29 1nl3 h ASN 178 CO 0.63 0.44 -0.46 -1.13 -2.08 0.00 0.00 177.43 174.83 1nl3 h ASN 179 N 0.84 -1.30 -0.15 6.14 -1.24 -1.93 0.29 115.58 118.23 1nl3 h ASN 179 Ca 0.42 0.12 -0.01 0.00 0.71 0.00 0.00 56.30 57.54 1nl3 h ASN 179 Cb 0.48 0.45 -0.01 0.00 0.73 0.00 0.00 38.32 39.97 1nl3 h ASN 179 CO -0.19 -0.59 0.06 -0.33 -1.29 0.00 0.00 177.43 175.09 1nl3 h GLU 180 N -0.86 0.23 -0.13 6.67 4.39 -1.78 0.30 114.58 123.41 1nl3 h GLU 180 Ca -0.03 -0.04 0.05 0.00 0.34 0.00 0.00 59.36 59.67 1nl3 h GLU 180 Cb 0.79 -0.04 -0.06 0.00 -0.10 0.00 0.00 28.75 29.34 1nl3 h GLU 180 CO -0.13 0.33 -0.29 0.74 -1.16 0.00 0.00 179.01 178.50 1nl3 h PHE 181 N 0.08 -0.80 -0.43 4.33 0.04 -1.20 0.11 116.94 119.07 1nl3 h PHE 181 Ca 0.05 0.04 0.06 0.00 2.80 0.00 0.00 57.97 60.92 1nl3 h PHE 181 Cb 0.19 0.37 -0.05 0.00 2.20 0.00 0.00 35.95 38.66 1nl3 h PHE 181 CO -0.01 -0.37 0.11 0.78 -0.60 0.00 0.00 178.31 178.22 1nl3 h GLY 182 N -0.37 0.53 1.54 -1.45 0.00 -0.15 -1.86 103.07 101.31 1nl3 h GLY 182 Ca 0.10 -0.05 -0.20 0.00 0.00 0.00 0.00 47.33 47.18 1nl3 h GLY 182 CO -0.34 -0.02 -0.80 0.74 0.00 0.00 0.00 176.54 176.13 1nl3 h PHE 183 N 0.26 0.61 -0.46 5.60 0.04 -0.67 -0.82 116.94 121.50 1nl3 h PHE 183 Ca 0.21 -0.29 0.06 0.00 2.80 0.00 0.00 57.97 60.74 1nl3 h PHE 183 Cb 0.23 -0.09 -0.05 0.00 2.20 0.00 0.00 35.95 38.24 1nl3 h PHE 183 CO -0.18 1.07 0.17 -0.44 -0.60 0.00 0.00 178.31 178.33 1nl3 h ASP 184 N 0.29 0.19 -0.82 2.17 3.32 -0.83 0.55 116.42 121.28 1nl3 h ASP 184 Ca -0.05 0.05 0.03 0.00 0.02 0.00 0.00 57.03 57.09 1nl3 h ASP 184 Cb 1.40 0.03 -0.05 0.00 0.22 0.00 0.00 39.33 40.93 1nl3 h ASP 184 CO 0.14 0.14 0.53 0.22 -1.72 0.00 0.00 179.24 178.55 1nl3 h TYR 185 N 0.35 0.99 -0.35 4.55 3.20 -1.02 0.17 116.97 124.86 1nl3 h TYR 185 Ca 0.21 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 62.05 1nl3 h TYR 185 Cb 0.20 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.13 1nl3 h TYR 185 CO -0.15 0.56 -0.01 -0.07 -1.64 0.00 0.00 178.16 176.85 1nl3 h LEU 186 N 1.02 0.61 -0.67 2.82 3.38 0.43 -2.51 115.31 120.40 1nl3 h LEU 186 Ca 0.33 -0.32 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 1nl3 h LEU 186 Cb 0.02 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1nl3 h LEU 186 CO -0.12 0.78 -0.07 0.03 0.09 0.00 0.00 178.44 179.15 1nl3 h ARG 187 N 0.43 0.96 -0.37 1.13 3.08 0.46 -2.54 114.38 117.53 1nl3 h ARG 187 Ca 0.10 -0.33 0.08 0.00 0.07 0.00 0.00 59.98 59.90 1nl3 h ARG 187 Cb 0.48 -0.08 -0.08 0.00 0.08 0.00 0.00 29.97 30.37 1nl3 h ARG 187 CO 0.02 0.99 -0.20 -0.44 -1.07 0.00 0.00 179.97 179.28 1nl3 h ASP 188 N 0.87 -0.66 0.00 7.04 5.19 -0.59 -0.88 116.42 127.39 1nl3 h ASP 188 Ca 0.14 0.15 0.00 0.00 -0.62 0.00 0.00 57.03 56.70 1nl3 h ASP 188 Cb 0.61 0.35 0.00 0.00 0.18 0.00 0.00 39.33 40.47 1nl3 h ASP 188 CO 0.04 -0.23 0.00 0.59 -3.12 0.00 0.00 179.24 176.52 1nl3 n ASN 189 N -5.37 0.00 -0.02 6.45 3.02 -0.95 -1.27 115.26 117.11 1nl3 n ASN 189 Ca 0.02 -1.96 0.02 0.00 -0.03 0.00 0.00 54.58 52.62 1nl3 n ASN 189 Cb 0.28 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.43 1nl3 n ASN 189 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1nl3 n MET 190 N -0.50 4.86 -1.52 3.52 2.81 -0.58 -4.93 117.12 120.77 1nl3 n MET 190 Ca 0.00 -0.11 -0.36 0.00 -1.81 0.00 0.00 57.70 55.42 1nl3 n MET 190 Cb 0.00 -0.74 0.08 0.00 -0.71 0.00 0.00 33.22 31.85 1nl3 n MET 190 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1nl3 n ALA 191 N -0.91 0.31 0.62 3.04 0.00 -0.40 -4.96 120.51 118.21 1nl3 n ALA 191 Ca 0.01 -0.10 0.08 0.00 0.00 0.00 0.00 53.44 53.44 1nl3 n ALA 191 Cb 0.07 -2.19 -0.10 0.00 0.00 0.00 0.00 19.45 17.22 1nl3 n ALA 191 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1nl3 n HIS 192 N -2.21 0.00 -3.84 0.00 8.25 -1.26 -4.95 115.22 111.21 1nl3 n HIS 192 Ca 0.14 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.47 1nl3 n HIS 192 Cb 0.49 -0.08 -0.15 0.00 1.12 0.00 0.00 29.99 31.37 1nl3 n HIS 192 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1nl3 s SER 193 N -2.88 0.02 0.61 0.41 0.15 -1.26 -4.96 113.70 105.78 1nl3 s SER 193 Ca 0.04 0.01 0.27 0.00 0.70 0.00 0.00 55.95 56.97 1nl3 s SER 193 Cb 0.12 -0.02 1.18 0.00 -1.71 0.00 0.00 66.02 65.59 1nl3 s SER 193 CO 0.69 -0.04 1.59 0.25 1.20 0.00 0.00 173.24 176.94 1nl3 h LEU 194 N 6.47 0.00 -0.66 3.45 5.85 -1.93 0.49 115.31 128.98 1nl3 h LEU 194 Ca -0.30 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.42 1nl3 h LEU 194 Cb 1.18 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.21 1nl3 h LEU 194 CO 0.50 0.00 0.00 0.44 -0.34 0.00 0.00 178.44 179.04 1nl3 h ASP 195 N 0.00 0.00 0.77 1.25 5.19 -1.95 -3.18 116.42 118.50 1nl3 h ASP 195 Ca 0.31 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.70 1nl3 h ASP 195 Cb 1.96 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 41.47 1nl3 h ASP 195 CO -0.00 0.00 -1.25 0.47 -3.12 0.00 0.00 179.24 175.34 1nl3 n ASP 196 N -2.54 0.68 -4.61 6.45 8.00 0.17 -4.90 116.55 119.80 1nl3 n ASP 196 Ca 0.03 0.27 -0.49 0.00 0.71 0.00 0.00 54.79 55.30 1nl3 n ASP 196 Cb 0.32 0.71 -0.05 0.00 -0.02 0.00 0.00 41.12 42.09 1nl3 n ASP 196 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1nl3 n LEU 197 N -2.62 2.05 -0.07 0.64 4.77 -1.20 -4.92 117.00 115.64 1nl3 n LEU 197 Ca -0.02 1.12 -0.09 0.00 -0.03 0.00 0.00 56.01 56.99 1nl3 n LEU 197 Cb 0.59 -1.27 -0.09 0.00 -2.33 0.00 0.00 43.42 40.33 1nl3 n LEU 197 CO 0.41 -0.90 -0.97 1.33 -1.33 0.00 0.00 177.39 175.93 1nl3 n VAL 198 N 2.38 0.90 -2.06 4.08 0.24 -1.26 -4.91 118.33 117.70 1nl3 n VAL 198 Ca 0.17 -0.45 -0.28 0.00 -2.04 0.00 0.00 64.34 61.74 1nl3 n VAL 198 Cb 0.24 -0.87 0.07 0.00 -1.47 0.00 0.00 33.84 31.81 1nl3 n VAL 198 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1nl3 s GLN 199 N -2.32 2.27 -0.38 7.34 -0.21 -1.26 -4.38 119.66 120.72 1nl3 s GLN 199 Ca -0.14 0.01 0.13 0.00 0.02 0.00 0.00 55.36 55.37 1nl3 s GLN 199 Cb 0.05 -2.08 0.41 0.00 1.00 0.00 0.00 33.01 32.39 1nl3 s GLN 199 CO 0.45 -1.30 0.90 2.89 -2.12 0.00 0.00 175.29 176.11 1nl3 n ARG 200 N -3.05 1.61 0.00 2.91 1.85 -1.26 -5.09 116.66 113.63 1nl3 n ARG 200 Ca 0.07 -3.63 0.00 0.00 -1.00 0.00 0.00 57.85 53.29 1nl3 n ARG 200 Cb 0.60 -1.64 0.00 0.00 -1.05 0.00 0.00 32.46 30.37 1nl3 n ARG 200 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1nl3 n GLY 201 N -0.02 -0.34 2.69 2.89 0.00 -1.26 -4.89 105.19 104.25 1nl3 n GLY 201 Ca 0.21 -1.77 -0.29 0.00 0.00 0.00 0.00 46.02 44.16 1nl3 n GLY 201 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1nl3 s HIS 202 N -1.72 1.85 -0.20 1.61 0.09 -1.26 -4.97 115.29 110.68 1nl3 s HIS 202 Ca 0.00 -2.31 -0.16 0.00 -0.00 0.00 0.00 55.06 52.58 1nl3 s HIS 202 Cb 0.00 -1.79 -0.08 0.00 -0.00 0.00 0.00 32.58 30.71 1nl3 s HIS 202 CO 0.00 -0.79 -0.31 0.72 -0.00 0.00 0.00 174.74 174.35 1nl3 n HIS 203 N 3.67 0.14 -3.77 1.40 -0.00 -1.26 -1.86 115.22 113.53 1nl3 n HIS 203 Ca 0.08 0.06 -0.14 0.00 -0.00 0.00 0.00 57.72 57.72 1nl3 n HIS 203 Cb 0.35 -0.67 -0.15 0.00 -0.00 0.00 0.00 29.99 29.51 1nl3 n HIS 203 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.34 175.87 1nl3 s TYR 204 N -2.72 -0.03 -0.07 4.41 5.04 -1.26 -0.48 117.35 122.24 1nl3 s TYR 204 Ca -0.30 0.23 0.01 0.00 -2.44 0.00 0.00 57.07 54.58 1nl3 s TYR 204 Cb 0.07 -0.17 0.02 0.00 0.35 0.00 0.00 41.96 42.22 1nl3 s TYR 204 CO 0.43 -0.11 -0.09 0.00 -1.34 0.00 0.00 175.55 174.44 1nl3 s ALA 205 N 1.02 1.07 -0.30 3.97 0.00 -0.90 -0.16 121.76 126.45 1nl3 s ALA 205 Ca -0.08 -0.31 -0.07 0.00 0.00 0.00 0.00 51.96 51.49 1nl3 s ALA 205 Cb -0.11 -0.58 0.01 0.00 0.00 0.00 0.00 23.12 22.44 1nl3 s ALA 205 CO -0.04 -0.02 0.10 0.42 0.00 0.00 0.00 175.76 176.22 1nl3 s ILE 206 N 0.93 4.05 -0.49 0.00 1.01 0.62 -1.33 121.20 125.99 1nl3 s ILE 206 Ca -0.10 -0.71 -0.18 0.00 0.00 0.00 0.00 60.65 59.66 1nl3 s ILE 206 Cb -0.15 -3.12 0.06 0.00 0.01 0.00 0.00 42.46 39.27 1nl3 s ILE 206 CO 0.01 0.04 0.54 -0.69 0.00 0.00 0.00 174.94 174.83 1nl3 s VAL 207 N 1.51 5.01 0.68 2.92 1.01 0.16 -0.82 120.40 130.88 1nl3 s VAL 207 Ca 0.02 -0.72 -0.15 0.00 0.00 0.00 0.00 61.98 61.13 1nl3 s VAL 207 Cb -0.17 -4.23 0.01 0.00 0.00 0.00 0.00 36.38 31.98 1nl3 s VAL 207 CO 0.03 -0.72 1.14 -0.62 0.00 0.00 0.00 175.10 174.93 1nl3 s ASP 208 N 2.67 4.82 -1.35 3.32 2.15 0.66 -1.64 116.67 127.30 1nl3 s ASP 208 Ca 0.11 2.11 -0.16 0.00 0.43 0.00 0.00 52.55 55.04 1nl3 s ASP 208 Cb -0.21 -2.56 0.02 0.00 -0.30 0.00 0.00 42.92 39.86 1nl3 s ASP 208 CO 0.10 -1.83 0.43 -0.62 -0.17 0.00 0.00 175.17 173.07 1nl3 n GLU 209 N -2.50 -1.11 -0.33 4.34 -0.58 -0.52 -4.73 120.64 115.21 1nl3 n GLU 209 Ca 0.11 0.18 0.03 0.00 -0.42 0.00 0.00 57.16 57.07 1nl3 n GLU 209 Cb 0.51 -3.41 0.18 0.00 -0.57 0.00 0.00 31.44 28.15 1nl3 n GLU 209 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1nl3 h VAL 210 N -2.14 0.99 -0.23 2.62 2.07 -1.28 -0.76 116.25 117.53 1nl3 h VAL 210 Ca -0.68 -0.34 -0.05 0.00 0.82 0.00 0.00 66.70 66.45 1nl3 h VAL 210 Cb 1.39 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1nl3 h VAL 210 CO 0.60 0.18 -0.09 -2.24 0.02 0.00 0.00 177.57 176.04 1nl3 h ASP 211 N 0.99 0.35 -0.22 0.57 2.03 -1.84 0.14 116.42 118.44 1nl3 h ASP 211 Ca 0.42 -0.07 -0.18 0.00 -0.73 0.00 0.00 57.03 56.47 1nl3 h ASP 211 Cb 0.29 -0.09 0.00 0.00 -0.83 0.00 0.00 39.33 38.70 1nl3 h ASP 211 CO -0.21 0.49 -0.58 0.28 -1.03 0.00 0.00 179.24 178.19 1nl3 h SER 212 N 0.35 0.90 0.00 4.15 0.02 -1.50 -0.56 113.55 116.92 1nl3 h SER 212 Ca 0.07 -0.57 -0.05 0.00 -0.84 0.00 0.00 61.79 60.40 1nl3 h SER 212 Cb 0.38 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 1nl3 h SER 212 CO 0.02 1.31 -0.32 0.40 -1.14 0.00 0.00 176.83 177.09 1nl3 h ILE 213 N 0.53 0.96 0.00 3.27 2.04 -1.29 0.28 117.51 123.30 1nl3 h ILE 213 Ca -0.01 -1.82 -0.16 0.00 1.00 0.00 0.00 64.86 63.87 1nl3 h ILE 213 Cb 1.19 1.91 -0.02 0.00 -0.74 0.00 0.00 36.82 39.16 1nl3 h ILE 213 CO 0.13 0.32 -0.88 -0.07 0.00 0.00 0.00 178.15 177.65 1nl3 h LEU 214 N -1.00 0.00 0.00 1.44 3.38 -0.88 -3.01 115.31 115.24 1nl3 h LEU 214 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1nl3 h LEU 214 Cb 0.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1nl3 h LEU 214 CO -0.04 0.73 0.00 -0.38 0.09 0.00 0.00 178.44 178.84 1nl3 n ILE 215 N -3.22 0.00 -0.06 1.22 2.08 -1.01 -4.47 119.36 113.91 1nl3 n ILE 215 Ca -0.01 0.00 -0.12 0.00 0.56 0.00 0.00 62.75 63.17 1nl3 n ILE 215 Cb 0.85 -0.84 -0.07 0.00 -0.75 0.00 0.00 39.64 38.83 1nl3 n ILE 215 CO 0.00 0.00 0.00 0.44 0.56 0.00 0.00 176.55 177.55 1nl3 h ASP 216 N 0.00 -1.48 0.92 4.38 3.32 -1.14 -2.30 116.42 120.13 1nl3 h ASP 216 Ca 0.00 0.20 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1nl3 h ASP 216 Cb 0.00 0.61 0.00 0.00 0.22 0.00 0.00 39.33 40.16 1nl3 h ASP 216 CO 0.00 -0.42 0.00 -0.33 -1.72 0.00 0.00 179.24 176.77 1nl3 h GLU 217 N -0.45 0.00 0.00 3.56 5.08 -0.44 -3.16 114.58 119.18 1nl3 h GLU 217 Ca 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1nl3 h GLU 217 Cb 0.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.87 1nl3 h GLU 217 CO -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 177.53 1nl3 n ALA 218 N -1.80 1.19 0.34 3.43 0.00 -0.87 -2.68 120.51 120.13 1nl3 n ALA 218 Ca 0.03 0.16 0.15 0.00 0.00 0.00 0.00 53.44 53.77 1nl3 n ALA 218 Cb 0.28 -1.31 0.60 0.00 0.00 0.00 0.00 19.45 19.02 1nl3 n ALA 218 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1nl3 h ARG 219 N 0.00 0.00 -5.50 0.00 2.43 -1.70 -3.43 114.38 106.18 1nl3 h ARG 219 Ca 0.00 0.00 -0.66 0.00 -0.81 0.00 0.00 59.98 58.51 1nl3 h ARG 219 Cb 0.09 0.00 -0.26 0.00 -0.42 0.00 0.00 29.97 29.37 1nl3 h ARG 219 CO 0.00 0.00 -0.77 0.99 -1.51 0.00 0.00 179.97 178.68 1nl3 s THR 220 N -3.50 3.01 0.66 0.20 2.01 -1.09 -4.82 115.64 112.11 1nl3 s THR 220 Ca 0.02 -0.69 -0.07 0.00 0.31 0.00 0.00 61.69 61.26 1nl3 s THR 220 Cb 0.09 -2.24 0.03 0.00 0.01 0.00 0.00 72.50 70.39 1nl3 s THR 220 CO 0.45 0.54 0.98 -2.84 -0.69 0.00 0.00 174.62 173.06 1nl3 s PRO 221 N 0.16 2.64 -0.22 4.92 0.02 -1.26 -4.54 135.00 136.72 1nl3 s PRO 221 Ca -0.07 0.01 -0.11 0.00 0.02 0.00 0.00 61.00 60.85 1nl3 s PRO 221 Cb -0.15 -2.18 -0.05 0.00 0.02 0.00 0.00 34.50 32.14 1nl3 s PRO 221 CO 0.05 -0.96 0.16 -0.51 -0.33 0.00 0.00 177.00 175.40 1nl3 s LEU 222 N -5.16 4.16 -0.13 -5.54 1.02 -0.57 -5.01 118.68 107.46 1nl3 s LEU 222 Ca 0.57 0.19 -0.01 0.00 0.02 0.00 0.00 54.13 54.90 1nl3 s LEU 222 Cb -0.11 -2.12 0.03 0.00 0.02 0.00 0.00 46.19 44.02 1nl3 s LEU 222 CO 0.46 0.12 -0.06 -0.63 0.02 0.00 0.00 176.35 176.26 1nl3 s ILE 223 N 0.72 0.97 -0.24 -0.59 1.01 -1.26 -2.86 121.20 118.96 1nl3 s ILE 223 Ca 0.08 -0.37 -0.26 0.00 0.00 0.00 0.00 60.65 60.10 1nl3 s ILE 223 Cb -0.12 -1.08 0.00 0.00 0.01 0.00 0.00 42.46 41.27 1nl3 s ILE 223 CO 0.02 0.26 0.91 -0.63 0.00 0.00 0.00 174.94 175.49 1nl3 s ILE 224 N 1.71 4.78 0.44 2.92 1.01 -0.94 -5.00 121.20 126.12 1nl3 s ILE 224 Ca 0.03 1.74 0.06 0.00 0.00 0.00 0.00 60.65 62.49 1nl3 s ILE 224 Cb -0.14 -4.19 -0.05 0.00 0.01 0.00 0.00 42.46 38.10 1nl3 s ILE 224 CO -0.08 -0.11 0.13 -0.94 0.00 0.00 0.00 174.94 173.94 1nl3 s SER 225 N 1.29 4.26 0.00 3.58 1.04 -1.26 -1.11 113.70 121.49 1nl3 s SER 225 Ca 0.38 -1.25 0.00 0.00 0.48 0.00 0.00 55.95 55.57 1nl3 s SER 225 Cb -0.15 -0.25 0.00 0.00 0.10 0.00 0.00 66.02 65.72 1nl3 s SER 225 CO 0.07 -0.61 0.00 0.61 0.98 0.00 0.00 173.24 174.29 1nl3 n GLY 226 N -1.22 0.13 3.79 7.32 0.00 -0.88 -4.86 105.19 109.48 1nl3 n GLY 226 Ca -0.05 -0.87 -0.30 0.00 0.00 0.00 0.00 46.02 44.80 1nl3 n GLY 226 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1nl3 s PRO 227 N -2.00 2.31 0.34 1.61 0.02 -1.26 0.40 135.00 136.41 1nl3 s PRO 227 Ca 0.00 0.86 0.15 0.00 0.02 0.00 0.00 61.00 62.03 1nl3 s PRO 227 Cb 0.00 -1.93 1.13 0.00 0.02 0.00 0.00 34.50 33.72 1nl3 s PRO 227 CO 0.00 -1.52 1.49 0.00 -0.33 0.00 0.00 177.00 176.64 1nl3 n ALA 228 N -3.40 0.84 -1.61 -1.55 0.00 -0.77 -4.76 120.51 109.27 1nl3 n ALA 228 Ca 0.08 0.98 0.00 0.00 0.00 0.00 0.00 53.44 54.49 1nl3 n ALA 228 Cb 0.55 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 19.09 1nl3 n ALA 228 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1nl3 n ASP 229 N -5.21 -1.47 0.00 0.00 2.03 -1.26 -4.96 116.55 105.68 1nl3 n ASP 229 Ca 0.32 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.63 1nl3 n ASP 229 Cb 1.09 -0.37 0.00 0.00 -0.72 0.00 0.00 41.12 41.12 1nl3 n ASP 229 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1nl3 n GLY 230 N -0.59 -0.41 2.79 0.27 0.00 -1.26 -4.98 105.19 101.01 1nl3 n GLY 230 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.90 1nl3 n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nl3 n ALA 231 N 5.04 0.00 0.06 4.61 0.00 -1.26 -4.90 120.51 124.05 1nl3 n ALA 231 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 1nl3 n ALA 231 Cb 0.00 -0.58 -0.14 0.00 0.00 0.00 0.00 19.45 18.73 1nl3 n ALA 231 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1nl3 h SER 232 N 0.00 0.27 0.06 0.00 4.64 -2.01 -3.26 113.55 113.25 1nl3 h SER 232 Ca 0.00 -0.37 -0.01 0.00 -0.47 0.00 0.00 61.79 60.95 1nl3 h SER 232 Cb 0.28 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1nl3 h SER 232 CO 0.00 1.30 -0.04 -0.55 -0.87 0.00 0.00 176.83 176.68 1nl3 h ASN 233 N 0.05 0.00 -0.03 4.97 -1.07 -2.00 -2.61 115.58 114.90 1nl3 h ASN 233 Ca -0.19 0.00 -0.13 0.00 0.07 0.00 0.00 56.30 56.05 1nl3 h ASN 233 Cb 1.96 0.00 0.01 0.00 -2.07 0.00 0.00 38.32 38.22 1nl3 h ASN 233 CO 0.15 0.04 -0.50 -0.50 0.07 0.00 0.00 177.43 176.69 1nl3 h TRP 234 N 0.00 0.55 -0.59 4.14 4.06 -1.98 -0.63 115.95 121.50 1nl3 h TRP 234 Ca -0.00 -0.28 0.08 0.00 2.06 0.00 0.00 58.89 60.74 1nl3 h TRP 234 Cb 0.08 -0.07 -0.06 0.00 -1.00 0.00 0.00 29.16 28.10 1nl3 h TRP 234 CO 0.00 1.08 0.25 1.88 -3.56 0.00 0.00 178.44 178.10 1nl3 h TYR 235 N -0.13 0.45 -0.53 0.49 0.05 -1.55 0.32 116.97 116.08 1nl3 h TYR 235 Ca -0.06 0.03 -0.12 0.00 0.05 0.00 0.00 58.73 58.64 1nl3 h TYR 235 Cb 1.20 -0.11 -0.02 0.00 1.01 0.00 0.00 36.73 38.81 1nl3 h TYR 235 CO 0.14 0.16 -0.13 1.15 -1.05 0.00 0.00 178.16 178.44 1nl3 h THR 236 N 0.47 1.27 -0.35 -2.88 2.02 -1.48 -1.24 112.91 110.72 1nl3 h THR 236 Ca 0.29 -1.28 -0.11 0.00 0.77 0.00 0.00 66.41 66.07 1nl3 h THR 236 Cb 0.29 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 67.68 1nl3 h THR 236 CO -0.25 0.45 -0.25 -0.08 0.37 0.00 0.00 175.52 175.76 1nl3 h GLU 237 N 0.89 0.70 0.07 6.66 4.57 0.19 -2.71 114.58 124.96 1nl3 h GLU 237 Ca 0.13 -0.29 -0.27 0.00 -1.18 0.00 0.00 59.36 57.76 1nl3 h GLU 237 Cb 0.69 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.24 1nl3 h GLU 237 CO 0.05 0.88 -1.33 0.74 -1.18 0.00 0.00 179.01 178.18 1nl3 h PHE 238 N 0.61 0.27 -0.16 0.92 0.04 -0.35 -1.73 116.94 116.53 1nl3 h PHE 238 Ca 0.08 -0.19 0.05 0.00 2.80 0.00 0.00 57.97 60.71 1nl3 h PHE 238 Cb 0.74 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.88 1nl3 h PHE 238 CO 0.04 1.19 0.20 0.00 -0.60 0.00 0.00 178.31 179.14 1nl3 h ALA 239 N 0.73 1.72 0.08 2.45 0.00 -1.16 0.28 119.26 123.37 1nl3 h ALA 239 Ca -0.15 -0.01 -0.35 0.00 0.00 0.00 0.00 54.91 54.41 1nl3 h ALA 239 Cb 1.93 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.70 1nl3 h ALA 239 CO 0.15 -0.29 -1.94 -2.13 0.00 0.00 0.00 179.25 175.04 1nl3 n ARG 240 N -3.69 0.72 -0.02 0.00 0.63 -1.03 -4.25 116.66 109.02 1nl3 n ARG 240 Ca 0.01 0.26 -0.12 0.00 -0.92 0.00 0.00 57.85 57.08 1nl3 n ARG 240 Cb 0.32 -1.72 -0.07 0.00 0.45 0.00 0.00 32.46 31.43 1nl3 n ARG 240 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 1nl3 h LEU 241 N 0.05 0.12 -0.67 6.15 3.38 -0.49 -3.33 115.31 120.52 1nl3 h LEU 241 Ca -0.39 -0.30 0.14 0.00 0.09 0.00 0.00 57.88 57.41 1nl3 h LEU 241 Cb 2.03 -0.03 -0.10 0.00 0.09 0.00 0.00 40.66 42.65 1nl3 h LEU 241 CO 0.08 0.39 0.13 0.00 0.09 0.00 0.00 178.44 179.13 1nl3 h ALA 242 N 0.73 0.80 0.00 1.53 0.00 -0.66 0.20 119.26 121.88 1nl3 h ALA 242 Ca 0.02 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1nl3 h ALA 242 Cb 0.33 0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1nl3 h ALA 242 CO 0.00 -0.33 0.00 -1.00 0.00 0.00 0.00 179.25 177.92 1nl3 h PRO 243 N 0.24 0.00 -1.00 0.00 0.13 -1.75 -2.64 132.00 126.98 1nl3 h PRO 243 Ca 0.36 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.49 1nl3 h PRO 243 Cb 0.58 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.71 1nl3 h PRO 243 CO -0.47 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 178.58 1nl3 n LEU 244 N -2.65 1.31 -3.92 1.56 4.77 0.71 -4.80 117.00 113.99 1nl3 n LEU 244 Ca 0.01 -0.66 -0.29 0.00 -0.03 0.00 0.00 56.01 55.05 1nl3 n LEU 244 Cb 0.27 -0.50 -0.16 0.00 -2.33 0.00 0.00 43.42 40.70 1nl3 n LEU 244 CO 0.24 0.29 -0.43 -0.04 -1.33 0.00 0.00 177.39 176.11 1nl3 s MET 245 N -0.85 1.59 -0.06 3.23 -1.94 -1.00 -5.10 119.30 115.18 1nl3 s MET 245 Ca 0.00 -0.65 -0.30 0.00 -1.71 0.00 0.00 55.69 53.03 1nl3 s MET 245 Cb 0.00 -2.18 -0.05 0.00 2.01 0.00 0.00 34.83 34.60 1nl3 s MET 245 CO 0.00 -0.46 1.60 -2.00 -0.01 0.00 0.00 175.02 174.16 1nl3 s GLU 246 N 1.55 4.19 0.36 2.03 2.12 -1.26 -4.92 118.70 122.77 1nl3 s GLU 246 Ca -0.01 2.13 -0.28 0.00 0.36 0.00 0.00 54.97 57.17 1nl3 s GLU 246 Cb -0.16 -3.94 -0.12 0.00 0.26 0.00 0.00 34.13 30.18 1nl3 s GLU 246 CO -0.08 -0.82 1.43 1.17 -0.54 0.00 0.00 175.26 176.42 1nl3 n LYS 247 N 6.96 2.49 0.00 4.30 4.81 -1.26 -0.38 118.16 135.09 1nl3 n LYS 247 Ca 0.17 0.87 0.00 0.00 -0.87 0.00 0.00 58.31 58.48 1nl3 n LYS 247 Cb 0.43 -2.56 0.00 0.00 0.02 0.00 0.00 35.03 32.92 1nl3 n LYS 247 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1nl3 n ASP 248 N 0.64 0.00 -0.13 3.14 8.00 0.28 -4.69 116.55 123.79 1nl3 n ASP 248 Ca 0.03 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.24 1nl3 n ASP 248 Cb 0.38 -0.35 -0.10 0.00 -0.02 0.00 0.00 41.12 41.02 1nl3 n ASP 248 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1nl3 n VAL 249 N -1.87 1.53 -0.06 2.53 0.31 -0.90 -4.72 118.33 115.15 1nl3 n VAL 249 Ca 0.00 -0.35 -0.08 0.00 -0.01 0.00 0.00 64.34 63.91 1nl3 n VAL 249 Cb 0.00 -1.89 -0.15 0.00 -0.91 0.00 0.00 33.84 30.89 1nl3 n VAL 249 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1nl3 n HIS 250 N -4.26 0.36 -3.77 3.52 8.25 0.49 -4.61 115.22 115.21 1nl3 n HIS 250 Ca -0.52 0.13 -0.09 0.00 -0.26 0.00 0.00 57.72 56.98 1nl3 n HIS 250 Cb 0.86 -1.04 -0.04 0.00 1.12 0.00 0.00 29.99 30.90 1nl3 n HIS 250 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 1nl3 s TYR 251 N -2.60 -0.06 0.19 4.41 1.13 -1.25 -0.96 117.35 118.21 1nl3 s TYR 251 Ca -0.08 -0.29 0.09 0.00 -1.41 0.00 0.00 57.07 55.39 1nl3 s TYR 251 Cb 0.07 0.36 -0.04 0.00 -1.10 0.00 0.00 41.96 41.25 1nl3 s TYR 251 CO 0.83 -0.91 -0.19 -1.83 -2.51 0.00 0.00 175.55 170.93 1nl3 s GLU 252 N -3.89 1.38 -0.11 -3.49 -1.05 0.70 0.10 118.70 112.34 1nl3 s GLU 252 Ca 0.10 -1.49 0.03 0.00 -0.15 0.00 0.00 54.97 53.46 1nl3 s GLU 252 Cb -0.01 -1.48 -0.01 0.00 -0.44 0.00 0.00 34.13 32.20 1nl3 s GLU 252 CO -0.02 0.30 -0.20 0.08 0.95 0.00 0.00 175.26 176.37 1nl3 s VAL 253 N -2.07 2.43 -0.82 1.83 1.01 -1.26 -1.58 120.40 119.94 1nl3 s VAL 253 Ca 0.19 -0.89 -0.16 0.00 0.00 0.00 0.00 61.98 61.12 1nl3 s VAL 253 Cb -0.06 -1.97 0.18 0.00 0.00 0.00 0.00 36.38 34.54 1nl3 s VAL 253 CO 0.08 0.55 0.85 -0.62 0.00 0.00 0.00 175.10 175.96 1nl3 s ASP 254 N 0.30 6.65 0.41 3.32 -1.08 -0.68 -4.94 116.67 120.65 1nl3 s ASP 254 Ca -0.15 -2.36 0.25 0.00 -0.52 0.00 0.00 52.55 49.77 1nl3 s ASP 254 Cb -0.17 -2.27 1.35 0.00 -1.46 0.00 0.00 42.92 40.37 1nl3 s ASP 254 CO 0.07 -0.77 1.74 -0.07 0.52 0.00 0.00 175.17 176.66 1nl3 h LEU 255 N 8.76 0.00 0.00 -1.34 3.38 -1.98 -0.87 115.31 123.26 1nl3 h LEU 255 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1nl3 h LEU 255 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 1nl3 h LEU 255 CO 0.90 0.00 -0.78 0.54 0.09 0.00 0.00 178.44 179.19 1nl3 n ARG 256 N -2.42 1.50 0.25 1.13 1.74 -1.26 -4.40 116.66 113.22 1nl3 n ARG 256 Ca -0.02 0.00 0.14 0.00 -0.77 0.00 0.00 57.85 57.21 1nl3 n ARG 256 Cb 0.12 -0.89 0.56 0.00 -1.02 0.00 0.00 32.46 31.23 1nl3 n ARG 256 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1nl3 h LYS 257 N 0.00 0.00 -4.39 5.56 1.79 -1.96 -3.48 116.57 114.09 1nl3 h LYS 257 Ca 0.00 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.31 1nl3 h LYS 257 Cb 0.07 0.00 0.11 0.00 -1.58 0.00 0.00 32.23 30.84 1nl3 h LYS 257 CO 0.00 0.07 -0.50 -2.13 -1.08 0.00 0.00 179.45 175.81 1nl3 n ARG 258 N -3.18 -1.75 -3.94 3.15 0.63 -0.34 -5.06 116.66 106.16 1nl3 n ARG 258 Ca 0.01 0.51 -0.08 0.00 -0.92 0.00 0.00 57.85 57.37 1nl3 n ARG 258 Cb 0.37 -4.13 -0.08 0.00 0.45 0.00 0.00 32.46 29.07 1nl3 n ARG 258 CO 0.00 0.00 0.00 -0.08 -2.51 0.00 0.00 177.63 175.04 1nl3 s THR 259 N -3.23 0.17 -0.02 5.15 -1.32 -1.16 -5.03 115.64 110.20 1nl3 s THR 259 Ca 0.23 -1.38 0.02 0.00 -1.21 0.00 0.00 61.69 59.34 1nl3 s THR 259 Cb -0.03 -1.37 0.01 0.00 -1.51 0.00 0.00 72.50 69.59 1nl3 s THR 259 CO 0.44 -0.76 -0.06 -0.69 -2.21 0.00 0.00 174.62 171.33 1nl3 s VAL 260 N -3.81 0.57 -0.05 5.08 1.01 -1.26 -1.68 120.40 120.27 1nl3 s VAL 260 Ca 0.05 -0.23 0.05 0.00 0.00 0.00 0.00 61.98 61.85 1nl3 s VAL 260 Cb 0.06 -0.54 -0.00 0.00 0.00 0.00 0.00 36.38 35.89 1nl3 s VAL 260 CO -0.10 0.20 -0.19 -0.83 0.00 0.00 0.00 175.10 174.17 1nl3 s GLY 261 N 0.35 1.04 -0.20 4.51 0.00 -0.62 -5.01 107.32 107.39 1nl3 s GLY 261 Ca -0.05 -0.79 -0.09 0.00 0.00 0.00 0.00 44.72 43.79 1nl3 s GLY 261 CO 0.00 -0.42 0.11 0.54 0.00 0.00 0.00 173.10 173.32 1nl3 s VAL 262 N 0.01 5.11 0.77 1.40 0.11 -1.26 -0.22 120.40 126.31 1nl3 s VAL 262 Ca -0.04 0.08 -0.12 0.00 -2.93 0.00 0.00 61.98 58.97 1nl3 s VAL 262 Cb -0.12 -3.33 0.05 0.00 -1.53 0.00 0.00 36.38 31.45 1nl3 s VAL 262 CO 0.03 0.42 1.15 -1.00 -3.33 0.00 0.00 175.10 172.37 1nl3 s HIS 263 N 0.56 3.09 0.24 1.54 3.76 -0.13 -4.79 115.29 119.55 1nl3 s HIS 263 Ca 0.06 0.87 -0.07 0.00 -0.15 0.00 0.00 55.06 55.77 1nl3 s HIS 263 Cb -0.12 -3.33 0.42 0.00 1.11 0.00 0.00 32.58 30.65 1nl3 s HIS 263 CO 0.00 -1.55 1.66 0.93 -0.85 0.00 0.00 174.74 174.94 1nl3 h GLU 264 N -0.90 0.17 -0.71 1.40 5.08 -1.92 -0.17 114.58 117.52 1nl3 h GLU 264 Ca -0.46 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 57.86 1nl3 h GLU 264 Cb 1.30 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.48 1nl3 h GLU 264 CO 0.65 0.11 0.30 0.87 -1.00 0.00 0.00 179.01 179.94 1nl3 h LYS 265 N 0.17 1.03 -0.02 2.33 1.57 -1.84 -1.40 116.57 118.40 1nl3 h LYS 265 Ca 0.39 -0.17 -0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1nl3 h LYS 265 Cb 0.68 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.81 1nl3 h LYS 265 CO -0.57 0.83 0.00 0.78 -0.57 0.00 0.00 179.45 179.93 1nl3 h GLY 266 N 1.08 0.04 0.26 3.86 0.00 -1.14 0.24 103.07 107.41 1nl3 h GLY 266 Ca 0.24 -0.03 0.05 0.00 0.00 0.00 0.00 47.33 47.59 1nl3 h GLY 266 CO -0.02 0.03 -0.25 -2.08 0.00 0.00 0.00 176.54 174.22 1nl3 h VAL 267 N -0.20 0.40 -0.62 4.60 2.07 -1.00 -1.81 116.25 119.69 1nl3 h VAL 267 Ca 0.01 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 1nl3 h VAL 267 Cb 0.26 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 1nl3 h VAL 267 CO 0.00 0.00 0.38 -0.08 0.02 0.00 0.00 177.57 177.89 1nl3 h GLU 268 N -0.30 0.85 -0.38 1.57 4.81 -1.13 0.03 114.58 120.03 1nl3 h GLU 268 Ca 0.11 -0.07 0.06 0.00 -0.13 0.00 0.00 59.36 59.32 1nl3 h GLU 268 Cb 0.46 -0.18 -0.05 0.00 0.63 0.00 0.00 28.75 29.62 1nl3 h GLU 268 CO -0.32 0.60 0.09 0.35 -0.73 0.00 0.00 179.01 179.00 1nl3 h PHE 269 N 0.85 0.14 -0.65 0.92 3.57 -0.30 -1.43 116.94 120.04 1nl3 h PHE 269 Ca 0.22 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.68 1nl3 h PHE 269 Cb -0.03 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 1nl3 h PHE 269 CO -0.02 0.03 0.13 0.28 -2.23 0.00 0.00 178.31 176.50 1nl3 h VAL 270 N 0.22 1.26 -0.69 1.41 2.07 -0.94 -2.13 116.25 117.45 1nl3 h VAL 270 Ca 0.18 -0.97 0.03 0.00 0.82 0.00 0.00 66.70 66.76 1nl3 h VAL 270 Cb 0.20 0.61 -0.04 0.00 -1.52 0.00 0.00 31.29 30.54 1nl3 h VAL 270 CO -0.23 0.37 0.43 -0.33 0.02 0.00 0.00 177.57 177.83 1nl3 h GLU 271 N 0.99 0.81 0.00 1.57 5.08 -0.47 -2.51 114.58 120.04 1nl3 h GLU 271 Ca 0.20 -0.05 -0.17 0.00 -1.00 0.00 0.00 59.36 58.34 1nl3 h GLU 271 Cb 0.39 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1nl3 h GLU 271 CO 0.01 0.54 -0.89 -0.44 -1.00 0.00 0.00 179.01 177.22 1nl3 h ASP 272 N 0.83 0.00 1.05 1.42 3.32 -1.15 0.81 116.42 122.70 1nl3 h ASP 272 Ca 0.28 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.33 1nl3 h ASP 272 Cb 0.03 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 1nl3 h ASP 272 CO -0.11 0.78 -0.00 1.56 -1.72 0.00 0.00 179.24 179.75 1nl3 h GLN 273 N 0.00 0.00 -0.03 3.56 1.08 -1.18 -3.09 115.11 115.46 1nl3 h GLN 273 Ca -0.04 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 1nl3 h GLN 273 Cb 1.63 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.06 1nl3 h GLN 273 CO 0.10 0.00 0.00 1.28 -0.95 0.00 0.00 178.83 179.26 1nl3 n LEU 274 N -3.10 1.52 -3.65 1.46 4.77 -0.96 -5.01 117.00 112.03 1nl3 n LEU 274 Ca 0.01 -1.27 -0.23 0.00 -0.03 0.00 0.00 56.01 54.49 1nl3 n LEU 274 Cb 0.31 -0.02 0.06 0.00 -2.33 0.00 0.00 43.42 41.45 1nl3 n LEU 274 CO 0.27 0.36 0.12 0.61 -1.33 0.00 0.00 177.39 177.42 1nl3 n GLY 275 N 0.06 -0.44 3.38 -0.72 0.00 0.01 -4.99 105.19 102.49 1nl3 n GLY 275 Ca 0.02 0.18 -0.25 0.00 0.00 0.00 0.00 46.02 45.97 1nl3 n GLY 275 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1nl3 s ILE 276 N -3.39 2.12 -1.48 -0.61 1.09 0.07 -5.03 121.20 113.96 1nl3 s ILE 276 Ca 0.35 -1.97 0.15 0.00 -1.10 0.00 0.00 60.65 58.07 1nl3 s ILE 276 Cb -0.16 -1.99 0.03 0.00 -1.06 0.00 0.00 42.46 39.28 1nl3 s ILE 276 CO 0.77 -0.20 0.84 0.47 -0.10 0.00 0.00 174.94 176.72 1nl3 n ASP 277 N 0.30 1.72 -3.64 3.58 9.92 -1.26 -4.51 116.55 122.66 1nl3 n ASP 277 Ca -0.13 -1.36 -0.07 0.00 -0.53 0.00 0.00 54.79 52.70 1nl3 n ASP 277 Cb 0.56 0.34 -0.07 0.00 -0.64 0.00 0.00 41.12 41.32 1nl3 n ASP 277 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 1nl3 s ASN 278 N -1.62 -0.52 0.17 -2.24 3.84 -1.26 -5.06 114.94 108.26 1nl3 s ASN 278 Ca 0.13 0.92 0.24 0.00 0.21 0.00 0.00 52.86 54.37 1nl3 s ASN 278 Cb 0.12 1.04 0.91 0.00 -0.55 0.00 0.00 41.25 42.77 1nl3 s ASN 278 CO 0.32 -0.15 1.74 0.18 -2.79 0.00 0.00 177.10 176.39 1nl3 n LEU 279 N 2.87 0.55 -1.66 3.21 4.77 -1.26 -2.05 117.00 123.43 1nl3 n LEU 279 Ca -0.15 0.59 0.09 0.00 -0.03 0.00 0.00 56.01 56.51 1nl3 n LEU 279 Cb 0.57 -0.46 0.37 0.00 -2.33 0.00 0.00 43.42 41.57 1nl3 n LEU 279 CO 0.02 -0.31 0.83 -1.22 -1.33 0.00 0.00 177.39 175.39 1nl3 n TYR 280 N -2.06 1.65 0.00 -1.77 4.01 -1.26 -3.85 117.16 113.88 1nl3 n TYR 280 Ca 0.04 -0.65 -0.08 0.00 -0.16 0.00 0.00 57.90 57.05 1nl3 n TYR 280 Cb 0.31 -0.33 -0.06 0.00 -0.31 0.00 0.00 39.34 38.96 1nl3 n TYR 280 CO 0.00 0.00 0.00 1.05 -0.46 0.00 0.00 176.86 177.45 1nl3 h GLU 281 N 4.01 -0.12 -6.39 -0.72 4.11 -1.43 -3.17 114.58 110.88 1nl3 h GLU 281 Ca 0.00 0.01 -0.57 0.00 0.07 0.00 0.00 59.36 58.87 1nl3 h GLU 281 Cb 1.61 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 30.84 1nl3 h GLU 281 CO 0.31 0.27 1.00 0.00 0.07 0.00 0.00 179.01 180.66 1nl3 s ALA 282 N -2.97 3.29 0.28 1.06 0.00 -1.26 -0.31 121.76 121.84 1nl3 s ALA 282 Ca -0.09 0.06 -0.30 0.00 0.00 0.00 0.00 51.96 51.63 1nl3 s ALA 282 Cb -0.00 -3.82 -0.13 0.00 0.00 0.00 0.00 23.12 19.16 1nl3 s ALA 282 CO 0.34 -1.93 1.26 0.00 0.00 0.00 0.00 175.76 175.43 1nl3 n ALA 283 N 7.94 0.72 -2.63 0.00 0.00 -1.26 -2.63 120.51 122.64 1nl3 n ALA 283 Ca 0.15 0.40 -0.14 0.00 0.00 0.00 0.00 53.44 53.85 1nl3 n ALA 283 Cb 0.47 -2.19 0.02 0.00 0.00 0.00 0.00 19.45 17.74 1nl3 n ALA 283 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1nl3 n ASN 284 N 1.49 -4.41 -3.50 0.00 2.85 -1.26 -4.98 115.26 105.45 1nl3 n ASN 284 Ca 0.09 -0.15 -0.29 0.00 -0.11 0.00 0.00 54.58 54.13 1nl3 n ASN 284 Cb 0.32 -3.35 -0.13 0.00 1.24 0.00 0.00 39.78 37.87 1nl3 n ASN 284 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 1nl3 s SER 285 N -2.72 3.13 -1.08 1.20 0.01 -1.08 -5.06 113.70 108.10 1nl3 s SER 285 Ca 0.15 -2.08 -0.14 0.00 1.31 0.00 0.00 55.95 55.19 1nl3 s SER 285 Cb -0.07 -0.45 -0.08 0.00 0.21 0.00 0.00 66.02 65.64 1nl3 s SER 285 CO 0.19 -0.33 2.17 -0.81 0.41 0.00 0.00 173.24 174.87 1nl3 n PRO 286 N 4.20 2.24 0.32 12.44 -0.04 -1.26 -4.72 135.00 148.19 1nl3 n PRO 286 Ca 0.09 -1.97 0.19 0.00 -0.04 0.00 0.00 63.50 61.77 1nl3 n PRO 286 Cb 0.38 -2.87 1.07 0.00 -0.04 0.00 0.00 33.50 32.04 1nl3 n PRO 286 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1nl3 h LEU 287 N 10.65 0.00 -0.02 1.53 3.38 -1.93 -0.52 115.31 128.39 1nl3 h LEU 287 Ca 0.53 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.50 1nl3 h LEU 287 Cb 0.48 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 1nl3 h LEU 287 CO 1.79 0.01 -0.00 0.58 0.09 0.00 0.00 178.44 180.91 1nl3 h VAL 288 N 0.00 1.25 -0.36 1.22 2.07 -1.85 -1.90 116.25 116.69 1nl3 h VAL 288 Ca -0.00 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.76 1nl3 h VAL 288 Cb 0.04 1.71 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 1nl3 h VAL 288 CO 0.00 0.20 0.19 0.28 0.02 0.00 0.00 177.57 178.26 1nl3 h SER 289 N -0.26 0.45 -0.17 0.57 0.02 -1.51 -0.15 113.55 112.50 1nl3 h SER 289 Ca 0.01 -0.09 0.02 0.00 -0.84 0.00 0.00 61.79 60.88 1nl3 h SER 289 Cb 0.32 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 1nl3 h SER 289 CO 0.00 0.42 0.03 1.88 -1.14 0.00 0.00 176.83 178.02 1nl3 h TYR 290 N 0.45 0.05 0.79 3.45 0.05 -1.48 0.37 116.97 120.65 1nl3 h TYR 290 Ca 0.13 0.01 -0.03 0.00 0.05 0.00 0.00 58.73 58.88 1nl3 h TYR 290 Cb 0.07 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.81 1nl3 h TYR 290 CO -0.03 0.02 -0.49 1.25 -1.05 0.00 0.00 178.16 177.86 1nl3 h LEU 291 N 0.10 -1.25 -0.52 3.88 5.85 -1.15 -0.21 115.31 122.01 1nl3 h LEU 291 Ca 0.08 0.07 0.10 0.00 0.84 0.00 0.00 57.88 58.97 1nl3 h LEU 291 Cb 0.07 0.36 -0.10 0.00 0.37 0.00 0.00 40.66 41.36 1nl3 h LEU 291 CO -0.10 -0.75 -0.19 -1.13 -0.34 0.00 0.00 178.44 175.92 1nl3 h ASN 292 N -1.21 -0.68 -0.70 1.25 -0.73 -0.81 -0.32 115.58 112.38 1nl3 h ASN 292 Ca -0.11 0.18 0.08 0.00 1.87 0.00 0.00 56.30 58.32 1nl3 h ASN 292 Cb 0.97 0.39 -0.06 0.00 0.27 0.00 0.00 38.32 39.89 1nl3 h ASN 292 CO 0.10 -0.23 0.37 0.78 -0.37 0.00 0.00 177.43 178.09 1nl3 h ASN 293 N -0.07 0.51 -0.55 1.15 -0.26 -0.11 0.35 115.58 116.60 1nl3 h ASN 293 Ca 0.24 0.05 -0.07 0.00 -0.56 0.00 0.00 56.30 55.96 1nl3 h ASN 293 Cb 0.45 -0.05 -0.02 0.00 -1.06 0.00 0.00 38.32 37.64 1nl3 h ASN 293 CO -0.57 0.31 0.09 0.00 -1.06 0.00 0.00 177.43 176.20 1nl3 h ALA 294 N 1.40 1.05 -0.38 -0.83 0.00 0.37 0.86 119.26 121.73 1nl3 h ALA 294 Ca 0.33 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1nl3 h ALA 294 Cb 0.30 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1nl3 h ALA 294 CO -0.23 0.61 -0.07 -0.07 0.00 0.00 0.00 179.25 179.48 1nl3 h LEU 295 N 0.89 0.73 -0.62 0.00 3.38 -0.25 -1.01 115.31 118.43 1nl3 h LEU 295 Ca 0.18 -0.35 0.09 0.00 0.09 0.00 0.00 57.88 57.88 1nl3 h LEU 295 Cb 0.40 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.88 1nl3 h LEU 295 CO 0.01 0.91 0.27 0.11 0.09 0.00 0.00 178.44 179.83 1nl3 h LYS 296 N 0.53 0.47 -0.52 1.13 1.57 -0.69 0.91 116.57 119.96 1nl3 h LYS 296 Ca 0.10 -0.03 0.06 0.00 -1.87 0.00 0.00 60.65 58.91 1nl3 h LYS 296 Cb 0.58 -0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.74 1nl3 h LYS 296 CO 0.03 0.31 0.24 0.00 -0.57 0.00 0.00 179.45 179.47 1nl3 h ALA 297 N 1.40 0.67 -0.12 3.86 0.00 -0.48 0.33 119.26 124.93 1nl3 h ALA 297 Ca 0.31 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 1nl3 h ALA 297 Cb 0.33 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1nl3 h ALA 297 CO -0.27 -0.12 0.03 -0.22 0.00 0.00 0.00 179.25 178.66 1nl3 h LYS 298 N 0.47 0.19 0.04 0.00 3.64 -0.65 -3.34 116.57 116.92 1nl3 h LYS 298 Ca 0.24 -0.05 -0.37 0.00 -1.27 0.00 0.00 60.65 59.21 1nl3 h LYS 298 Cb 0.19 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.94 1nl3 h LYS 298 CO -0.19 0.36 -2.23 0.39 -2.27 0.00 0.00 179.45 175.51 1nl3 n GLU 299 N -4.85 0.69 -0.00 1.90 -0.58 0.27 -4.65 120.64 113.41 1nl3 n GLU 299 Ca -0.06 0.18 0.08 0.00 -0.42 0.00 0.00 57.16 56.94 1nl3 n GLU 299 Cb 0.16 -1.61 -0.10 0.00 -0.57 0.00 0.00 31.44 29.32 1nl3 n GLU 299 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1nl3 n LEU 300 N -3.23 0.65 -4.09 -4.62 4.77 0.12 -4.91 117.00 105.69 1nl3 n LEU 300 Ca -0.36 -0.42 -0.29 0.00 -0.03 0.00 0.00 56.01 54.91 1nl3 n LEU 300 Cb 1.04 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.96 1nl3 n LEU 300 CO 0.36 0.16 -0.51 -0.36 -1.33 0.00 0.00 177.39 175.72 1nl3 s PHE 301 N -2.62 2.04 -0.14 -1.77 0.40 -1.17 -5.03 117.98 109.68 1nl3 s PHE 301 Ca 0.04 -0.91 -0.00 0.00 -0.60 0.00 0.00 56.93 55.46 1nl3 s PHE 301 Cb 0.12 -1.44 -0.01 0.00 0.51 0.00 0.00 43.02 42.20 1nl3 s PHE 301 CO 0.67 -0.44 -0.14 -1.12 0.70 0.00 0.00 175.22 174.89 1nl3 s SER 302 N 0.79 3.88 0.00 1.36 0.01 -1.26 -4.74 113.70 113.75 1nl3 s SER 302 Ca -0.10 -0.38 -0.30 0.00 1.31 0.00 0.00 55.95 56.47 1nl3 s SER 302 Cb -0.16 -1.60 -0.06 0.00 0.21 0.00 0.00 66.02 64.42 1nl3 s SER 302 CO 0.01 0.13 1.42 -0.60 0.41 0.00 0.00 173.24 174.61 1nl3 s ARG 303 N 0.57 4.28 0.00 12.44 3.52 -1.26 -1.17 118.95 137.32 1nl3 s ARG 303 Ca -0.08 1.99 0.00 0.00 -0.13 0.00 0.00 55.73 57.51 1nl3 s ARG 303 Cb -0.16 -3.57 0.00 0.00 -1.56 0.00 0.00 34.95 29.66 1nl3 s ARG 303 CO 0.03 -0.59 0.00 -0.25 -0.81 0.00 0.00 175.30 173.69 1nl3 n ASP 304 N 5.39 0.00 -0.05 -2.12 8.00 0.17 -4.83 116.55 123.11 1nl3 n ASP 304 Ca 0.13 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.57 1nl3 n ASP 304 Cb 0.43 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.51 1nl3 n ASP 304 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1nl3 n LYS 305 N -2.00 0.35 -0.06 -1.24 0.00 -0.90 -4.84 118.16 109.48 1nl3 n LYS 305 Ca 0.00 0.14 -0.10 0.00 0.00 0.00 0.00 58.31 58.35 1nl3 n LYS 305 Cb 0.00 -1.10 -0.15 0.00 0.00 0.00 0.00 35.03 33.78 1nl3 n LYS 305 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1nl3 n ASP 306 N -3.97 0.65 -3.84 3.14 8.00 -0.32 -4.80 116.55 115.41 1nl3 n ASP 306 Ca -0.09 0.20 -0.09 0.00 0.71 0.00 0.00 54.79 55.51 1nl3 n ASP 306 Cb 0.35 0.31 -0.06 0.00 -0.02 0.00 0.00 41.12 41.69 1nl3 n ASP 306 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1nl3 s TYR 307 N -2.55 0.14 0.12 1.24 -0.85 -1.24 -0.63 117.35 113.58 1nl3 s TYR 307 Ca -0.10 -0.53 0.05 0.00 -0.52 0.00 0.00 57.07 55.98 1nl3 s TYR 307 Cb 0.07 0.03 -0.04 0.00 0.38 0.00 0.00 41.96 42.40 1nl3 s TYR 307 CO 0.81 -0.64 -0.12 0.96 -1.52 0.00 0.00 175.55 175.04 1nl3 s ILE 308 N -3.88 1.16 -0.15 -3.49 -5.25 0.40 0.42 121.20 110.42 1nl3 s ILE 308 Ca 0.08 -1.72 -0.07 0.00 -0.99 0.00 0.00 60.65 57.95 1nl3 s ILE 308 Cb 0.04 -1.49 -0.04 0.00 2.95 0.00 0.00 42.46 43.91 1nl3 s ILE 308 CO -0.08 -0.50 0.11 -0.69 -1.79 0.00 0.00 174.94 171.98 1nl3 s VAL 309 N -2.37 5.20 0.00 8.37 1.01 -1.26 -1.43 120.40 129.92 1nl3 s VAL 309 Ca 0.08 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.17 1nl3 s VAL 309 Cb -0.03 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 33.05 1nl3 s VAL 309 CO 0.02 0.55 0.00 0.54 0.00 0.00 0.00 175.10 176.20 1nl3 n ARG 310 N 2.64 3.81 -2.50 2.72 3.00 -0.84 -4.95 116.66 120.54 1nl3 n ARG 310 Ca -0.18 0.00 -0.04 0.00 -0.01 0.00 0.00 57.85 57.62 1nl3 n ARG 310 Cb 0.54 -0.56 0.06 0.00 0.00 0.00 0.00 32.46 32.50 1nl3 n ARG 310 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 1nl3 n ASP 311 N -0.33 -1.29 -3.23 0.55 4.64 -1.26 -4.84 116.55 110.80 1nl3 n ASP 311 Ca 0.00 -1.94 -0.21 0.00 -1.38 0.00 0.00 54.79 51.26 1nl3 n ASP 311 Cb 0.02 0.79 0.07 0.00 -1.04 0.00 0.00 41.12 40.96 1nl3 n ASP 311 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 1nl3 n GLY 312 N -0.69 -0.37 2.84 0.27 0.00 -1.26 -5.02 105.19 100.96 1nl3 n GLY 312 Ca -0.13 0.14 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 1nl3 n GLY 312 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nl3 s GLU 313 N -6.11 0.67 -0.40 1.61 0.41 -1.26 -4.86 118.70 108.75 1nl3 s GLU 313 Ca 0.49 0.00 -0.22 0.00 -0.41 0.00 0.00 54.97 54.83 1nl3 s GLU 313 Cb -0.22 -0.84 0.02 0.00 -1.78 0.00 0.00 34.13 31.31 1nl3 s GLU 313 CO 0.64 -0.17 0.74 0.08 -0.49 0.00 0.00 175.26 176.06 1nl3 s VAL 314 N 1.33 4.74 -0.19 2.63 1.01 -1.26 -2.00 120.40 126.66 1nl3 s VAL 314 Ca -0.05 0.58 -0.01 0.00 0.00 0.00 0.00 61.98 62.50 1nl3 s VAL 314 Cb -0.13 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.02 1nl3 s VAL 314 CO -0.02 -0.54 -0.12 -0.76 0.00 0.00 0.00 175.10 173.66 1nl3 s LEU 315 N 3.08 2.54 0.17 3.92 1.43 -0.52 -4.94 118.68 124.36 1nl3 s LEU 315 Ca 0.29 -0.50 -0.30 0.00 -1.03 0.00 0.00 54.13 52.59 1nl3 s LEU 315 Cb -0.13 -1.61 -0.08 0.00 0.03 0.00 0.00 46.19 44.40 1nl3 s LEU 315 CO 0.19 0.01 1.12 -0.63 0.23 0.00 0.00 176.35 177.27 1nl3 s ILE 316 N 1.25 3.84 0.09 -0.59 1.01 -1.26 -0.45 121.20 125.09 1nl3 s ILE 316 Ca 0.03 1.57 0.08 0.00 0.00 0.00 0.00 60.65 62.33 1nl3 s ILE 316 Cb -0.14 -4.00 -0.04 0.00 0.01 0.00 0.00 42.46 38.29 1nl3 s ILE 316 CO -0.06 0.26 -0.16 0.68 0.00 0.00 0.00 174.94 175.66 1nl3 s VAL 317 N -0.15 2.98 0.92 2.92 -7.23 0.20 -0.70 120.40 119.35 1nl3 s VAL 317 Ca 0.50 -1.35 -0.12 0.00 -1.81 0.00 0.00 61.98 59.20 1nl3 s VAL 317 Cb -0.30 -2.35 0.06 0.00 0.56 0.00 0.00 36.38 34.36 1nl3 s VAL 317 CO 0.35 0.17 0.65 -0.67 -0.31 0.00 0.00 175.10 175.29 1nl3 n ASP 318 N 0.99 -1.23 0.00 4.85 -0.08 -1.16 -4.57 116.55 115.34 1nl3 n ASP 318 Ca -0.15 0.38 0.00 0.00 -1.51 0.00 0.00 54.79 53.51 1nl3 n ASP 318 Cb 0.52 -1.29 0.00 0.00 2.34 0.00 0.00 41.12 42.69 1nl3 n ASP 318 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 1nl3 n GLU 319 N -2.38 0.00 0.00 -0.67 2.13 -1.26 -3.65 120.64 114.81 1nl3 n GLU 319 Ca 0.09 0.75 0.00 0.00 0.66 0.00 0.00 57.16 58.66 1nl3 n GLU 319 Cb 0.53 -1.45 0.00 0.00 0.27 0.00 0.00 31.44 30.78 1nl3 n GLU 319 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 1nl3 n PHE 320 N -2.43 0.00 -0.10 4.31 7.35 -1.26 -4.65 117.46 120.69 1nl3 n PHE 320 Ca 0.00 -0.21 -0.10 0.00 -0.76 0.00 0.00 57.45 56.38 1nl3 n PHE 320 Cb 0.00 -0.02 -0.02 0.00 0.35 0.00 0.00 39.48 39.78 1nl3 n PHE 320 CO 0.00 0.00 0.00 1.15 -0.76 0.00 0.00 176.76 177.15 1nl3 h THR 321 N 1.35 1.18 0.00 -2.13 2.02 -1.98 -3.47 112.91 109.88 1nl3 h THR 321 Ca 0.00 -0.53 0.00 0.00 0.77 0.00 0.00 66.41 66.65 1nl3 h THR 321 Cb 0.68 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 68.05 1nl3 h THR 321 CO 0.00 0.18 0.00 0.61 0.37 0.00 0.00 175.52 176.68 1nl3 n GLY 322 N -0.76 0.75 3.45 2.16 0.00 -1.24 -5.00 105.19 104.55 1nl3 n GLY 322 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 1nl3 n GLY 322 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1nl3 s ARG 323 N -0.50 3.56 -0.44 1.61 3.00 -1.26 -4.78 118.95 120.13 1nl3 s ARG 323 Ca 0.00 -0.58 -0.41 0.00 -1.00 0.00 0.00 55.73 53.73 1nl3 s ARG 323 Cb 0.00 -2.80 -0.17 0.00 0.00 0.00 0.00 34.95 31.98 1nl3 s ARG 323 CO 0.00 0.24 2.09 0.28 0.00 0.00 0.00 175.30 177.91 1nl3 n VAL 324 N 3.51 0.07 -2.42 7.11 0.31 -1.26 -3.00 118.33 122.65 1nl3 n VAL 324 Ca -0.18 -0.08 -0.39 0.00 -0.01 0.00 0.00 64.34 63.69 1nl3 n VAL 324 Cb 0.53 -0.87 -0.03 0.00 -0.91 0.00 0.00 33.84 32.55 1nl3 n VAL 324 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1nl3 s LEU 325 N 6.01 3.30 0.37 7.52 1.43 0.13 -4.96 118.68 132.48 1nl3 s LEU 325 Ca 1.15 -0.72 -0.26 0.00 -1.03 0.00 0.00 54.13 53.26 1nl3 s LEU 325 Cb -1.29 -2.56 -0.09 0.00 0.03 0.00 0.00 46.19 42.28 1nl3 s LEU 325 CO 0.62 -1.91 1.16 -0.51 0.23 0.00 0.00 176.35 175.94 1nl3 s ILE 326 N 6.47 3.23 0.00 -0.59 1.10 -1.26 -3.20 121.20 126.95 1nl3 s ILE 326 Ca 0.48 1.08 0.00 0.00 -0.51 0.00 0.00 60.65 61.69 1nl3 s ILE 326 Cb -0.06 -3.62 0.00 0.00 0.15 0.00 0.00 42.46 38.93 1nl3 s ILE 326 CO 0.05 0.14 0.00 0.61 -2.11 0.00 0.00 174.94 173.63 1nl3 n GLY 327 N 0.71 2.75 3.57 1.50 0.00 -1.26 -4.94 105.19 107.51 1nl3 n GLY 327 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1nl3 n GLY 327 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1nl3 s ARG 328 N -0.74 3.70 0.36 1.61 6.06 -1.20 -4.85 118.95 123.90 1nl3 s ARG 328 Ca 0.00 -0.04 0.08 0.00 -2.50 0.00 0.00 55.73 53.28 1nl3 s ARG 328 Cb 0.00 -3.78 -0.05 0.00 0.06 0.00 0.00 34.95 31.17 1nl3 s ARG 328 CO 0.00 -0.62 0.06 -0.98 -2.50 0.00 0.00 175.30 171.27 1nl3 s ARG 329 N 2.45 2.15 0.73 5.12 1.70 -1.26 -4.17 118.95 125.66 1nl3 s ARG 329 Ca 0.20 -1.76 -0.12 0.00 -0.47 0.00 0.00 55.73 53.59 1nl3 s ARG 329 Cb -0.15 -1.96 0.03 0.00 -0.57 0.00 0.00 34.95 32.30 1nl3 s ARG 329 CO 0.13 0.07 1.11 0.71 -1.08 0.00 0.00 175.30 176.24 1nl3 s TYR 330 N -2.53 3.21 0.06 5.89 2.02 -1.26 -5.02 117.35 119.73 1nl3 s TYR 330 Ca 0.36 1.03 0.04 0.00 -0.37 0.00 0.00 57.07 58.13 1nl3 s TYR 330 Cb 0.01 -3.13 -0.04 0.00 -0.40 0.00 0.00 41.96 38.40 1nl3 s TYR 330 CO 0.20 -1.34 -0.00 -0.80 -1.57 0.00 0.00 175.55 172.05 1nl3 s ASN 331 N -4.32 5.04 -1.15 2.29 0.01 -1.26 -3.97 114.94 111.58 1nl3 s ASN 331 Ca 0.59 -0.13 -0.05 0.00 -0.71 0.00 0.00 52.86 52.57 1nl3 s ASN 331 Cb -0.12 -1.23 -0.03 0.00 0.41 0.00 0.00 41.25 40.28 1nl3 s ASN 331 CO 0.52 0.21 0.89 -0.62 -1.51 0.00 0.00 177.10 176.59 1nl3 n GLU 332 N 0.81 -4.04 -1.06 -0.60 1.02 -1.26 -2.36 120.64 113.16 1nl3 n GLU 332 Ca -0.12 0.77 -0.02 0.00 -0.02 0.00 0.00 57.16 57.77 1nl3 n GLU 332 Cb 0.52 -5.54 -0.01 0.00 -0.02 0.00 0.00 31.44 26.39 1nl3 n GLU 332 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nl3 n GLY 333 N -1.31 0.34 0.15 0.62 0.00 -1.26 -4.88 105.19 98.84 1nl3 n GLY 333 Ca -0.19 -0.04 -0.15 0.00 0.00 0.00 0.00 46.02 45.64 1nl3 n GLY 333 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1nl3 h MET 334 N 0.25 0.41 0.21 1.61 2.86 -1.72 -2.92 114.93 115.63 1nl3 h MET 334 Ca -0.04 -0.48 0.01 0.00 -2.06 0.00 0.00 59.70 57.13 1nl3 h MET 334 Cb 0.75 0.15 -0.04 0.00 0.06 0.00 0.00 31.60 32.52 1nl3 h MET 334 CO 0.06 1.15 -0.37 1.25 1.06 0.00 0.00 176.91 180.06 1nl3 h HIS 335 N 0.21 -1.02 -0.67 -0.22 2.76 -1.80 0.83 115.15 115.23 1nl3 h HIS 335 Ca -0.10 0.02 0.14 0.00 -2.20 0.00 0.00 60.37 58.23 1nl3 h HIS 335 Cb 1.67 0.42 -0.12 0.00 1.55 0.00 0.00 27.41 30.93 1nl3 h HIS 335 CO 0.07 -0.49 -0.08 1.96 -1.30 0.00 0.00 177.93 178.08 1nl3 h GLN 336 N -0.66 0.05 -0.34 5.26 7.50 -1.91 0.41 115.11 125.42 1nl3 h GLN 336 Ca 0.01 -0.00 0.02 0.00 0.50 0.00 0.00 58.65 59.18 1nl3 h GLN 336 Cb 0.65 -0.01 -0.03 0.00 0.05 0.00 0.00 27.48 28.14 1nl3 h GLN 336 CO -0.16 0.03 0.17 0.00 -1.50 0.00 0.00 178.83 177.37 1nl3 h ALA 337 N 1.65 0.42 -0.34 3.87 0.00 -1.24 0.18 119.26 123.79 1nl3 h ALA 337 Ca 0.34 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.27 1nl3 h ALA 337 Cb 0.56 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1nl3 h ALA 337 CO -0.64 -0.20 0.21 0.82 0.00 0.00 0.00 179.25 179.45 1nl3 h ILE 338 N 0.36 1.06 -0.45 0.00 2.04 -0.04 0.27 117.51 120.75 1nl3 h ILE 338 Ca 0.14 -0.15 0.09 0.00 1.00 0.00 0.00 64.86 65.94 1nl3 h ILE 338 Cb 0.04 0.59 -0.09 0.00 -0.74 0.00 0.00 36.82 36.62 1nl3 h ILE 338 CO -0.09 0.08 -0.18 -0.33 0.00 0.00 0.00 178.15 177.63 1nl3 h GLU 339 N 0.43 -0.08 -0.42 2.37 5.08 -0.49 -1.13 114.58 120.34 1nl3 h GLU 339 Ca 0.13 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.46 1nl3 h GLU 339 Cb -0.02 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1nl3 h GLU 339 CO -0.05 -0.05 0.14 0.00 -1.00 0.00 0.00 179.01 178.05 1nl3 h ALA 340 N 1.27 0.55 -0.64 3.43 0.00 0.10 -2.12 119.26 121.84 1nl3 h ALA 340 Ca 0.22 -0.16 0.13 0.00 0.00 0.00 0.00 54.91 55.09 1nl3 h ALA 340 Cb 0.42 -0.16 -0.12 0.00 0.00 0.00 0.00 17.79 17.92 1nl3 h ALA 340 CO -0.51 0.18 -0.14 -0.22 0.00 0.00 0.00 179.25 178.56 1nl3 h LYS 341 N 0.53 0.01 -0.96 0.00 3.64 0.08 -1.38 116.57 118.49 1nl3 h LYS 341 Ca 0.14 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 1nl3 h LYS 341 Cb 0.24 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1nl3 h LYS 341 CO -0.01 0.01 0.02 0.39 -2.27 0.00 0.00 179.45 177.59 1nl3 n GLU 342 N -5.42 1.43 -2.22 1.90 -0.58 -0.48 -4.86 120.64 110.40 1nl3 n GLU 342 Ca 0.08 -0.41 -0.05 0.00 -0.42 0.00 0.00 57.16 56.35 1nl3 n GLU 342 Cb 0.34 -1.49 -0.01 0.00 -0.57 0.00 0.00 31.44 29.72 1nl3 n GLU 342 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1nl3 n HIS 343 N 0.13 -1.56 -2.18 -0.32 8.25 -0.52 -4.90 115.22 114.12 1nl3 n HIS 343 Ca 0.05 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.09 1nl3 n HIS 343 Cb 0.45 -1.71 -0.03 0.00 1.12 0.00 0.00 29.99 29.82 1nl3 n HIS 343 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1nl3 s VAL 344 N -2.10 3.11 0.05 1.59 1.01 -1.05 -4.95 120.40 118.07 1nl3 s VAL 344 Ca 0.00 0.92 -0.38 0.00 0.00 0.00 0.00 61.98 62.52 1nl3 s VAL 344 Cb 0.00 -3.59 -0.18 0.00 0.00 0.00 0.00 36.38 32.61 1nl3 s VAL 344 CO 0.00 0.14 1.26 1.21 0.00 0.00 0.00 175.10 177.71 1nl3 n GLU 345 N 2.51 0.77 -3.42 2.72 4.07 -1.26 -4.78 120.64 121.26 1nl3 n GLU 345 Ca 0.06 0.28 -0.41 0.00 -0.06 0.00 0.00 57.16 57.03 1nl3 n GLU 345 Cb 0.42 -1.88 -0.10 0.00 -0.06 0.00 0.00 31.44 29.83 1nl3 n GLU 345 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 1nl3 s ILE 346 N 0.37 5.19 0.21 6.31 1.10 -1.26 -5.00 121.20 128.12 1nl3 s ILE 346 Ca 0.87 0.02 0.06 0.00 -0.51 0.00 0.00 60.65 61.09 1nl3 s ILE 346 Cb -1.06 -3.80 -0.04 0.00 0.15 0.00 0.00 42.46 37.71 1nl3 s ILE 346 CO 0.50 -0.07 0.23 -1.59 -2.11 0.00 0.00 174.94 171.90 1nl3 s LYS 347 N 1.98 3.09 0.22 3.50 -2.85 -1.26 -5.08 119.74 119.33 1nl3 s LYS 347 Ca 0.11 -0.89 -0.31 0.00 -1.00 0.00 0.00 55.97 53.88 1nl3 s LYS 347 Cb -0.17 -2.70 -0.10 0.00 -2.06 0.00 0.00 37.83 32.80 1nl3 s LYS 347 CO 0.11 0.44 1.48 0.00 0.10 0.00 0.00 175.35 177.49 1nl3 s ALA 348 N -1.96 3.67 -0.05 0.59 0.00 -1.26 -5.02 121.76 117.74 1nl3 s ALA 348 Ca 0.33 1.34 -0.03 0.00 0.00 0.00 0.00 51.96 53.60 1nl3 s ALA 348 Cb -0.09 -3.58 0.03 0.00 0.00 0.00 0.00 23.12 19.48 1nl3 s ALA 348 CO 0.26 -0.76 0.12 -1.21 0.00 0.00 0.00 175.76 174.17 1nl3 s GLU 349 N 0.13 0.09 0.23 0.00 0.41 -1.26 -5.10 118.70 113.20 1nl3 s GLU 349 Ca 0.63 0.27 0.07 0.00 -0.41 0.00 0.00 54.97 55.53 1nl3 s GLU 349 Cb -0.42 -0.11 -0.04 0.00 -1.78 0.00 0.00 34.13 31.78 1nl3 s GLU 349 CO 0.39 -0.11 0.13 -0.80 -0.49 0.00 0.00 175.26 174.37 1nl3 s ASN 350 N 0.78 5.25 0.12 -0.19 0.01 -1.26 -1.85 114.94 117.80 1nl3 s ASN 350 Ca -0.06 -0.32 -0.18 0.00 -0.71 0.00 0.00 52.86 51.58 1nl3 s ASN 350 Cb -0.08 -1.26 0.04 0.00 0.41 0.00 0.00 41.25 40.37 1nl3 s ASN 350 CO -0.04 0.00 0.46 0.00 -1.51 0.00 0.00 177.10 176.01 1nl3 s GLN 351 N -3.59 1.10 0.14 -0.60 -2.07 0.16 -4.90 119.66 109.90 1nl3 s GLN 351 Ca 0.32 -0.58 -0.34 0.00 -1.82 0.00 0.00 55.36 52.93 1nl3 s GLN 351 Cb -0.08 0.49 -0.14 0.00 -1.09 0.00 0.00 33.01 32.19 1nl3 s GLN 351 CO 0.23 -0.44 1.54 2.41 -1.32 0.00 0.00 175.29 177.72 1nl3 n THR 352 N -0.14 0.02 -0.01 3.63 -1.04 -1.26 -2.08 114.28 113.41 1nl3 n THR 352 Ca -0.17 -0.00 0.02 0.00 -2.04 0.00 0.00 64.05 61.86 1nl3 n THR 352 Cb 0.63 -1.41 -0.05 0.00 -1.82 0.00 0.00 70.33 67.68 1nl3 n THR 352 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1nl3 n LEU 353 N 3.36 0.00 -3.65 -4.42 4.77 -0.27 -4.56 117.00 112.23 1nl3 n LEU 353 Ca 0.17 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 56.02 1nl3 n LEU 353 Cb 0.27 0.04 -0.07 0.00 -2.33 0.00 0.00 43.42 41.33 1nl3 n LEU 353 CO 0.64 0.04 0.19 0.00 -1.33 0.00 0.00 177.39 176.92 1nl3 s ALA 354 N -2.40 -1.12 0.09 -1.18 0.00 -1.01 -4.98 121.76 111.14 1nl3 s ALA 354 Ca -0.03 0.51 -0.23 0.00 0.00 0.00 0.00 51.96 52.22 1nl3 s ALA 354 Cb 0.04 0.24 0.06 0.00 0.00 0.00 0.00 23.12 23.45 1nl3 s ALA 354 CO 0.28 -0.41 0.55 0.95 0.00 0.00 0.00 175.76 177.13 1nl3 s THR 355 N -2.01 0.02 -0.10 0.00 -4.23 -1.26 -2.21 115.64 105.86 1nl3 s THR 355 Ca -0.08 -0.18 -0.30 0.00 -1.18 0.00 0.00 61.69 59.96 1nl3 s THR 355 Cb -0.02 -1.01 0.07 0.00 1.34 0.00 0.00 72.50 72.88 1nl3 s THR 355 CO 0.01 -0.10 0.71 -0.51 -0.54 0.00 0.00 174.62 174.20 1nl3 s ILE 356 N -2.97 0.00 0.60 2.99 2.07 -1.14 -5.01 121.20 117.75 1nl3 s ILE 356 Ca -0.02 0.00 -0.07 0.00 -1.41 0.00 0.00 60.65 59.14 1nl3 s ILE 356 Cb -0.00 -1.00 -0.00 0.00 0.13 0.00 0.00 42.46 41.59 1nl3 s ILE 356 CO -0.06 0.00 0.94 0.42 -1.91 0.00 0.00 174.94 174.33 1nl3 s THR 357 N -0.89 3.90 0.31 4.00 -4.23 -1.26 -1.51 115.64 115.97 1nl3 s THR 357 Ca -0.08 0.22 0.02 0.00 -1.18 0.00 0.00 61.69 60.67 1nl3 s THR 357 Cb -0.01 -3.56 0.15 0.00 1.34 0.00 0.00 72.50 70.42 1nl3 s THR 357 CO 0.08 -0.62 1.84 -0.07 -0.54 0.00 0.00 174.62 175.30 1nl3 h LEU 358 N -0.23 0.59 0.05 4.79 3.38 -1.84 -0.47 115.31 121.56 1nl3 h LEU 358 Ca -0.45 -0.12 -0.00 0.00 0.09 0.00 0.00 57.88 57.40 1nl3 h LEU 358 Cb 1.24 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 1nl3 h LEU 358 CO 0.62 0.65 -0.08 1.56 0.09 0.00 0.00 178.44 181.28 1nl3 h GLN 359 N 0.60 -0.13 0.00 1.13 7.50 -1.90 -0.70 115.11 121.60 1nl3 h GLN 359 Ca 0.13 0.01 -0.02 0.00 0.50 0.00 0.00 58.65 59.26 1nl3 h GLN 359 Cb 0.36 0.03 -0.00 0.00 0.05 0.00 0.00 27.48 27.92 1nl3 h GLN 359 CO 0.01 -0.09 -0.10 -0.91 -1.50 0.00 0.00 178.83 176.24 1nl3 h ASN 360 N -0.13 0.00 0.41 1.46 2.35 -1.94 -1.93 115.58 115.80 1nl3 h ASN 360 Ca -0.01 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.72 1nl3 h ASN 360 Cb 0.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.50 1nl3 h ASN 360 CO -0.03 0.10 -0.20 0.22 -1.65 0.00 0.00 177.43 175.88 1nl3 h TYR 361 N 0.00 -0.52 0.00 1.19 3.20 -0.86 -3.15 116.97 116.83 1nl3 h TYR 361 Ca -0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1nl3 h TYR 361 Cb 0.33 0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.77 1nl3 h TYR 361 CO 0.00 -0.21 0.00 0.74 -1.64 0.00 0.00 178.16 177.05 1nl3 h PHE 362 N -0.81 0.00 0.00 -3.82 0.04 -0.90 -1.63 116.94 109.82 1nl3 h PHE 362 Ca -0.06 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.71 1nl3 h PHE 362 Cb 0.54 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.69 1nl3 h PHE 362 CO 0.00 0.00 0.00 0.54 -0.60 0.00 0.00 178.31 178.25 1nl3 n ARG 363 N -2.53 0.16 0.22 1.51 1.74 -0.75 -2.97 116.66 114.04 1nl3 n ARG 363 Ca 0.02 0.18 0.12 0.00 -0.77 0.00 0.00 57.85 57.40 1nl3 n ARG 363 Cb 0.28 -1.50 0.19 0.00 -1.02 0.00 0.00 32.46 30.41 1nl3 n ARG 363 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1nl3 h LEU 364 N 0.00 0.00 -9.79 0.55 3.38 -1.34 -3.46 115.31 104.64 1nl3 h LEU 364 Ca 0.00 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.48 1nl3 h LEU 364 Cb 0.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1nl3 h LEU 364 CO 0.00 0.00 0.39 -0.31 0.09 0.00 0.00 178.44 178.61 1nl3 s TYR 365 N -3.21 3.81 0.29 1.13 1.51 -1.16 -4.74 117.35 114.98 1nl3 s TYR 365 Ca 0.07 1.83 -0.00 0.00 -1.01 0.00 0.00 57.07 57.96 1nl3 s TYR 365 Cb 0.05 -3.06 0.44 0.00 -0.11 0.00 0.00 41.96 39.28 1nl3 s TYR 365 CO 0.67 0.10 1.84 -0.44 -1.11 0.00 0.00 175.55 176.60 1nl3 h ASP 366 N 3.87 0.72 -4.42 2.29 3.32 -1.08 -3.43 116.42 117.69 1nl3 h ASP 366 Ca -0.46 -0.13 -0.42 0.00 0.02 0.00 0.00 57.03 56.04 1nl3 h ASP 366 Cb 1.20 -0.19 -0.21 0.00 0.22 0.00 0.00 39.33 40.35 1nl3 h ASP 366 CO 0.67 0.72 -0.78 -0.75 -1.72 0.00 0.00 179.24 177.38 1nl3 s LYS 367 N -5.17 0.86 -0.09 3.56 2.20 0.37 -5.01 119.74 116.46 1nl3 s LYS 367 Ca -0.09 -1.00 -0.05 0.00 -0.36 0.00 0.00 55.97 54.47 1nl3 s LYS 367 Cb 0.15 -0.87 0.04 0.00 -1.51 0.00 0.00 37.83 35.65 1nl3 s LYS 367 CO 0.79 0.19 0.21 -1.17 -0.36 0.00 0.00 175.35 175.02 1nl3 s LEU 368 N -1.83 0.61 0.29 5.43 2.96 -1.26 -2.11 118.68 122.76 1nl3 s LEU 368 Ca -0.00 0.45 -0.05 0.00 -0.22 0.00 0.00 54.13 54.31 1nl3 s LEU 368 Cb -0.09 0.64 -0.01 0.00 0.50 0.00 0.00 46.19 47.22 1nl3 s LEU 368 CO 0.02 -0.15 0.40 0.00 -1.32 0.00 0.00 176.35 175.30 1nl3 s ALA 369 N 1.07 0.62 0.15 5.97 0.00 -0.44 -4.02 121.76 125.11 1nl3 s ALA 369 Ca -0.08 -1.40 -0.25 0.00 0.00 0.00 0.00 51.96 50.24 1nl3 s ALA 369 Cb -0.09 1.20 0.06 0.00 0.00 0.00 0.00 23.12 24.28 1nl3 s ALA 369 CO -0.07 -0.76 0.84 0.20 0.00 0.00 0.00 175.76 175.98 1nl3 s GLY 370 N -3.17 -0.29 0.06 0.00 0.00 -1.16 0.38 107.32 103.14 1nl3 s GLY 370 Ca 0.30 0.24 0.03 0.00 0.00 0.00 0.00 44.72 45.30 1nl3 s GLY 370 CO 0.16 0.07 -0.10 1.06 0.00 0.00 0.00 173.10 174.28 1nl3 s MET 371 N -3.46 0.67 0.00 2.90 1.00 -0.65 -0.52 119.30 119.24 1nl3 s MET 371 Ca 0.09 -0.89 0.00 0.00 0.00 0.00 0.00 55.69 54.89 1nl3 s MET 371 Cb -0.02 -0.51 0.00 0.00 0.00 0.00 0.00 34.83 34.30 1nl3 s MET 371 CO -0.01 0.10 0.00 -2.37 0.00 0.00 0.00 175.02 172.74 1nl3 n THR 372 N 1.26 0.00 0.59 2.05 5.66 -1.18 -1.44 114.28 121.22 1nl3 n THR 372 Ca -0.21 0.00 0.12 0.00 -3.05 0.00 0.00 64.05 60.91 1nl3 n THR 372 Cb 0.55 0.00 0.45 0.00 -1.55 0.00 0.00 70.33 69.78 1nl3 n THR 372 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1nl3 n GLY 373 N -0.20 -1.47 2.69 1.09 0.00 -1.05 -0.52 105.19 105.73 1nl3 n GLY 373 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1nl3 n GLY 373 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1nl3 s THR 374 N -3.15 -0.27 0.00 2.61 -4.23 -1.26 -4.69 115.64 104.65 1nl3 s THR 374 Ca 0.09 -0.40 0.00 0.00 -1.18 0.00 0.00 61.69 60.20 1nl3 s THR 374 Cb 0.12 -0.84 0.00 0.00 1.34 0.00 0.00 72.50 73.12 1nl3 s THR 374 CO 0.49 -0.42 0.00 0.00 -0.54 0.00 0.00 174.62 174.14 1nl3 n ALA 375 N 5.30 0.08 -0.20 3.99 0.00 -1.26 -4.61 120.51 123.81 1nl3 n ALA 375 Ca -0.05 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.50 1nl3 n ALA 375 Cb 0.47 0.00 0.40 0.00 0.00 0.00 0.00 19.45 20.32 1nl3 n ALA 375 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1nl3 h GLN 376 N 0.00 0.62 0.00 0.00 1.08 -1.95 0.30 115.11 115.17 1nl3 h GLN 376 Ca 0.00 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 1nl3 h GLN 376 Cb 0.00 -0.14 0.00 0.00 -0.05 0.00 0.00 27.48 27.29 1nl3 h GLN 376 CO 0.00 0.41 0.00 0.25 -0.95 0.00 0.00 178.83 178.54 1nl3 n THR 377 N -4.51 0.44 -0.21 -0.54 -2.24 -1.26 -2.32 114.28 103.64 1nl3 n THR 377 Ca 0.14 0.11 0.03 0.00 -2.27 0.00 0.00 64.05 62.06 1nl3 n THR 377 Cb 0.38 -0.80 0.08 0.00 -2.10 0.00 0.00 70.33 67.89 1nl3 n THR 377 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1nl3 n GLU 378 N -1.29 2.81 -0.23 -0.78 -0.58 0.10 -4.79 120.64 115.89 1nl3 n GLU 378 Ca 0.09 -1.86 0.01 0.00 -0.42 0.00 0.00 57.16 54.97 1nl3 n GLU 378 Cb 0.15 -1.19 0.09 0.00 -0.57 0.00 0.00 31.44 29.92 1nl3 n GLU 378 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1nl3 h ALA 379 N 0.81 0.51 -0.62 0.62 0.00 -1.10 0.81 119.26 120.29 1nl3 h ALA 379 Ca 0.00 0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 1nl3 h ALA 379 Cb 0.68 0.47 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 1nl3 h ALA 379 CO 0.01 -0.42 0.32 0.00 0.00 0.00 0.00 179.25 179.17 1nl3 h ALA 380 N 1.65 0.80 -0.11 0.00 0.00 -1.87 0.12 119.26 119.85 1nl3 h ALA 380 Ca 0.33 -0.12 -0.19 0.00 0.00 0.00 0.00 54.91 54.93 1nl3 h ALA 380 Cb 0.52 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1nl3 h ALA 380 CO -0.66 0.34 -0.72 1.49 0.00 0.00 0.00 179.25 179.70 1nl3 h GLU 381 N 0.85 0.53 -0.16 0.00 4.81 -1.73 -0.23 114.58 118.66 1nl3 h GLU 381 Ca 0.22 -0.42 -0.08 0.00 -0.13 0.00 0.00 59.36 58.94 1nl3 h GLU 381 Cb 0.07 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 1nl3 h GLU 381 CO -0.03 1.05 -0.27 -0.07 -0.73 0.00 0.00 179.01 178.96 1nl3 h LEU 382 N 0.37 0.29 0.13 1.64 3.38 -0.36 -0.28 115.31 120.49 1nl3 h LEU 382 Ca -0.03 -0.09 -0.26 0.00 0.09 0.00 0.00 57.88 57.59 1nl3 h LEU 382 Cb 1.30 -0.08 0.03 0.00 0.09 0.00 0.00 40.66 42.00 1nl3 h LEU 382 CO 0.13 0.56 -1.09 -0.74 0.09 0.00 0.00 178.44 177.39 1nl3 h HIS 383 N 0.26 0.85 -0.37 1.13 2.76 -0.84 -1.70 115.15 117.24 1nl3 h HIS 383 Ca 0.04 -0.56 -0.15 0.00 -2.20 0.00 0.00 60.37 57.50 1nl3 h HIS 383 Cb 0.61 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 29.51 1nl3 h HIS 383 CO 0.01 1.41 -0.37 1.49 -1.30 0.00 0.00 177.93 179.17 1nl3 h GLU 384 N 0.06 0.88 0.11 5.26 4.57 -0.78 -1.73 114.58 122.95 1nl3 h GLU 384 Ca -0.17 -0.45 -0.32 0.00 -1.18 0.00 0.00 59.36 57.24 1nl3 h GLU 384 Cb 1.81 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 30.39 1nl3 h GLU 384 CO 0.21 1.10 -1.69 0.82 -1.18 0.00 0.00 179.01 178.26 1nl3 h ILE 385 N 0.72 0.96 0.00 2.32 1.08 -1.19 -3.42 117.51 117.99 1nl3 h ILE 385 Ca 0.06 -2.65 0.00 0.00 -0.39 0.00 0.00 64.86 61.89 1nl3 h ILE 385 Cb 0.95 2.65 0.00 0.00 -3.07 0.00 0.00 36.82 37.34 1nl3 h ILE 385 CO 0.09 0.79 -0.02 -1.22 -0.69 0.00 0.00 178.15 177.10 1nl3 n TYR 386 N -3.41 0.00 -3.62 1.37 4.01 -0.88 -4.97 117.16 109.67 1nl3 n TYR 386 Ca -0.21 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.29 1nl3 n TYR 386 Cb 1.05 -0.00 0.07 0.00 -0.31 0.00 0.00 39.34 40.15 1nl3 n TYR 386 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1nl3 n LYS 387 N -1.01 -7.36 -3.78 -0.72 5.02 -0.65 -4.97 118.16 104.69 1nl3 n LYS 387 Ca 0.00 0.79 -0.36 0.00 -2.02 0.00 0.00 58.31 56.72 1nl3 n LYS 387 Cb 0.01 -5.81 -0.13 0.00 -0.02 0.00 0.00 35.03 29.08 1nl3 n LYS 387 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1nl3 s LEU 388 N -7.15 3.42 0.58 -0.35 1.43 -0.70 -4.94 118.68 110.98 1nl3 s LEU 388 Ca 0.49 -0.34 -0.12 0.00 -1.03 0.00 0.00 54.13 53.13 1nl3 s LEU 388 Cb -0.22 -1.88 -0.05 0.00 0.03 0.00 0.00 46.19 44.07 1nl3 s LEU 388 CO 0.75 -0.06 0.99 -0.83 0.23 0.00 0.00 176.35 177.42 1nl3 s GLY 389 N 1.57 1.74 -0.17 -3.19 0.00 -1.26 -3.23 107.32 102.77 1nl3 s GLY 389 Ca 0.06 -0.08 0.01 0.00 0.00 0.00 0.00 44.72 44.71 1nl3 s GLY 389 CO 0.02 0.18 -0.19 0.14 0.00 0.00 0.00 173.10 173.26 1nl3 s VAL 390 N -3.00 2.21 -0.23 1.40 1.01 -1.26 -0.41 120.40 120.13 1nl3 s VAL 390 Ca 0.55 -0.90 -0.05 0.00 0.00 0.00 0.00 61.98 61.57 1nl3 s VAL 390 Cb -0.11 -1.92 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 1nl3 s VAL 390 CO 0.48 0.53 0.00 -0.69 0.00 0.00 0.00 175.10 175.42 1nl3 s VAL 391 N 1.13 3.79 -0.37 2.92 1.01 -0.14 -4.90 120.40 123.85 1nl3 s VAL 391 Ca 0.01 -0.35 -0.29 0.00 0.00 0.00 0.00 61.98 61.35 1nl3 s VAL 391 Cb -0.14 -2.74 0.02 0.00 0.00 0.00 0.00 36.38 33.52 1nl3 s VAL 391 CO -0.08 0.39 1.09 -0.44 0.00 0.00 0.00 175.10 176.07 1nl3 s SER 392 N 1.45 6.84 0.12 3.32 0.01 -1.26 -0.46 113.70 123.72 1nl3 s SER 392 Ca 0.05 0.87 -0.25 0.00 1.31 0.00 0.00 55.95 57.93 1nl3 s SER 392 Cb -0.15 -2.54 -0.07 0.00 0.21 0.00 0.00 66.02 63.47 1nl3 s SER 392 CO 0.00 -1.00 0.77 -0.63 0.41 0.00 0.00 173.24 172.79 1nl3 s ILE 393 N 3.90 4.52 0.53 1.44 -1.09 -0.48 -4.95 121.20 125.07 1nl3 s ILE 393 Ca 0.46 1.67 -0.21 0.00 -2.23 0.00 0.00 60.65 60.34 1nl3 s ILE 393 Cb -0.11 -4.13 -0.05 0.00 -1.58 0.00 0.00 42.46 36.59 1nl3 s ILE 393 CO 0.20 0.46 1.26 -2.84 -1.23 0.00 0.00 174.94 172.79 1nl3 s PRO 394 N -0.70 3.30 0.66 2.79 0.02 -1.26 -4.76 135.00 135.05 1nl3 s PRO 394 Ca 0.37 1.98 -0.13 0.00 0.02 0.00 0.00 61.00 63.24 1nl3 s PRO 394 Cb -0.22 -2.22 -0.00 0.00 0.02 0.00 0.00 34.50 32.07 1nl3 s PRO 394 CO 0.25 -0.99 1.07 0.95 -0.33 0.00 0.00 177.00 177.95 1nl3 s THR 395 N -1.45 3.69 0.11 0.99 -4.23 -1.26 -4.85 115.64 108.63 1nl3 s THR 395 Ca 0.70 0.68 -0.26 0.00 -1.18 0.00 0.00 61.69 61.64 1nl3 s THR 395 Cb -0.34 -3.26 -0.10 0.00 1.34 0.00 0.00 72.50 70.14 1nl3 s THR 395 CO 0.40 -0.59 1.66 -1.13 -0.54 0.00 0.00 174.62 174.42 1nl3 h ASN 396 N -0.22 -0.55 -2.20 3.99 -0.00 -1.95 -3.43 115.58 111.22 1nl3 h ASN 396 Ca -0.45 0.06 -0.56 0.00 -0.00 0.00 0.00 56.30 55.35 1nl3 h ASN 396 Cb 1.22 0.21 -0.10 0.00 -0.00 0.00 0.00 38.32 39.65 1nl3 h ASN 396 CO 0.56 -0.28 -0.65 -0.04 -0.00 0.00 0.00 177.43 177.01 1nl3 s MET 397 N -6.10 2.27 0.08 6.67 1.00 -1.26 -5.07 119.30 116.88 1nl3 s MET 397 Ca -0.15 -1.43 -0.31 0.00 0.00 0.00 0.00 55.69 53.80 1nl3 s MET 397 Cb 0.07 -2.15 -0.08 0.00 0.00 0.00 0.00 34.83 32.68 1nl3 s MET 397 CO 0.65 0.36 1.64 -1.25 0.00 0.00 0.00 175.02 176.43 1nl3 s PRO 398 N -3.67 4.20 -0.11 2.03 0.04 -1.26 -4.47 135.00 131.76 1nl3 s PRO 398 Ca 0.31 2.33 -0.34 0.00 0.04 0.00 0.00 61.00 63.34 1nl3 s PRO 398 Cb -0.06 -3.56 -0.12 0.00 0.04 0.00 0.00 34.50 30.80 1nl3 s PRO 398 CO 0.20 -0.72 1.91 -0.12 0.04 0.00 0.00 177.00 178.30 1nl3 n MET 399 N 5.46 2.10 -0.49 4.56 1.56 -1.26 -4.37 117.12 124.67 1nl3 n MET 399 Ca 0.16 0.76 0.05 0.00 -0.27 0.00 0.00 57.70 58.40 1nl3 n MET 399 Cb 0.40 -2.65 0.19 0.00 2.15 0.00 0.00 33.22 33.32 1nl3 n MET 399 CO 0.00 0.00 0.00 0.44 -0.73 0.00 0.00 175.97 175.68 1nl3 n ILE 400 N 5.34 2.19 -2.61 1.12 -6.64 -1.26 -5.06 119.36 112.44 1nl3 n ILE 400 Ca 0.24 -2.84 -0.41 0.00 -1.77 0.00 0.00 62.75 57.97 1nl3 n ILE 400 Cb 0.29 -0.25 -0.04 0.00 -1.44 0.00 0.00 39.64 38.19 1nl3 n ILE 400 CO 0.00 0.00 0.00 -0.60 -1.77 0.00 0.00 176.55 174.18 1nl3 s ARG 401 N -3.13 4.68 -0.60 6.28 3.52 -1.26 -4.63 118.95 123.81 1nl3 s ARG 401 Ca 0.38 1.62 -0.25 0.00 -0.13 0.00 0.00 55.73 57.35 1nl3 s ARG 401 Cb 0.35 -3.29 0.04 0.00 -1.56 0.00 0.00 34.95 30.49 1nl3 s ARG 401 CO -0.02 0.21 1.02 -1.21 -0.81 0.00 0.00 175.30 174.49 1nl3 s GLU 402 N -0.56 3.30 -0.69 5.12 0.41 -0.57 -5.01 118.70 120.70 1nl3 s GLU 402 Ca 0.47 -0.31 -0.20 0.00 -0.41 0.00 0.00 54.97 54.52 1nl3 s GLU 402 Cb -0.28 -4.10 0.11 0.00 -1.78 0.00 0.00 34.13 28.08 1nl3 s GLU 402 CO 0.34 -1.66 0.87 -0.51 -0.49 0.00 0.00 175.26 173.81 1nl3 s ASP 403 N 3.13 6.30 0.52 -0.19 1.01 -1.26 -1.12 116.67 125.06 1nl3 s ASP 403 Ca 0.31 -1.48 -0.18 0.00 0.71 0.00 0.00 52.55 51.91 1nl3 s ASP 403 Cb -0.12 -2.35 -0.07 0.00 1.01 0.00 0.00 42.92 41.39 1nl3 s ASP 403 CO 0.18 -1.18 1.02 -1.10 0.21 0.00 0.00 175.17 174.30 1nl3 s GLN 404 N 2.98 3.74 0.56 8.23 -1.52 -0.02 -4.99 119.66 128.64 1nl3 s GLN 404 Ca 0.19 1.17 -0.21 0.00 -1.95 0.00 0.00 55.36 54.57 1nl3 s GLN 404 Cb -0.17 -2.10 -0.04 0.00 -0.22 0.00 0.00 33.01 30.48 1nl3 s GLN 404 CO 0.04 -0.46 1.28 -1.12 -0.25 0.00 0.00 175.29 174.77 1nl3 s SER 405 N -2.56 5.31 0.36 5.90 0.01 -1.26 -4.52 113.70 116.94 1nl3 s SER 405 Ca 0.63 2.57 -0.28 0.00 1.31 0.00 0.00 55.95 60.18 1nl3 s SER 405 Cb -0.14 -2.62 -0.11 0.00 0.21 0.00 0.00 66.02 63.36 1nl3 s SER 405 CO 0.28 -1.53 1.48 0.47 0.41 0.00 0.00 173.24 174.35 1nl3 n ASP 406 N -1.20 3.66 -4.50 2.44 8.00 -1.26 -4.65 116.55 119.05 1nl3 n ASP 406 Ca 0.11 1.21 -0.39 0.00 0.71 0.00 0.00 54.79 56.44 1nl3 n ASP 406 Cb 0.47 -1.60 -0.11 0.00 -0.02 0.00 0.00 41.12 39.86 1nl3 n ASP 406 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1nl3 s LEU 407 N -1.62 4.14 -0.22 0.64 1.43 -0.48 -5.01 118.68 117.56 1nl3 s LEU 407 Ca 0.56 -0.35 -0.08 0.00 -1.03 0.00 0.00 54.13 53.23 1nl3 s LEU 407 Cb -0.49 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 43.63 1nl3 s LEU 407 CO 0.61 -0.16 0.09 -0.63 0.23 0.00 0.00 176.35 176.49 1nl3 s ILE 408 N 1.68 4.69 0.41 -0.59 1.01 -1.26 0.35 121.20 127.49 1nl3 s ILE 408 Ca 0.06 -0.05 0.08 0.00 0.00 0.00 0.00 60.65 60.73 1nl3 s ILE 408 Cb -0.17 -3.16 -0.01 0.00 0.01 0.00 0.00 42.46 39.12 1nl3 s ILE 408 CO 0.08 0.38 0.42 -0.31 0.00 0.00 0.00 174.94 175.51 1nl3 s TYR 409 N 1.06 2.75 0.07 3.97 1.51 0.35 -0.49 117.35 126.56 1nl3 s TYR 409 Ca 0.05 -0.46 -0.09 0.00 -1.01 0.00 0.00 57.07 55.56 1nl3 s TYR 409 Cb -0.14 -2.20 -0.28 0.00 -0.11 0.00 0.00 41.96 39.23 1nl3 s TYR 409 CO 0.03 -0.17 1.12 -0.22 -1.11 0.00 0.00 175.55 175.20 1nl3 h LYS 410 N 0.95 0.41 -4.69 -0.62 3.64 -1.83 -2.04 116.57 112.38 1nl3 h LYS 410 Ca -0.41 -0.63 -0.26 0.00 -1.27 0.00 0.00 60.65 58.08 1nl3 h LYS 410 Cb 1.27 0.23 -0.17 0.00 -0.41 0.00 0.00 32.23 33.14 1nl3 h LYS 410 CO 0.55 1.29 -0.71 -0.08 -2.27 0.00 0.00 179.45 178.22 1nl3 s THR 411 N -2.76 0.70 0.22 1.00 -1.32 -1.26 -3.77 115.64 108.46 1nl3 s THR 411 Ca -0.06 -1.66 -0.08 0.00 -1.21 0.00 0.00 61.69 58.68 1nl3 s THR 411 Cb 0.06 -1.34 0.16 0.00 -1.51 0.00 0.00 72.50 69.88 1nl3 s THR 411 CO 0.91 -0.69 1.75 -0.33 -2.21 0.00 0.00 174.62 174.05 1nl3 h GLU 412 N 3.48 0.47 -0.27 7.08 5.08 -1.92 -1.32 114.58 127.17 1nl3 h GLU 412 Ca -0.36 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 57.99 1nl3 h GLU 412 Cb 1.18 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.30 1nl3 h GLU 412 CO 0.56 0.31 0.13 0.93 -1.00 0.00 0.00 179.01 179.94 1nl3 h GLU 413 N 0.48 0.27 -0.14 2.33 5.08 -1.99 -2.34 114.58 118.27 1nl3 h GLU 413 Ca 0.34 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.70 1nl3 h GLU 413 Cb 0.41 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1nl3 h GLU 413 CO -0.31 0.18 0.03 0.00 -1.00 0.00 0.00 179.01 177.91 1nl3 h ALA 414 N 1.14 0.14 -0.42 3.43 0.00 -1.79 -2.89 119.26 118.87 1nl3 h ALA 414 Ca 0.11 0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.09 1nl3 h ALA 414 Cb 0.04 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 1nl3 h ALA 414 CO -0.08 -0.42 0.17 -0.22 0.00 0.00 0.00 179.25 178.70 1nl3 h LYS 415 N 0.09 0.34 -0.25 0.00 3.64 -0.99 -2.99 116.57 116.41 1nl3 h LYS 415 Ca 0.06 -0.02 -0.19 0.00 -1.27 0.00 0.00 60.65 59.23 1nl3 h LYS 415 Cb 0.05 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 1nl3 h LYS 415 CO -0.08 0.23 -0.58 1.88 -2.27 0.00 0.00 179.45 178.63 1nl3 h TYR 416 N 0.35 1.02 -0.80 1.91 0.05 -1.38 0.19 116.97 118.31 1nl3 h TYR 416 Ca 0.19 -0.37 0.04 0.00 0.05 0.00 0.00 58.73 58.64 1nl3 h TYR 416 Cb 0.15 -0.19 -0.05 0.00 1.01 0.00 0.00 36.73 37.66 1nl3 h TYR 416 CO -0.13 1.19 0.53 -0.84 -1.05 0.00 0.00 178.16 177.85 1nl3 h ILE 417 N 0.61 1.10 -0.02 -2.88 -0.00 -1.50 0.17 117.51 114.99 1nl3 h ILE 417 Ca 0.00 -0.33 -0.17 0.00 -0.00 0.00 0.00 64.86 64.37 1nl3 h ILE 417 Cb 1.18 0.06 -0.01 0.00 -0.00 0.00 0.00 36.82 38.04 1nl3 h ILE 417 CO 0.12 0.17 -0.75 0.00 -0.00 0.00 0.00 178.15 177.70 1nl3 h ALA 418 N 1.54 0.70 0.28 0.16 0.00 -1.34 -2.55 119.26 118.05 1nl3 h ALA 418 Ca 0.33 -0.65 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1nl3 h ALA 418 Cb 0.10 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1nl3 h ALA 418 CO -0.10 0.86 -0.13 0.28 0.00 0.00 0.00 179.25 180.15 1nl3 h VAL 419 N 0.09 0.75 -1.00 0.00 2.07 0.08 -3.01 116.25 115.23 1nl3 h VAL 419 Ca -0.02 -0.59 0.20 0.00 0.82 0.00 0.00 66.70 67.12 1nl3 h VAL 419 Cb 1.32 1.06 -0.11 0.00 -1.52 0.00 0.00 31.29 32.04 1nl3 h VAL 419 CO 0.11 0.12 0.60 0.58 0.02 0.00 0.00 177.57 179.00 1nl3 h VAL 420 N -0.70 0.66 -0.41 2.57 2.07 -0.67 -1.69 116.25 118.09 1nl3 h VAL 420 Ca -0.04 -0.25 -0.06 0.00 0.82 0.00 0.00 66.70 67.18 1nl3 h VAL 420 Cb 0.48 -0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.12 1nl3 h VAL 420 CO 0.06 0.13 0.03 0.44 0.02 0.00 0.00 177.57 178.25 1nl3 h ASP 421 N 0.72 0.69 -0.47 0.57 5.19 -1.48 0.45 116.42 122.08 1nl3 h ASP 421 Ca 0.59 -0.29 0.00 0.00 -0.62 0.00 0.00 57.03 56.71 1nl3 h ASP 421 Cb 0.97 -0.18 -0.02 0.00 0.18 0.00 0.00 39.33 40.27 1nl3 h ASP 421 CO -0.41 0.81 0.29 -0.78 -3.12 0.00 0.00 179.24 176.03 1nl3 h ASP 422 N 0.55 0.55 -0.02 6.45 1.82 -1.19 -0.40 116.42 124.18 1nl3 h ASP 422 Ca 0.12 -0.04 -0.00 0.00 -0.39 0.00 0.00 57.03 56.72 1nl3 h ASP 422 Cb 0.44 -0.14 -0.00 0.00 0.68 0.00 0.00 39.33 40.31 1nl3 h ASP 422 CO 0.02 0.43 0.01 0.58 -1.61 0.00 0.00 179.24 178.66 1nl3 h VAL 423 N 0.63 1.11 -0.46 2.25 2.07 -1.21 -0.34 116.25 120.30 1nl3 h VAL 423 Ca 0.17 -0.33 0.02 0.00 0.82 0.00 0.00 66.70 67.38 1nl3 h VAL 423 Cb -0.03 1.31 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 1nl3 h VAL 423 CO -0.03 0.09 0.27 0.00 0.02 0.00 0.00 177.57 177.92 1nl3 h ALA 424 N 0.87 0.59 -0.08 1.67 0.00 -0.87 0.04 119.26 121.48 1nl3 h ALA 424 Ca 0.01 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.93 1nl3 h ALA 424 Cb 0.14 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1nl3 h ALA 424 CO -0.00 -0.04 -0.36 0.93 0.00 0.00 0.00 179.25 179.78 1nl3 h GLU 425 N 0.55 -0.38 -0.68 0.00 5.08 -0.97 -2.16 114.58 116.02 1nl3 h GLU 425 Ca 0.18 0.03 0.14 0.00 -1.00 0.00 0.00 59.36 58.71 1nl3 h GLU 425 Cb 0.02 0.09 -0.13 0.00 0.50 0.00 0.00 28.75 29.22 1nl3 h GLU 425 CO -0.09 -0.25 -0.19 0.00 -1.00 0.00 0.00 179.01 177.48 1nl3 h ARG 426 N -0.39 -0.02 0.20 2.33 2.47 -0.64 -1.63 114.38 116.69 1nl3 h ARG 426 Ca 0.02 0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.75 1nl3 h ARG 426 Cb 0.46 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.74 1nl3 h ARG 426 CO -0.29 -0.01 -0.50 -0.92 0.56 0.00 0.00 179.97 178.81 1nl3 h TYR 427 N -0.02 -1.43 -0.90 3.04 3.20 -0.87 -1.19 116.97 118.80 1nl3 h TYR 427 Ca 0.32 0.03 0.26 0.00 3.14 0.00 0.00 58.73 62.48 1nl3 h TYR 427 Cb 0.51 0.60 -0.04 0.00 1.54 0.00 0.00 36.73 39.34 1nl3 h TYR 427 CO -0.57 -0.60 0.65 0.00 -1.64 0.00 0.00 178.16 176.00 1nl3 h ALA 428 N -0.51 2.83 -0.00 1.82 0.00 -0.66 0.74 119.26 123.49 1nl3 h ALA 428 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1nl3 h ALA 428 Cb 0.77 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1nl3 h ALA 428 CO -0.23 -1.09 -0.30 1.17 0.00 0.00 0.00 179.25 178.80 1nl3 n LYS 429 N -4.28 0.37 0.00 0.00 4.81 -0.60 -4.96 118.16 113.51 1nl3 n LYS 429 Ca 0.19 -0.19 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1nl3 n LYS 429 Cb 0.96 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 34.51 1nl3 n LYS 429 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1nl3 n GLY 430 N 1.41 3.12 3.66 3.14 0.00 0.26 -4.94 105.19 111.83 1nl3 n GLY 430 Ca 0.09 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.66 1nl3 n GLY 430 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1nl3 n GLN 431 N -0.85 1.90 -2.63 1.61 7.27 -0.92 -0.98 117.38 122.78 1nl3 n GLN 431 Ca 0.00 0.68 -0.41 0.00 0.07 0.00 0.00 57.00 57.34 1nl3 n GLN 431 Cb 0.00 -2.31 -0.04 0.00 2.41 0.00 0.00 30.24 30.30 1nl3 n GLN 431 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 1nl3 s PRO 432 N -0.43 4.63 -0.02 3.69 0.04 -1.26 -4.18 135.00 137.47 1nl3 s PRO 432 Ca 0.69 1.57 0.04 0.00 0.04 0.00 0.00 61.00 63.34 1nl3 s PRO 432 Cb -0.68 -3.34 -0.03 0.00 0.04 0.00 0.00 34.50 30.49 1nl3 s PRO 432 CO 0.50 0.12 -0.14 0.08 0.04 0.00 0.00 177.00 177.60 1nl3 s VAL 433 N 0.03 3.09 -0.22 -0.36 1.01 0.32 -1.25 120.40 123.03 1nl3 s VAL 433 Ca 0.49 -0.84 -0.01 0.00 0.00 0.00 0.00 61.98 61.62 1nl3 s VAL 433 Cb -0.26 -2.25 0.02 0.00 0.00 0.00 0.00 36.38 33.89 1nl3 s VAL 433 CO 0.32 0.50 -0.11 -0.22 0.00 0.00 0.00 175.10 175.58 1nl3 s LEU 434 N -1.01 2.74 -0.19 3.92 0.20 0.38 -1.55 118.68 123.17 1nl3 s LEU 434 Ca 0.13 -0.73 -0.02 0.00 0.69 0.00 0.00 54.13 54.20 1nl3 s LEU 434 Cb -0.11 -1.60 -0.01 0.00 -0.43 0.00 0.00 46.19 44.04 1nl3 s LEU 434 CO 0.03 -0.06 -0.08 -0.63 -0.29 0.00 0.00 176.35 175.32 1nl3 s ILE 435 N 1.33 3.23 -0.01 6.68 1.09 0.29 0.12 121.20 133.94 1nl3 s ILE 435 Ca 0.03 -0.56 -0.02 0.00 -1.10 0.00 0.00 60.65 59.00 1nl3 s ILE 435 Cb -0.15 -2.43 -0.04 0.00 -1.06 0.00 0.00 42.46 38.78 1nl3 s ILE 435 CO -0.08 0.47 0.14 -0.83 -0.10 0.00 0.00 174.94 174.54 1nl3 s GLY 436 N 1.05 2.11 0.00 6.18 0.00 0.56 -0.68 107.32 116.55 1nl3 s GLY 436 Ca 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 44.72 43.91 1nl3 s GLY 436 CO -0.01 -0.69 0.00 -1.30 0.00 0.00 0.00 173.10 171.10 1nl3 n THR 437 N 1.05 0.00 -0.23 0.90 -2.24 -0.78 -2.20 114.28 110.79 1nl3 n THR 437 Ca -0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1nl3 n THR 437 Cb 0.53 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 1nl3 n THR 437 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1nl3 n THR 438 N 0.00 0.00 -3.68 4.28 -1.04 -1.26 -2.42 114.28 110.17 1nl3 n THR 438 Ca 0.00 -0.28 -0.15 0.00 -2.04 0.00 0.00 64.05 61.58 1nl3 n THR 438 Cb 0.00 1.23 -0.08 0.00 -1.82 0.00 0.00 70.33 69.66 1nl3 n THR 438 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1nl3 s SER 439 N -0.27 -0.41 0.27 8.00 1.04 -1.26 -4.68 113.70 116.39 1nl3 s SER 439 Ca 0.00 0.50 -0.01 0.00 0.48 0.00 0.00 55.95 56.92 1nl3 s SER 439 Cb 0.00 0.55 0.51 0.00 0.10 0.00 0.00 66.02 67.18 1nl3 s SER 439 CO 0.00 -0.42 1.81 0.58 0.98 0.00 0.00 173.24 176.19 1nl3 h VAL 440 N 3.74 0.87 -0.75 5.02 2.07 -1.96 -0.74 116.25 124.50 1nl3 h VAL 440 Ca -0.28 -0.29 0.10 0.00 0.82 0.00 0.00 66.70 67.05 1nl3 h VAL 440 Cb 1.17 -0.06 -0.05 0.00 -1.52 0.00 0.00 31.29 30.83 1nl3 h VAL 440 CO 0.35 0.16 0.49 -0.08 0.02 0.00 0.00 177.57 178.50 1nl3 h GLU 441 N 0.86 0.60 0.00 1.57 4.22 -2.00 -1.74 114.58 118.09 1nl3 h GLU 441 Ca 0.47 -0.04 0.00 0.00 0.08 0.00 0.00 59.36 59.87 1nl3 h GLU 441 Cb 0.50 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1nl3 h GLU 441 CO -0.28 0.40 -0.78 0.00 -2.18 0.00 0.00 179.01 176.17 1nl3 h ARG 442 N 0.62 0.00 -0.10 1.92 2.47 -1.58 -2.81 114.38 114.91 1nl3 h ARG 442 Ca 0.35 0.00 -0.16 0.00 -1.26 0.00 0.00 59.98 58.91 1nl3 h ARG 442 Cb 0.53 0.00 0.01 0.00 -1.65 0.00 0.00 29.97 28.85 1nl3 h ARG 442 CO -0.13 0.00 -0.58 0.77 0.56 0.00 0.00 179.97 180.60 1nl3 h SER 443 N 0.00 0.67 0.16 7.04 0.02 -0.64 -2.32 113.55 118.49 1nl3 h SER 443 Ca 0.00 -0.65 -0.16 0.00 -0.84 0.00 0.00 61.79 60.13 1nl3 h SER 443 Cb 0.80 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.13 1nl3 h SER 443 CO 0.00 1.22 -0.61 -0.33 -1.14 0.00 0.00 176.83 175.97 1nl3 h GLU 444 N 0.17 0.45 -0.65 3.45 4.39 -1.48 0.48 114.58 121.39 1nl3 h GLU 444 Ca -0.04 -0.31 -0.03 0.00 0.34 0.00 0.00 59.36 59.31 1nl3 h GLU 444 Cb 1.22 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.89 1nl3 h GLU 444 CO 0.12 0.92 0.28 -0.92 -1.16 0.00 0.00 179.01 178.26 1nl3 h TYR 445 N 0.33 0.97 -0.13 4.33 3.20 -1.57 0.03 116.97 124.14 1nl3 h TYR 445 Ca -0.01 -0.06 -0.13 0.00 3.14 0.00 0.00 58.73 61.67 1nl3 h TYR 445 Cb 1.16 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 39.12 1nl3 h TYR 445 CO 0.04 0.75 -0.47 1.25 -1.64 0.00 0.00 178.16 178.08 1nl3 h LEU 446 N 0.91 0.36 -0.39 2.82 5.85 -1.15 -2.34 115.31 121.38 1nl3 h LEU 446 Ca 0.22 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 1nl3 h LEU 446 Cb 0.17 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.10 1nl3 h LEU 446 CO -0.02 0.78 -0.05 0.77 -0.34 0.00 0.00 178.44 179.58 1nl3 h SER 447 N 0.27 0.00 -0.06 1.25 4.64 -0.71 0.86 113.55 119.80 1nl3 h SER 447 Ca 0.02 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.24 1nl3 h SER 447 Cb 0.94 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 1nl3 h SER 447 CO 0.08 0.05 -0.34 0.03 -0.87 0.00 0.00 176.83 175.78 1nl3 h ARG 448 N 0.00 0.34 -0.77 4.77 3.08 -0.81 -1.10 114.38 119.90 1nl3 h ARG 448 Ca -0.00 -0.28 0.05 0.00 0.07 0.00 0.00 59.98 59.81 1nl3 h ARG 448 Cb 0.90 0.06 -0.05 0.00 0.08 0.00 0.00 29.97 30.96 1nl3 h ARG 448 CO 0.01 0.93 0.47 0.37 -1.07 0.00 0.00 179.97 180.68 1nl3 h GLN 449 N -0.16 0.86 -0.64 0.04 5.75 -1.35 0.13 115.11 119.73 1nl3 h GLN 449 Ca -0.02 -0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.41 1nl3 h GLN 449 Cb 1.00 -0.19 -0.03 0.00 1.07 0.00 0.00 27.48 29.32 1nl3 h GLN 449 CO 0.07 0.57 0.34 0.74 -2.65 0.00 0.00 178.83 177.90 1nl3 h PHE 450 N 0.89 0.87 0.07 3.99 0.04 -0.71 -1.78 116.94 120.30 1nl3 h PHE 450 Ca 0.32 -0.02 -0.25 0.00 2.80 0.00 0.00 57.97 60.83 1nl3 h PHE 450 Cb 0.10 -0.28 -0.00 0.00 2.20 0.00 0.00 35.95 37.97 1nl3 h PHE 450 CO -0.04 0.62 -1.09 1.15 -0.60 0.00 0.00 178.31 178.34 1nl3 h THR 451 N 0.89 1.49 0.00 -1.55 2.02 -0.88 0.22 112.91 115.10 1nl3 h THR 451 Ca 0.23 -2.86 0.00 0.00 0.77 0.00 0.00 66.41 64.55 1nl3 h THR 451 Cb 0.04 2.73 0.00 0.00 -1.74 0.00 0.00 68.15 69.18 1nl3 h THR 451 CO -0.03 0.84 0.00 0.29 0.37 0.00 0.00 175.52 176.98 1nl3 n LYS 452 N -3.60 0.06 -0.00 6.66 5.02 0.41 -0.49 118.16 126.22 1nl3 n LYS 452 Ca -0.07 0.28 0.00 0.00 -2.02 0.00 0.00 58.31 56.51 1nl3 n LYS 452 Cb 0.93 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.45 1nl3 n LYS 452 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1nl3 n ARG 453 N -1.37 1.57 -1.93 1.97 3.00 -0.72 -5.01 116.66 114.15 1nl3 n ARG 453 Ca 0.03 -1.16 -0.20 0.00 -0.00 0.00 0.00 57.85 56.52 1nl3 n ARG 453 Cb 0.07 -1.01 -0.05 0.00 0.00 0.00 0.00 32.46 31.47 1nl3 n ARG 453 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1nl3 n ARG 454 N -0.29 -1.49 -2.81 -0.14 3.00 0.35 -4.99 116.66 110.30 1nl3 n ARG 454 Ca 0.00 1.11 -0.43 0.00 -0.01 0.00 0.00 57.85 58.53 1nl3 n ARG 454 Cb 0.17 -5.58 -0.04 0.00 0.00 0.00 0.00 32.46 27.01 1nl3 n ARG 454 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1nl3 s ILE 455 N -2.86 4.50 0.25 0.55 1.01 0.74 -4.97 121.20 120.42 1nl3 s ILE 455 Ca 0.00 0.92 -0.30 0.00 0.00 0.00 0.00 60.65 61.27 1nl3 s ILE 455 Cb 0.00 -4.40 -0.10 0.00 0.01 0.00 0.00 42.46 37.97 1nl3 s ILE 455 CO 0.00 -0.74 1.38 -2.16 0.00 0.00 0.00 174.94 173.43 1nl3 s PRO 456 N 3.68 4.31 0.16 2.79 0.04 -1.26 -4.45 135.00 140.28 1nl3 s PRO 456 Ca 0.38 2.22 -0.24 0.00 0.04 0.00 0.00 61.00 63.40 1nl3 s PRO 456 Cb -0.11 -3.12 0.06 0.00 0.04 0.00 0.00 34.50 31.37 1nl3 s PRO 456 CO 0.24 -0.33 0.85 -3.38 0.04 0.00 0.00 177.00 174.42 1nl3 s HIS 457 N -0.19 -0.22 0.17 0.56 -3.43 -1.26 -4.51 115.29 106.40 1nl3 s HIS 457 Ca 0.57 -0.09 0.09 0.00 -0.80 0.00 0.00 55.06 54.83 1nl3 s HIS 457 Cb -0.40 0.63 -0.04 0.00 -1.43 0.00 0.00 32.58 31.34 1nl3 s HIS 457 CO 0.44 -0.89 -0.18 -0.80 -2.00 0.00 0.00 174.74 171.31 1nl3 s ASN 458 N -2.84 2.72 -0.15 7.38 -0.87 -1.02 -5.04 114.94 115.11 1nl3 s ASN 458 Ca 0.10 -0.87 -0.02 0.00 -1.57 0.00 0.00 52.86 50.50 1nl3 s ASN 458 Cb -0.02 -0.16 -0.02 0.00 -0.02 0.00 0.00 41.25 41.02 1nl3 s ASN 458 CO 0.00 -0.03 -0.07 -0.69 -2.57 0.00 0.00 177.10 173.74 1nl3 s VAL 459 N -2.05 3.57 -0.15 1.60 1.01 -1.26 -0.72 120.40 122.41 1nl3 s VAL 459 Ca 0.16 -0.47 -0.01 0.00 0.00 0.00 0.00 61.98 61.66 1nl3 s VAL 459 Cb -0.06 -2.55 -0.01 0.00 0.00 0.00 0.00 36.38 33.76 1nl3 s VAL 459 CO 0.07 0.50 -0.11 -0.76 0.00 0.00 0.00 175.10 174.79 1nl3 s LEU 460 N 0.41 2.76 0.00 3.92 1.43 0.91 -4.96 118.68 123.15 1nl3 s LEU 460 Ca -0.06 -0.33 0.09 0.00 -1.03 0.00 0.00 54.13 52.79 1nl3 s LEU 460 Cb -0.15 -1.64 0.12 0.00 0.03 0.00 0.00 46.19 44.55 1nl3 s LEU 460 CO 0.04 0.13 0.90 0.59 0.23 0.00 0.00 176.35 178.24 1nl3 n ASN 461 N 3.74 2.02 0.00 2.29 5.03 -1.26 -0.83 115.26 126.24 1nl3 n ASN 461 Ca -0.18 -1.54 0.00 0.00 0.87 0.00 0.00 54.58 53.72 1nl3 n ASN 461 Cb 0.52 -0.05 0.00 0.00 -1.02 0.00 0.00 39.78 39.23 1nl3 n ASN 461 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1nl3 n ALA 462 N 0.45 0.00 -0.08 5.41 0.00 -1.26 -4.86 120.51 120.17 1nl3 n ALA 462 Ca 0.06 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.43 1nl3 n ALA 462 Cb 0.27 -0.45 -0.03 0.00 0.00 0.00 0.00 19.45 19.24 1nl3 n ALA 462 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1nl3 n LYS 463 N -2.61 0.46 -3.23 0.00 4.81 -1.26 -4.80 118.16 111.54 1nl3 n LYS 463 Ca 0.00 0.22 -0.46 0.00 -0.87 0.00 0.00 58.31 57.20 1nl3 n LYS 463 Cb 0.07 -1.35 -0.03 0.00 0.02 0.00 0.00 35.03 33.75 1nl3 n LYS 463 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1nl3 s TYR 464 N -2.62 3.53 0.25 5.64 1.51 -1.26 -4.92 117.35 119.48 1nl3 s TYR 464 Ca -0.24 -1.74 -0.04 0.00 -1.01 0.00 0.00 57.07 54.04 1nl3 s TYR 464 Cb 0.03 -3.93 0.28 0.00 -0.11 0.00 0.00 41.96 38.24 1nl3 s TYR 464 CO 0.36 -1.12 1.77 0.45 -1.11 0.00 0.00 175.55 175.90 1nl3 h HIS 465 N 8.19 0.98 0.25 2.71 3.86 -1.98 -1.93 115.15 127.23 1nl3 h HIS 465 Ca 0.05 -0.11 -0.01 0.00 -1.16 0.00 0.00 60.37 59.14 1nl3 h HIS 465 Cb 1.05 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 29.24 1nl3 h HIS 465 CO 1.02 0.82 -0.12 1.49 0.86 0.00 0.00 177.93 182.01 1nl3 h GLU 466 N 0.89 -0.33 0.00 2.45 4.81 -1.97 0.58 114.58 121.01 1nl3 h GLU 466 Ca 0.19 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.44 1nl3 h GLU 466 Cb 0.35 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.81 1nl3 h GLU 466 CO 0.00 0.03 -0.02 -0.56 -0.73 0.00 0.00 179.01 177.74 1nl3 h GLN 467 N -0.79 0.00 0.07 1.92 3.07 -1.97 -0.85 115.11 116.56 1nl3 h GLN 467 Ca -0.03 0.00 -0.25 0.00 0.09 0.00 0.00 58.65 58.45 1nl3 h GLN 467 Cb 0.51 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.06 1nl3 h GLN 467 CO 0.06 0.02 -1.18 0.93 0.09 0.00 0.00 178.83 178.74 1nl3 h GLU 468 N 0.00 0.16 -0.36 0.06 5.08 -1.12 -2.98 114.58 115.42 1nl3 h GLU 468 Ca -0.00 -0.27 -0.00 0.00 -1.00 0.00 0.00 59.36 58.09 1nl3 h GLU 468 Cb 0.22 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1nl3 h GLU 468 CO 0.00 1.11 0.21 0.00 -1.00 0.00 0.00 179.01 179.33 1nl3 h ALA 469 N 0.75 0.46 -0.52 3.43 0.00 0.49 -1.85 119.26 122.02 1nl3 h ALA 469 Ca -0.10 -0.05 0.10 0.00 0.00 0.00 0.00 54.91 54.86 1nl3 h ALA 469 Cb 1.90 -0.14 -0.09 0.00 0.00 0.00 0.00 17.79 19.45 1nl3 h ALA 469 CO 0.17 -0.05 -0.09 1.15 0.00 0.00 0.00 179.25 180.44 1nl3 h THR 470 N 0.46 0.52 0.77 0.00 2.02 -1.34 0.44 112.91 115.79 1nl3 h THR 470 Ca 0.13 -0.01 -0.04 0.00 0.77 0.00 0.00 66.41 67.26 1nl3 h THR 470 Cb 0.01 0.48 0.01 0.00 -1.74 0.00 0.00 68.15 66.90 1nl3 h THR 470 CO -0.02 0.01 -0.39 0.40 0.37 0.00 0.00 175.52 175.88 1nl3 h ILE 471 N 0.04 0.20 -0.85 3.11 2.04 -1.44 -2.98 117.51 117.63 1nl3 h ILE 471 Ca 0.25 0.00 0.22 0.00 1.00 0.00 0.00 64.86 66.33 1nl3 h ILE 471 Cb 0.39 0.20 -0.13 0.00 -0.74 0.00 0.00 36.82 36.54 1nl3 h ILE 471 CO -0.50 0.00 0.23 0.40 0.00 0.00 0.00 178.15 178.28 1nl3 h ILE 472 N -1.06 0.37 -0.95 -0.67 1.08 -0.87 0.16 117.51 115.57 1nl3 h ILE 472 Ca -0.10 -0.08 0.24 0.00 -0.39 0.00 0.00 64.86 64.53 1nl3 h ILE 472 Cb 0.82 0.11 -0.06 0.00 -3.07 0.00 0.00 36.82 34.62 1nl3 h ILE 472 CO 0.16 0.04 0.64 0.00 -0.69 0.00 0.00 178.15 178.31 1nl3 h ALA 473 N 1.74 2.47 -0.25 1.87 0.00 0.03 -0.88 119.26 124.24 1nl3 h ALA 473 Ca 0.52 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.34 1nl3 h ALA 473 Cb 1.01 0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.76 1nl3 h ALA 473 CO -0.61 -0.77 -0.12 1.33 0.00 0.00 0.00 179.25 179.07 1nl3 n VAL 474 N -4.44 2.39 0.50 0.00 0.24 0.52 -1.35 118.33 116.18 1nl3 n VAL 474 Ca 0.21 -2.62 0.13 0.00 -2.04 0.00 0.00 64.34 60.01 1nl3 n VAL 474 Cb 0.85 -0.29 0.44 0.00 -1.47 0.00 0.00 33.84 33.38 1nl3 n VAL 474 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1nl3 h ALA 475 N 1.04 1.00 -0.12 2.33 0.00 -0.66 -3.26 119.26 119.59 1nl3 h ALA 475 Ca 0.13 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1nl3 h ALA 475 Cb 1.46 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 19.22 1nl3 h ALA 475 CO 0.26 0.00 -0.26 0.41 0.00 0.00 0.00 179.25 179.66 1nl3 n GLY 476 N 0.70 4.96 3.89 0.00 0.00 -1.26 -4.58 105.19 108.90 1nl3 n GLY 476 Ca 0.04 -1.24 -0.29 0.00 0.00 0.00 0.00 46.02 44.53 1nl3 n GLY 476 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nl3 s ARG 477 N -3.15 3.66 0.58 1.61 0.52 -1.23 -0.32 118.95 120.61 1nl3 s ARG 477 Ca 0.39 0.37 -0.19 0.00 -0.52 0.00 0.00 55.73 55.79 1nl3 s ARG 477 Cb 0.36 -2.36 -0.04 0.00 0.52 0.00 0.00 34.95 33.43 1nl3 s ARG 477 CO -0.02 -0.16 1.16 -0.98 0.02 0.00 0.00 175.30 175.32 1nl3 s ARG 478 N -4.37 3.13 0.00 3.54 1.70 -1.26 -2.25 118.95 119.44 1nl3 s ARG 478 Ca 0.50 1.69 0.00 0.00 -0.47 0.00 0.00 55.73 57.45 1nl3 s ARG 478 Cb -0.10 -1.97 0.00 0.00 -0.57 0.00 0.00 34.95 32.31 1nl3 s ARG 478 CO 0.39 -1.04 0.00 0.41 -1.08 0.00 0.00 175.30 173.98 1nl3 n GLY 479 N 0.26 3.13 3.65 3.88 0.00 -0.15 -4.98 105.19 110.97 1nl3 n GLY 479 Ca 0.12 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.63 1nl3 n GLY 479 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nl3 n GLY 480 N -1.39 0.84 2.69 -0.02 0.00 -0.95 -4.88 105.19 101.48 1nl3 n GLY 480 Ca 0.00 0.75 -0.25 0.00 0.00 0.00 0.00 46.02 46.52 1nl3 n GLY 480 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1nl3 s VAL 481 N 1.63 0.21 -0.08 1.61 1.01 -1.26 -0.52 120.40 123.01 1nl3 s VAL 481 Ca 0.87 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.69 1nl3 s VAL 481 Cb -0.87 -0.67 0.02 0.00 0.00 0.00 0.00 36.38 34.86 1nl3 s VAL 481 CO 0.49 -0.08 -0.08 -0.89 0.00 0.00 0.00 175.10 174.53 1nl3 s THR 482 N 2.01 0.91 -0.27 3.92 2.01 -0.59 -2.43 115.64 121.20 1nl3 s THR 482 Ca 0.02 -0.29 -0.07 0.00 0.31 0.00 0.00 61.69 61.66 1nl3 s THR 482 Cb -0.15 -0.89 -0.01 0.00 0.01 0.00 0.00 72.50 71.45 1nl3 s THR 482 CO -0.07 0.32 0.08 -0.69 -0.69 0.00 0.00 174.62 173.57 1nl3 s VAL 483 N 1.15 4.16 -0.21 3.82 1.01 0.10 -0.54 120.40 129.88 1nl3 s VAL 483 Ca -0.06 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.53 1nl3 s VAL 483 Cb -0.14 -3.03 0.03 0.00 0.00 0.00 0.00 36.38 33.24 1nl3 s VAL 483 CO -0.02 0.22 -0.16 0.00 0.00 0.00 0.00 175.10 175.15 1nl3 s ALA 484 N 1.57 2.45 0.05 5.51 0.00 0.15 -0.06 121.76 131.42 1nl3 s ALA 484 Ca 0.05 -1.43 -0.30 0.00 0.00 0.00 0.00 51.96 50.27 1nl3 s ALA 484 Cb -0.16 -1.37 -0.04 0.00 0.00 0.00 0.00 23.12 21.55 1nl3 s ALA 484 CO 0.03 -0.69 0.99 0.99 0.00 0.00 0.00 175.76 177.08 1nl3 s THR 485 N 1.23 4.65 0.00 0.00 2.01 -0.01 -1.86 115.64 121.66 1nl3 s THR 485 Ca -0.00 2.01 0.00 0.00 0.31 0.00 0.00 61.69 64.01 1nl3 s THR 485 Cb -0.16 -4.29 0.00 0.00 0.01 0.00 0.00 72.50 68.07 1nl3 s THR 485 CO -0.09 0.22 0.00 0.59 -0.69 0.00 0.00 174.62 174.64 1nl3 n ASN 486 N 3.45 0.00 -2.26 3.53 3.02 -1.01 -1.93 115.26 120.05 1nl3 n ASN 486 Ca 0.05 0.00 -0.28 0.00 -0.03 0.00 0.00 54.58 54.32 1nl3 n ASN 486 Cb 0.50 0.00 0.14 0.00 -0.61 0.00 0.00 39.78 39.81 1nl3 n ASN 486 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1nl3 n MET 487 N 14.00 2.40 -1.46 3.52 2.81 -1.26 -4.77 117.12 132.37 1nl3 n MET 487 Ca 0.00 -3.11 -0.41 0.00 -1.81 0.00 0.00 57.70 52.37 1nl3 n MET 487 Cb 0.00 -2.22 0.01 0.00 -0.71 0.00 0.00 33.22 30.31 1nl3 n MET 487 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1nl3 n ALA 488 N -1.07 -1.39 -2.13 3.04 0.00 -0.81 -2.55 120.51 115.61 1nl3 n ALA 488 Ca 0.61 0.13 -0.06 0.00 0.00 0.00 0.00 53.44 54.12 1nl3 n ALA 488 Cb 1.32 -1.79 -0.00 0.00 0.00 0.00 0.00 19.45 18.98 1nl3 n ALA 488 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nl3 n GLY 489 N 1.77 0.14 3.72 0.00 0.00 -1.26 -4.89 105.19 104.67 1nl3 n GLY 489 Ca 0.11 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 1nl3 n GLY 489 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1nl3 s ARG 490 N -4.31 4.16 0.00 1.61 3.52 -1.06 -3.55 118.95 119.33 1nl3 s ARG 490 Ca 0.00 2.50 0.00 0.00 -0.13 0.00 0.00 55.73 58.10 1nl3 s ARG 490 Cb -0.00 -3.14 0.00 0.00 -1.56 0.00 0.00 34.95 30.25 1nl3 s ARG 490 CO 0.00 -0.70 0.00 0.41 -0.81 0.00 0.00 175.30 174.21 1nl3 n GLY 491 N 3.90 0.64 3.51 8.12 0.00 -1.26 -5.00 105.19 115.10 1nl3 n GLY 491 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 1nl3 n GLY 491 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nl3 s THR 492 N -2.48 4.07 0.12 2.61 2.01 -1.23 -5.10 115.64 115.64 1nl3 s THR 492 Ca 0.00 -0.29 -0.30 0.00 0.31 0.00 0.00 61.69 61.41 1nl3 s THR 492 Cb 0.00 -2.81 -0.07 0.00 0.01 0.00 0.00 72.50 69.63 1nl3 s THR 492 CO 0.00 0.47 1.25 -1.81 -0.69 0.00 0.00 174.62 173.83 1nl3 s ASP 493 N 0.56 7.01 -1.19 3.53 1.01 -1.26 -4.95 116.67 121.40 1nl3 s ASP 493 Ca -0.01 2.18 -0.19 0.00 0.71 0.00 0.00 52.55 55.23 1nl3 s ASP 493 Cb -0.14 -2.59 0.07 0.00 1.01 0.00 0.00 42.92 41.27 1nl3 s ASP 493 CO 0.02 -0.48 1.60 -0.63 0.21 0.00 0.00 175.17 175.89 1nl3 s ILE 494 N 0.64 4.14 0.06 0.77 1.01 -1.26 -4.69 121.20 121.86 1nl3 s ILE 494 Ca 0.58 -1.57 -0.30 0.00 0.00 0.00 0.00 60.65 59.36 1nl3 s ILE 494 Cb -0.33 -5.12 -0.05 0.00 0.01 0.00 0.00 42.46 36.98 1nl3 s ILE 494 CO 0.32 -1.95 0.95 -0.69 0.00 0.00 0.00 174.94 173.58 1nl3 s VAL 495 N 4.24 4.66 0.17 2.92 1.01 -1.26 -4.84 120.40 127.30 1nl3 s VAL 495 Ca 0.50 2.04 -0.31 0.00 0.00 0.00 0.00 61.98 64.20 1nl3 s VAL 495 Cb 0.02 -4.31 -0.09 0.00 0.00 0.00 0.00 36.38 32.00 1nl3 s VAL 495 CO 0.01 0.26 1.46 -0.76 0.00 0.00 0.00 175.10 176.06 1nl3 s LEU 496 N 0.39 4.38 0.00 3.92 1.43 -1.26 -1.06 118.68 126.48 1nl3 s LEU 496 Ca 0.48 2.51 0.00 0.00 -1.03 0.00 0.00 54.13 56.09 1nl3 s LEU 496 Cb -0.22 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.40 1nl3 s LEU 496 CO 0.29 -0.71 0.00 0.61 0.23 0.00 0.00 176.35 176.76 1nl3 n GLY 497 N 3.19 2.50 0.00 -3.19 0.00 0.57 -4.67 105.19 103.60 1nl3 n GLY 497 Ca 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1nl3 n GLY 497 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nl3 n GLY 498 N 0.00 4.18 3.57 -0.02 0.00 -0.22 -4.58 105.19 108.12 1nl3 n GLY 498 Ca 0.00 -1.52 -0.42 0.00 0.00 0.00 0.00 46.02 44.08 1nl3 n GLY 498 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1nl3 s ASN 499 N 0.00 6.32 0.19 1.61 3.84 -0.46 -4.70 114.94 121.75 1nl3 s ASN 499 Ca 0.00 0.04 -0.10 0.00 0.21 0.00 0.00 52.86 53.01 1nl3 s ASN 499 Cb 0.00 -2.55 0.11 0.00 -0.55 0.00 0.00 41.25 38.26 1nl3 s ASN 499 CO 0.00 -1.60 1.76 0.58 -2.79 0.00 0.00 177.10 175.05 1nl3 h VAL 500 N 6.18 1.24 -0.09 -5.21 2.07 -1.94 0.56 116.25 119.06 1nl3 h VAL 500 Ca -0.26 -0.72 -0.01 0.00 0.82 0.00 0.00 66.70 66.53 1nl3 h VAL 500 Cb 1.06 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 31.27 1nl3 h VAL 500 CO 1.20 0.29 0.01 0.44 0.02 0.00 0.00 177.57 179.54 1nl3 h ASP 501 N 0.96 0.15 -0.77 0.57 3.32 -1.97 -0.78 116.42 117.89 1nl3 h ASP 501 Ca 0.23 -0.27 0.01 0.00 0.02 0.00 0.00 57.03 57.02 1nl3 h ASP 501 Cb 0.18 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.65 1nl3 h ASP 501 CO -0.02 0.38 0.51 0.15 -1.72 0.00 0.00 179.24 178.54 1nl3 h PHE 502 N -0.09 0.97 -0.31 4.55 3.57 -1.90 -0.54 116.94 123.20 1nl3 h PHE 502 Ca 0.03 0.02 -0.16 0.00 3.53 0.00 0.00 57.97 61.39 1nl3 h PHE 502 Cb 0.29 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 1nl3 h PHE 502 CO 0.02 0.61 -0.44 -0.07 -2.23 0.00 0.00 178.31 176.20 1nl3 h LEU 503 N 1.04 0.84 -0.21 0.59 3.38 -0.90 -2.18 115.31 117.87 1nl3 h LEU 503 Ca 0.29 -0.40 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1nl3 h LEU 503 Cb -0.11 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 1nl3 h LEU 503 CO -0.07 1.15 0.07 0.74 0.09 0.00 0.00 178.44 180.43 1nl3 h THR 504 N 0.63 1.18 -0.73 0.22 2.02 -0.82 -1.59 112.91 113.81 1nl3 h THR 504 Ca 0.04 -0.55 0.07 0.00 0.77 0.00 0.00 66.41 66.74 1nl3 h THR 504 Cb 1.00 1.16 -0.05 0.00 -1.74 0.00 0.00 68.15 68.52 1nl3 h THR 504 CO 0.10 0.18 0.48 -0.78 0.37 0.00 0.00 175.52 175.86 1nl3 h ASP 505 N 0.17 0.66 -0.19 4.18 3.58 -1.07 -2.70 116.42 121.05 1nl3 h ASP 505 Ca 0.07 0.01 -0.04 0.00 0.42 0.00 0.00 57.03 57.48 1nl3 h ASP 505 Cb 0.21 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.11 1nl3 h ASP 505 CO -0.00 0.42 -0.05 -0.61 -2.88 0.00 0.00 179.24 176.11 1nl3 h GLN 506 N 0.75 0.37 -0.55 0.28 4.15 -1.01 -1.64 115.11 117.45 1nl3 h GLN 506 Ca 0.32 -0.15 0.11 0.00 0.77 0.00 0.00 58.65 59.71 1nl3 h GLN 506 Cb 0.29 -0.02 -0.10 0.00 0.21 0.00 0.00 27.48 27.86 1nl3 h GLN 506 CO -0.11 0.64 -0.10 0.00 -1.93 0.00 0.00 178.83 177.33 1nl3 h ARG 507 N 0.08 0.03 -0.20 1.69 2.47 -1.06 -1.45 114.38 115.94 1nl3 h ARG 507 Ca 0.05 -0.00 -0.15 0.00 -1.26 0.00 0.00 59.98 58.61 1nl3 h ARG 507 Cb 0.51 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.81 1nl3 h ARG 507 CO 0.02 0.02 -0.51 -0.07 0.56 0.00 0.00 179.97 179.99 1nl3 h LEU 508 N 0.03 0.60 -0.13 3.04 4.07 -1.35 -3.17 115.31 118.41 1nl3 h LEU 508 Ca 0.27 -0.31 -0.20 0.00 0.08 0.00 0.00 57.88 57.72 1nl3 h LEU 508 Cb 0.42 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 41.97 1nl3 h LEU 508 CO -0.54 1.01 -0.96 0.03 -1.08 0.00 0.00 178.44 176.90 1nl3 h ARG 509 N 0.43 0.06 0.00 1.13 3.08 -0.86 -2.13 114.38 116.08 1nl3 h ARG 509 Ca 0.02 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 1nl3 h ARG 509 Cb 1.05 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 31.12 1nl3 h ARG 509 CO 0.10 0.97 -0.16 0.93 -1.07 0.00 0.00 179.97 180.74 1nl3 h GLU 510 N 0.02 0.00 -0.31 0.04 5.08 -1.29 -0.51 114.58 117.61 1nl3 h GLU 510 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1nl3 h GLU 510 Cb 1.66 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.91 1nl3 h GLU 510 CO 0.13 0.16 0.00 0.54 -1.00 0.00 0.00 179.01 178.84 1nl3 n ARG 511 N -3.77 1.56 -1.17 2.33 1.74 -1.11 -4.90 116.66 111.35 1nl3 n ARG 511 Ca -0.02 -0.75 -0.03 0.00 -0.77 0.00 0.00 57.85 56.28 1nl3 n ARG 511 Cb 0.26 -1.24 -0.01 0.00 -1.02 0.00 0.00 32.46 30.45 1nl3 n ARG 511 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nl3 n GLY 512 N 0.72 0.57 3.92 -0.13 0.00 -0.20 -5.04 105.19 105.04 1nl3 n GLY 512 Ca 0.07 -0.93 -0.26 0.00 0.00 0.00 0.00 46.02 44.89 1nl3 n GLY 512 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1nl3 s LEU 513 N -0.67 3.92 -0.18 0.99 1.43 -0.82 -4.96 118.68 118.40 1nl3 s LEU 513 Ca 0.00 0.67 -0.16 0.00 -1.03 0.00 0.00 54.13 53.61 1nl3 s LEU 513 Cb 0.00 -3.54 0.05 0.00 0.03 0.00 0.00 46.19 42.73 1nl3 s LEU 513 CO 0.00 -0.34 0.46 -0.62 0.23 0.00 0.00 176.35 176.08 1nl3 s ASP 514 N -3.77 -0.49 0.30 2.29 -1.08 -1.26 -4.14 116.67 108.52 1nl3 s ASP 514 Ca 0.43 0.94 -0.00 0.00 -0.52 0.00 0.00 52.55 53.40 1nl3 s ASP 514 Cb -0.10 0.94 0.47 0.00 -1.46 0.00 0.00 42.92 42.77 1nl3 s ASP 514 CO 0.36 -0.16 1.89 -0.65 0.52 0.00 0.00 175.17 177.13 1nl3 h PRO 515 N 5.58 0.85 0.00 4.34 0.11 -1.92 0.55 132.00 141.51 1nl3 h PRO 515 Ca -0.28 -0.12 -0.13 0.00 0.11 0.00 0.00 66.00 65.58 1nl3 h PRO 515 Cb 1.18 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 1nl3 h PRO 515 CO 0.22 0.69 -0.97 0.28 -0.21 0.00 0.00 178.00 178.00 1nl3 n VAL 516 N -4.33 1.48 -0.18 3.15 0.31 -1.26 -3.81 118.33 113.69 1nl3 n VAL 516 Ca 0.05 0.07 -0.08 0.00 -0.01 0.00 0.00 64.34 64.38 1nl3 n VAL 516 Cb 0.15 -2.21 0.02 0.00 -0.91 0.00 0.00 33.84 30.89 1nl3 n VAL 516 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1nl3 h GLU 517 N -1.00 0.75 -2.22 5.55 3.07 -1.98 -3.36 114.58 115.40 1nl3 h GLU 517 Ca -0.19 -0.11 -0.59 0.00 -0.50 0.00 0.00 59.36 57.97 1nl3 h GLU 517 Cb 0.94 -0.14 -0.41 0.00 -0.84 0.00 0.00 28.75 28.30 1nl3 h GLU 517 CO -0.12 0.62 -0.74 0.25 -1.40 0.00 0.00 179.01 177.62 1nl3 n THR 518 N -4.59 1.36 0.30 1.13 -2.24 0.18 -4.96 114.28 105.47 1nl3 n THR 518 Ca 0.02 -4.81 -0.16 0.00 -2.27 0.00 0.00 64.05 56.84 1nl3 n THR 518 Cb 0.12 -2.05 -0.08 0.00 -2.10 0.00 0.00 70.33 66.21 1nl3 n THR 518 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 1nl3 h PRO 519 N 4.28 -0.74 -0.54 -0.78 0.11 -1.66 -0.15 132.00 132.52 1nl3 h PRO 519 Ca 0.16 0.05 0.01 0.00 0.11 0.00 0.00 66.00 66.34 1nl3 h PRO 519 Cb 0.74 0.17 -0.03 0.00 0.11 0.00 0.00 31.00 31.98 1nl3 h PRO 519 CO 0.71 -0.44 0.34 0.93 -0.21 0.00 0.00 178.00 179.34 1nl3 h GLU 520 N -0.94 0.68 -0.27 1.05 5.08 -1.91 -1.27 114.58 116.99 1nl3 h GLU 520 Ca -0.08 -0.04 -0.17 0.00 -1.00 0.00 0.00 59.36 58.07 1nl3 h GLU 520 Cb 0.64 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1nl3 h GLU 520 CO 0.13 0.45 -0.49 0.93 -1.00 0.00 0.00 179.01 179.03 1nl3 h GLU 521 N 0.70 0.81 -0.47 2.33 3.07 -1.94 -0.59 114.58 118.49 1nl3 h GLU 521 Ca 0.20 -0.51 0.05 0.00 -0.50 0.00 0.00 59.36 58.60 1nl3 h GLU 521 Cb -0.04 0.06 -0.05 0.00 -0.84 0.00 0.00 28.75 27.88 1nl3 h GLU 521 CO -0.06 1.14 0.21 -0.92 -1.40 0.00 0.00 179.01 177.97 1nl3 h TYR 522 N 0.58 0.37 0.21 4.33 5.03 -0.78 0.11 116.97 126.81 1nl3 h TYR 522 Ca 0.02 0.02 -0.00 0.00 2.58 0.00 0.00 58.73 61.34 1nl3 h TYR 522 Cb 1.09 -0.10 -0.01 0.00 1.55 0.00 0.00 36.73 39.27 1nl3 h TYR 522 CO 0.08 0.16 -0.14 0.93 -1.32 0.00 0.00 178.16 177.87 1nl3 h GLU 523 N 0.41 -0.33 -0.69 1.82 4.39 -0.96 0.59 114.58 119.81 1nl3 h GLU 523 Ca 0.22 0.02 -0.07 0.00 0.34 0.00 0.00 59.36 59.87 1nl3 h GLU 523 Cb 0.17 0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.87 1nl3 h GLU 523 CO -0.18 -0.22 0.16 0.00 -1.16 0.00 0.00 179.01 177.61 1nl3 h ALA 524 N 0.44 0.91 -0.56 3.43 0.00 -0.97 -1.65 119.26 120.86 1nl3 h ALA 524 Ca -0.02 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.56 1nl3 h ALA 524 Cb 0.29 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1nl3 h ALA 524 CO 0.01 0.64 0.04 0.00 0.00 0.00 0.00 179.25 179.94 1nl3 h ALA 525 N 1.07 1.01 0.35 0.00 0.00 -0.60 -2.03 119.26 119.06 1nl3 h ALA 525 Ca 0.21 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1nl3 h ALA 525 Cb 0.38 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1nl3 h ALA 525 CO 0.00 0.62 -0.27 2.35 0.00 0.00 0.00 179.25 181.95 1nl3 h TRP 526 N 0.88 -0.72 -0.26 0.00 2.91 -0.01 -0.09 115.95 118.66 1nl3 h TRP 526 Ca 0.17 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.19 1nl3 h TRP 526 Cb 0.46 0.27 -0.01 0.00 -0.51 0.00 0.00 29.16 29.36 1nl3 h TRP 526 CO 0.03 -0.40 0.17 0.45 -1.03 0.00 0.00 178.44 177.66 1nl3 h HIS 527 N -0.62 0.33 -0.78 2.65 3.86 -1.26 -0.17 115.15 119.16 1nl3 h HIS 527 Ca -0.03 0.01 0.05 0.00 -1.16 0.00 0.00 60.37 59.24 1nl3 h HIS 527 Cb 0.54 -0.11 -0.05 0.00 1.06 0.00 0.00 27.41 28.85 1nl3 h HIS 527 CO -0.14 0.21 0.48 1.03 0.86 0.00 0.00 177.93 180.37 1nl3 h SER 528 N 0.35 0.77 0.00 2.45 0.87 -1.24 -3.36 113.55 113.39 1nl3 h SER 528 Ca 0.10 0.01 -0.28 0.00 -1.23 0.00 0.00 61.79 60.39 1nl3 h SER 528 Cb -0.04 -0.15 -0.05 0.00 -0.44 0.00 0.00 62.40 61.72 1nl3 h SER 528 CO -0.02 0.51 -2.19 -0.62 -0.53 0.00 0.00 176.83 173.98 1nl3 n GLU 529 N -4.65 0.95 -0.31 2.24 1.02 -0.06 -4.40 120.64 115.43 1nl3 n GLU 529 Ca 0.10 -0.04 -0.03 0.00 -0.02 0.00 0.00 57.16 57.17 1nl3 n GLU 529 Cb 0.13 -1.47 0.03 0.00 -0.02 0.00 0.00 31.44 30.11 1nl3 n GLU 529 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1nl3 h LEU 530 N 0.00 -1.33 -1.20 -4.62 5.85 -1.17 0.79 115.31 113.62 1nl3 h LEU 530 Ca -0.41 0.28 0.07 0.00 0.84 0.00 0.00 57.88 58.66 1nl3 h LEU 530 Cb 1.91 0.69 -0.06 0.00 0.37 0.00 0.00 40.66 43.57 1nl3 h LEU 530 CO 0.02 -0.30 0.56 -0.65 -0.34 0.00 0.00 178.44 177.74 1nl3 h PRO 531 N -0.07 0.92 0.60 5.25 0.11 -1.77 0.40 132.00 137.44 1nl3 h PRO 531 Ca 0.30 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.33 1nl3 h PRO 531 Cb 0.58 -0.21 0.01 0.00 0.11 0.00 0.00 31.00 31.49 1nl3 h PRO 531 CO -0.87 0.61 -0.29 0.82 -0.21 0.00 0.00 178.00 178.06 1nl3 h ILE 532 N 0.95 0.38 -0.64 4.15 2.04 -1.13 -1.23 117.51 122.03 1nl3 h ILE 532 Ca 0.38 -0.12 0.09 0.00 1.00 0.00 0.00 64.86 66.21 1nl3 h ILE 532 Cb 0.25 0.43 -0.07 0.00 -0.74 0.00 0.00 36.82 36.69 1nl3 h ILE 532 CO -0.14 0.02 0.27 0.58 0.00 0.00 0.00 178.15 178.88 1nl3 h VAL 533 N -0.89 0.80 -0.69 1.67 2.07 -0.69 -0.10 116.25 118.42 1nl3 h VAL 533 Ca -0.08 -0.16 0.11 0.00 0.82 0.00 0.00 66.70 67.38 1nl3 h VAL 533 Cb 0.65 0.28 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 1nl3 h VAL 533 CO 0.14 0.09 0.46 0.50 0.02 0.00 0.00 177.57 178.77 1nl3 h LYS 534 N 0.47 0.50 0.19 1.57 3.64 -0.07 -3.02 116.57 119.85 1nl3 h LYS 534 Ca 0.32 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.66 1nl3 h LYS 534 Cb 0.38 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1nl3 h LYS 534 CO -0.29 0.33 -0.09 0.93 -2.27 0.00 0.00 179.45 178.05 1nl3 h GLU 535 N 0.51 -0.25 -0.06 1.90 4.39 0.25 -1.78 114.58 119.54 1nl3 h GLU 535 Ca 0.32 0.02 0.02 0.00 0.34 0.00 0.00 59.36 60.06 1nl3 h GLU 535 Cb 0.57 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.27 1nl3 h GLU 535 CO -0.10 -0.17 0.10 1.05 -1.16 0.00 0.00 179.01 178.73 1nl3 h GLU 536 N -0.29 0.00 0.00 2.33 9.09 -1.55 -0.76 114.58 123.40 1nl3 h GLU 536 Ca -0.03 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 59.28 1nl3 h GLU 536 Cb 0.20 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.28 1nl3 h GLU 536 CO 0.04 0.00 -0.69 0.00 0.05 0.00 0.00 179.01 178.42 1nl3 h ALA 537 N 1.86 0.12 0.00 1.06 0.00 -1.62 -3.36 119.26 117.31 1nl3 h ALA 537 Ca 0.03 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.18 1nl3 h ALA 537 Cb 0.22 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1nl3 h ALA 537 CO -0.00 0.44 0.00 0.45 0.00 0.00 0.00 179.25 180.14 1nl3 n SER 538 N -4.56 0.02 -0.06 0.00 2.88 -0.67 -0.76 113.62 110.48 1nl3 n SER 538 Ca -0.18 0.51 -0.12 0.00 -1.33 0.00 0.00 58.87 57.75 1nl3 n SER 538 Cb 0.45 -0.51 0.01 0.00 -0.75 0.00 0.00 64.21 63.42 1nl3 n SER 538 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1nl3 h LYS 539 N 0.00 0.76 0.00 -1.46 1.79 -1.34 -3.23 116.57 113.09 1nl3 h LYS 539 Ca 0.00 -0.44 -0.03 0.00 -2.18 0.00 0.00 60.65 58.00 1nl3 h LYS 539 Cb 0.30 0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 30.98 1nl3 h LYS 539 CO 0.00 1.07 -0.24 1.49 -1.08 0.00 0.00 179.45 180.69 1nl3 h GLU 540 N 0.60 0.00 -0.51 3.15 4.57 -1.15 -3.31 114.58 117.93 1nl3 h GLU 540 Ca 0.03 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.15 1nl3 h GLU 540 Cb 1.05 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.62 1nl3 h GLU 540 CO 0.10 0.11 0.05 0.00 -1.18 0.00 0.00 179.01 178.09 1nl3 h ALA 541 N 1.89 1.13 -0.36 2.92 0.00 -0.96 -1.89 119.26 121.99 1nl3 h ALA 541 Ca -0.01 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1nl3 h ALA 541 Cb 1.09 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 1nl3 h ALA 541 CO 0.01 0.57 0.11 0.87 0.00 0.00 0.00 179.25 180.82 1nl3 h LYS 542 N 0.78 0.51 -0.19 0.00 1.57 -1.64 0.56 116.57 118.15 1nl3 h LYS 542 Ca 0.16 -0.07 -0.16 0.00 -1.87 0.00 0.00 60.65 58.71 1nl3 h LYS 542 Cb 0.39 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1nl3 h LYS 542 CO 0.01 0.45 -0.53 0.93 -0.57 0.00 0.00 179.45 179.74 1nl3 h GLU 543 N 0.51 0.56 -0.03 3.15 4.39 -1.60 -1.78 114.58 119.78 1nl3 h GLU 543 Ca 0.12 -0.34 -0.21 0.00 0.34 0.00 0.00 59.36 59.27 1nl3 h GLU 543 Cb 0.15 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 1nl3 h GLU 543 CO -0.01 0.95 -0.87 0.28 -1.16 0.00 0.00 179.01 178.20 1nl3 h VAL 544 N 0.43 1.39 -0.24 3.13 2.07 -0.89 -2.69 116.25 119.46 1nl3 h VAL 544 Ca 0.01 -2.34 0.01 0.00 0.82 0.00 0.00 66.70 65.20 1nl3 h VAL 544 Cb 1.07 2.31 -0.02 0.00 -1.52 0.00 0.00 31.29 33.13 1nl3 h VAL 544 CO 0.10 0.70 0.13 0.40 0.02 0.00 0.00 177.57 178.92 1nl3 h ILE 545 N 0.26 1.02 -0.65 4.57 2.04 -0.84 -2.76 117.51 121.15 1nl3 h ILE 545 Ca -0.06 -0.09 0.11 0.00 1.00 0.00 0.00 64.86 65.82 1nl3 h ILE 545 Cb 1.49 0.72 -0.12 0.00 -0.74 0.00 0.00 36.82 38.17 1nl3 h ILE 545 CO 0.15 0.05 -0.32 -0.33 0.00 0.00 0.00 178.15 177.70 1nl3 h GLU 546 N 0.27 -0.12 0.00 2.37 4.39 -1.24 -2.02 114.58 118.23 1nl3 h GLU 546 Ca 0.09 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.80 1nl3 h GLU 546 Cb 0.00 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 1nl3 h GLU 546 CO -0.05 -0.08 0.00 0.00 -1.16 0.00 0.00 179.01 177.72 1nl3 n ALA 547 N -3.18 2.16 0.00 3.43 0.00 -1.02 -4.82 120.51 117.08 1nl3 n ALA 547 Ca 0.05 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1nl3 n ALA 547 Cb 0.36 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.65 1nl3 n ALA 547 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nl3 n GLY 548 N 0.15 1.01 6.78 0.00 0.00 -0.76 -4.59 105.19 107.79 1nl3 n GLY 548 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1nl3 n GLY 548 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nl3 n GLY 549 N -0.85 -1.62 3.74 -0.02 0.00 -1.07 -2.24 105.19 103.13 1nl3 n GLY 549 Ca 0.00 -1.35 -0.41 0.00 0.00 0.00 0.00 46.02 44.26 1nl3 n GLY 549 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1nl3 s LEU 550 N 0.00 4.53 -0.32 0.99 2.96 -1.26 -4.45 118.68 121.13 1nl3 s LEU 550 Ca 0.00 2.00 -0.11 0.00 -0.22 0.00 0.00 54.13 55.81 1nl3 s LEU 550 Cb 0.00 -3.60 -0.01 0.00 0.50 0.00 0.00 46.19 43.07 1nl3 s LEU 550 CO 0.00 -0.10 0.18 -0.47 -1.32 0.00 0.00 176.35 174.64 1nl3 s TYR 551 N -0.47 3.19 -0.26 5.38 5.04 -0.38 -0.61 117.35 129.25 1nl3 s TYR 551 Ca 0.46 -0.44 -0.11 0.00 -2.44 0.00 0.00 57.07 54.55 1nl3 s TYR 551 Cb -0.27 -2.39 -0.05 0.00 0.35 0.00 0.00 41.96 39.60 1nl3 s TYR 551 CO 0.34 -0.41 0.19 0.08 -1.34 0.00 0.00 175.55 174.40 1nl3 s VAL 552 N 1.65 5.33 -0.23 3.14 1.01 0.05 -0.47 120.40 130.87 1nl3 s VAL 552 Ca 0.05 0.20 -0.03 0.00 0.00 0.00 0.00 61.98 62.20 1nl3 s VAL 552 Cb -0.17 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.69 1nl3 s VAL 552 CO 0.08 0.29 -0.05 -0.22 0.00 0.00 0.00 175.10 175.19 1nl3 s LEU 553 N 1.43 2.95 -0.16 3.92 0.20 0.33 -1.08 118.68 126.28 1nl3 s LEU 553 Ca 0.08 -0.54 -0.14 0.00 0.69 0.00 0.00 54.13 54.22 1nl3 s LEU 553 Cb -0.15 -1.71 -0.05 0.00 -0.43 0.00 0.00 46.19 43.86 1nl3 s LEU 553 CO 0.08 -0.05 0.29 -0.83 -0.29 0.00 0.00 176.35 175.54 1nl3 s GLY 554 N 1.43 2.21 0.00 7.98 0.00 0.25 -0.32 107.32 118.87 1nl3 s GLY 554 Ca 0.04 -0.46 0.17 0.00 0.00 0.00 0.00 44.72 44.48 1nl3 s GLY 554 CO -0.04 0.40 0.88 2.41 0.00 0.00 0.00 173.10 176.75 1nl3 n THR 555 N 3.49 0.00 -3.61 0.90 -1.04 -0.94 0.12 114.28 113.21 1nl3 n THR 555 Ca -0.12 -0.32 -0.06 0.00 -2.04 0.00 0.00 64.05 61.51 1nl3 n THR 555 Cb 0.52 1.19 -0.05 0.00 -1.82 0.00 0.00 70.33 70.17 1nl3 n THR 555 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1nl3 s GLU 556 N -1.98 0.32 0.30 -2.82 2.12 -1.22 -4.65 118.70 110.77 1nl3 s GLU 556 Ca 0.14 0.10 -0.21 0.00 0.36 0.00 0.00 54.97 55.36 1nl3 s GLU 556 Cb 0.14 0.15 -0.09 0.00 0.26 0.00 0.00 34.13 34.58 1nl3 s GLU 556 CO 0.43 -0.09 0.83 1.03 -0.54 0.00 0.00 175.26 176.91 1nl3 s ARG 557 N -0.96 4.30 0.85 4.30 0.52 -1.26 -4.95 118.95 121.74 1nl3 s ARG 557 Ca 0.04 1.01 -0.09 0.00 -0.52 0.00 0.00 55.73 56.16 1nl3 s ARG 557 Cb -0.01 -2.67 0.16 0.00 0.52 0.00 0.00 34.95 32.95 1nl3 s ARG 557 CO -0.04 0.25 1.17 -1.01 0.02 0.00 0.00 175.30 175.69 1nl3 s HIS 558 N -1.74 1.68 -2.00 -0.53 3.76 -1.26 -4.91 115.29 110.29 1nl3 s HIS 558 Ca 0.50 0.09 0.09 0.00 -0.15 0.00 0.00 55.06 55.59 1nl3 s HIS 558 Cb -0.15 -3.60 0.51 0.00 1.11 0.00 0.00 32.58 30.45 1nl3 s HIS 558 CO 0.20 -2.19 0.94 -1.91 -0.85 0.00 0.00 174.74 170.93 1nl3 n GLU 559 N -3.34 0.30 -3.48 1.40 2.13 -1.26 -4.62 120.64 111.77 1nl3 n GLU 559 Ca 0.15 0.00 -0.16 0.00 0.66 0.00 0.00 57.16 57.81 1nl3 n GLU 559 Cb 0.60 -1.44 -0.04 0.00 0.27 0.00 0.00 31.44 30.82 1nl3 n GLU 559 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 1nl3 s SER 560 N -1.97 -0.62 0.39 4.31 1.04 -1.26 -3.65 113.70 111.94 1nl3 s SER 560 Ca 0.13 0.44 0.05 0.00 0.48 0.00 0.00 55.95 57.05 1nl3 s SER 560 Cb 0.06 0.56 0.77 0.00 0.10 0.00 0.00 66.02 67.51 1nl3 s SER 560 CO 0.10 -0.75 2.04 -0.09 0.98 0.00 0.00 173.24 175.52 1nl3 h ARG 561 N 2.62 0.66 -0.71 4.02 9.65 -1.90 -2.82 114.38 125.90 1nl3 h ARG 561 Ca -0.30 -0.04 0.15 0.00 -1.10 0.00 0.00 59.98 58.69 1nl3 h ARG 561 Cb 1.21 -0.15 -0.13 0.00 -1.39 0.00 0.00 29.97 29.50 1nl3 h ARG 561 CO 0.39 0.44 -0.15 -0.09 2.80 0.00 0.00 179.97 183.35 1nl3 h ARG 562 N 0.68 0.01 -0.11 0.20 2.43 -1.96 -1.05 114.38 114.57 1nl3 h ARG 562 Ca 0.19 -0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 59.18 1nl3 h ARG 562 Cb -0.07 -0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.49 1nl3 h ARG 562 CO -0.04 0.01 -0.61 0.82 -1.51 0.00 0.00 179.97 178.64 1nl3 h ILE 563 N 0.01 1.34 -0.74 1.20 2.04 -1.89 -0.66 117.51 118.81 1nl3 h ILE 563 Ca 0.35 -1.89 0.17 0.00 1.00 0.00 0.00 64.86 64.48 1nl3 h ILE 563 Cb 0.54 2.15 -0.11 0.00 -0.74 0.00 0.00 36.82 38.66 1nl3 h ILE 563 CO -0.72 0.58 0.16 0.44 0.00 0.00 0.00 178.15 178.61 1nl3 h ASP 564 N 0.25 -0.03 0.44 1.72 3.45 -1.52 0.12 116.42 120.85 1nl3 h ASP 564 Ca -0.04 0.16 -0.08 0.00 0.43 0.00 0.00 57.03 57.50 1nl3 h ASP 564 Cb 1.25 0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 40.23 1nl3 h ASP 564 CO 0.13 -0.06 -0.36 0.78 -1.57 0.00 0.00 179.24 178.15 1nl3 h ASN 565 N 0.24 0.00 -0.16 6.45 2.35 -0.79 -1.47 115.58 122.20 1nl3 h ASN 565 Ca 0.42 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 56.15 1nl3 h ASN 565 Cb 0.73 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.10 1nl3 h ASN 565 CO -0.54 0.36 0.01 -0.61 -1.65 0.00 0.00 177.43 175.00 1nl3 h GLN 566 N 0.00 0.28 -0.43 0.81 4.15 0.52 -1.08 115.11 119.37 1nl3 h GLN 566 Ca -0.00 -0.08 -0.00 0.00 0.77 0.00 0.00 58.65 59.33 1nl3 h GLN 566 Cb 0.68 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.32 1nl3 h GLN 566 CO 0.05 0.48 0.26 1.25 -1.93 0.00 0.00 178.83 178.94 1nl3 h LEU 567 N 0.04 0.51 -0.81 -2.39 5.85 -0.73 -1.54 115.31 116.23 1nl3 h LEU 567 Ca 0.05 -0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.78 1nl3 h LEU 567 Cb 0.35 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 41.19 1nl3 h LEU 567 CO 0.01 0.40 0.49 0.03 -0.34 0.00 0.00 178.44 179.03 1nl3 h ARG 568 N 0.57 0.88 0.00 1.25 3.08 -1.27 -2.03 114.38 116.86 1nl3 h ARG 568 Ca 0.15 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1nl3 h ARG 568 Cb -0.02 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.83 1nl3 h ARG 568 CO -0.03 0.58 0.00 0.41 -1.07 0.00 0.00 179.97 179.86 1nl3 n GLY 569 N -1.32 -0.83 0.24 0.04 0.00 -0.41 -2.22 105.19 100.70 1nl3 n GLY 569 Ca 0.11 0.14 0.10 0.00 0.00 0.00 0.00 46.02 46.36 1nl3 n GLY 569 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1nl3 h ARG 570 N 0.00 0.00 -6.55 1.61 2.47 -1.18 -3.42 114.38 107.30 1nl3 h ARG 570 Ca 0.00 0.00 -0.46 0.00 -1.26 0.00 0.00 59.98 58.26 1nl3 h ARG 570 Cb 0.04 0.00 0.02 0.00 -1.65 0.00 0.00 29.97 28.38 1nl3 h ARG 570 CO 0.00 0.16 -0.18 0.45 0.56 0.00 0.00 179.97 180.96 1nl3 s SER 571 N -6.48 6.06 -0.36 7.04 0.15 -0.94 -4.65 113.70 114.52 1nl3 s SER 571 Ca -0.03 0.28 0.00 0.00 0.70 0.00 0.00 55.95 56.90 1nl3 s SER 571 Cb 0.14 -1.71 0.00 0.00 -1.71 0.00 0.00 66.02 62.74 1nl3 s SER 571 CO 0.63 -0.47 0.00 0.61 1.20 0.00 0.00 173.24 175.21 1nl3 n GLY 572 N -1.87 0.51 3.76 9.45 0.00 -1.26 -4.99 105.19 110.80 1nl3 n GLY 572 Ca -0.02 -0.85 -0.40 0.00 0.00 0.00 0.00 46.02 44.75 1nl3 n GLY 572 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1nl3 s ARG 573 N -2.95 4.55 -1.47 1.61 1.70 -1.26 -3.43 118.95 117.71 1nl3 s ARG 573 Ca 0.00 1.92 -0.07 0.00 -0.47 0.00 0.00 55.73 57.10 1nl3 s ARG 573 Cb 0.00 -3.15 0.02 0.00 -0.57 0.00 0.00 34.95 31.25 1nl3 s ARG 573 CO 0.00 0.09 0.88 1.04 -1.08 0.00 0.00 175.30 176.23 1nl3 n GLN 574 N 1.06 -6.18 -0.97 3.89 1.13 -1.26 -1.92 117.38 113.14 1nl3 n GLN 574 Ca -0.01 0.83 0.00 0.00 -1.94 0.00 0.00 57.00 55.89 1nl3 n GLN 574 Cb 0.44 -5.78 0.00 0.00 0.11 0.00 0.00 30.24 25.01 1nl3 n GLN 574 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1nl3 n GLY 575 N -1.73 0.54 3.72 1.08 0.00 -1.22 -4.75 105.19 102.83 1nl3 n GLY 575 Ca -0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 1nl3 n GLY 575 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1nl3 n ASP 576 N -0.13 2.50 -4.37 1.61 8.00 -0.81 -4.71 116.55 118.65 1nl3 n ASP 576 Ca 0.00 0.99 -0.28 0.00 0.71 0.00 0.00 54.79 56.20 1nl3 n ASP 576 Cb 0.07 -1.55 0.25 0.00 -0.02 0.00 0.00 41.12 39.87 1nl3 n ASP 576 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1nl3 s PRO 577 N -2.74 -1.07 0.00 -0.24 0.04 -1.26 -4.38 135.00 125.34 1nl3 s PRO 577 Ca 0.70 0.63 0.00 0.00 0.04 0.00 0.00 61.00 62.37 1nl3 s PRO 577 Cb -0.43 -1.55 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1nl3 s PRO 577 CO 0.51 -3.77 0.00 0.41 0.04 0.00 0.00 177.00 174.19 1nl3 n GLY 578 N 0.50 3.38 3.28 0.56 0.00 -0.95 -4.09 105.19 107.87 1nl3 n GLY 578 Ca 0.04 -0.67 -0.25 0.00 0.00 0.00 0.00 46.02 45.15 1nl3 n GLY 578 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1nl3 s GLU 579 N -2.00 1.20 0.01 1.61 2.12 0.22 -1.51 118.70 120.36 1nl3 s GLU 579 Ca 0.00 -1.12 0.00 0.00 0.36 0.00 0.00 54.97 54.22 1nl3 s GLU 579 Cb 0.00 -1.44 -0.01 0.00 0.26 0.00 0.00 34.13 32.94 1nl3 s GLU 579 CO 0.00 0.34 -0.02 -1.54 -0.54 0.00 0.00 175.26 173.50 1nl3 s SER 580 N -1.74 0.22 -0.17 -1.70 1.04 -0.27 -0.77 113.70 110.30 1nl3 s SER 580 Ca 0.07 -0.30 -0.28 0.00 0.48 0.00 0.00 55.95 55.92 1nl3 s SER 580 Cb -0.10 0.05 0.08 0.00 0.10 0.00 0.00 66.02 66.15 1nl3 s SER 580 CO 0.04 -0.17 0.76 -0.60 0.98 0.00 0.00 173.24 174.25 1nl3 s ARG 581 N -0.88 0.87 -0.11 4.02 3.52 -0.24 -0.84 118.95 125.30 1nl3 s ARG 581 Ca -0.09 0.58 -0.01 0.00 -0.13 0.00 0.00 55.73 56.08 1nl3 s ARG 581 Cb -0.06 0.42 -0.03 0.00 -1.56 0.00 0.00 34.95 33.72 1nl3 s ARG 581 CO -0.01 -0.20 -0.05 -0.06 -0.81 0.00 0.00 175.30 174.18 1nl3 s PHE 582 N -0.41 3.00 -0.11 5.12 0.40 -1.26 0.86 117.98 125.57 1nl3 s PHE 582 Ca -0.04 -0.12 -0.03 0.00 -0.60 0.00 0.00 56.93 56.14 1nl3 s PHE 582 Cb -0.03 -1.83 -0.03 0.00 0.51 0.00 0.00 43.02 41.64 1nl3 s PHE 582 CO 0.04 0.17 -0.00 0.71 0.70 0.00 0.00 175.22 176.84 1nl3 s TYR 583 N -0.27 3.14 0.18 0.36 1.51 0.33 -1.38 117.35 121.22 1nl3 s TYR 583 Ca 0.04 0.08 0.00 0.00 -1.01 0.00 0.00 57.07 56.18 1nl3 s TYR 583 Cb -0.13 -1.86 -0.04 0.00 -0.11 0.00 0.00 41.96 39.82 1nl3 s TYR 583 CO 0.02 0.33 0.05 -0.51 -1.11 0.00 0.00 175.55 174.33 1nl3 s LEU 584 N -0.48 1.81 -0.00 -1.29 1.43 0.15 -3.40 118.68 116.90 1nl3 s LEU 584 Ca 0.08 -1.25 -0.09 0.00 -1.03 0.00 0.00 54.13 51.85 1nl3 s LEU 584 Cb -0.12 0.12 0.01 0.00 0.03 0.00 0.00 46.19 46.22 1nl3 s LEU 584 CO 0.02 -0.68 0.17 -0.94 0.23 0.00 0.00 176.35 175.15 1nl3 s SER 585 N -3.16 -0.02 0.00 2.29 1.04 -1.26 0.13 113.70 112.72 1nl3 s SER 585 Ca 0.28 -0.13 0.02 0.00 0.48 0.00 0.00 55.95 56.60 1nl3 s SER 585 Cb 0.07 0.23 0.09 0.00 0.10 0.00 0.00 66.02 66.52 1nl3 s SER 585 CO 0.06 -0.37 0.72 0.18 0.98 0.00 0.00 173.24 174.81 1nl3 n LEU 586 N 1.49 0.00 -0.50 2.42 4.77 -0.77 -1.33 117.00 123.08 1nl3 n LEU 586 Ca -0.22 0.14 0.08 0.00 -0.03 0.00 0.00 56.01 55.97 1nl3 n LEU 586 Cb 0.56 -0.14 0.03 0.00 -2.33 0.00 0.00 43.42 41.55 1nl3 n LEU 586 CO 0.21 -0.13 0.38 0.61 -1.33 0.00 0.00 177.39 177.13 1nl3 n GLY 587 N -1.01 0.05 3.72 -0.72 0.00 -1.26 -3.79 105.19 102.19 1nl3 n GLY 587 Ca 0.01 -0.45 -0.35 0.00 0.00 0.00 0.00 46.02 45.24 1nl3 n GLY 587 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1nl3 s ASP 588 N -1.56 4.31 0.24 1.61 1.01 -0.44 -4.56 116.67 117.28 1nl3 s ASP 588 Ca 0.16 2.40 -0.16 0.00 0.71 0.00 0.00 52.55 55.66 1nl3 s ASP 588 Cb 0.13 -2.59 0.28 0.00 1.01 0.00 0.00 42.92 41.74 1nl3 s ASP 588 CO 0.28 -2.19 1.55 -0.33 0.21 0.00 0.00 175.17 174.70 1nl3 h GLU 589 N -0.10 -0.00 -0.13 8.23 5.08 -1.96 0.46 114.58 126.15 1nl3 h GLU 589 Ca -0.48 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 57.90 1nl3 h GLU 589 Cb 1.30 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.51 1nl3 h GLU 589 CO 0.50 -0.00 -0.30 1.25 -1.00 0.00 0.00 179.01 179.46 1nl3 h LEU 590 N -0.00 -0.98 -1.04 1.33 5.85 -1.91 -2.17 115.31 116.38 1nl3 h LEU 590 Ca 0.37 0.12 -0.03 0.00 0.84 0.00 0.00 57.88 59.18 1nl3 h LEU 590 Cb 0.62 0.39 -0.03 0.00 0.37 0.00 0.00 40.66 42.01 1nl3 h LEU 590 CO -0.99 -0.25 0.31 0.24 -0.34 0.00 0.00 178.44 177.41 1nl3 h MET 591 N -0.28 0.99 0.00 1.25 2.86 -1.47 -2.16 114.93 116.12 1nl3 h MET 591 Ca 0.03 -0.14 -0.01 0.00 -2.06 0.00 0.00 59.70 57.51 1nl3 h MET 591 Cb 0.36 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 31.84 1nl3 h MET 591 CO -0.27 0.78 -0.05 0.00 1.06 0.00 0.00 176.91 178.43 1nl3 h ARG 592 N 0.98 0.00 0.00 1.72 3.08 -0.00 0.16 114.38 120.32 1nl3 h ARG 592 Ca 0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1nl3 h ARG 592 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1nl3 h ARG 592 CO -0.03 0.05 0.00 -2.13 -1.07 0.00 0.00 179.97 176.79 1nl3 n ARG 593 N -4.23 0.36 0.00 0.04 0.63 -0.81 -4.79 116.66 107.86 1nl3 n ARG 593 Ca -0.03 0.03 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1nl3 n ARG 593 Cb 0.13 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.54 1nl3 n ARG 593 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1nl3 n PHE 594 N -1.30 0.00 -1.04 -0.14 3.72 0.53 -5.07 117.46 114.17 1nl3 n PHE 594 Ca 0.12 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.60 1nl3 n PHE 594 Cb 0.22 0.00 0.25 0.00 -0.94 0.00 0.00 39.48 39.02 1nl3 n PHE 594 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1nl3 n ASN 595 N 0.00 3.76 -0.26 4.37 6.94 -1.05 -4.72 115.26 124.30 1nl3 n ASN 595 Ca 0.00 -3.10 -0.05 0.00 -0.02 0.00 0.00 54.58 51.42 1nl3 n ASN 595 Cb 0.00 -0.56 0.06 0.00 -2.36 0.00 0.00 39.78 36.92 1nl3 n ASN 595 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 1nl3 h GLY 596 N 1.72 1.02 0.62 4.83 0.00 -1.61 -1.93 103.07 107.72 1nl3 h GLY 596 Ca 0.03 -0.38 0.04 0.00 0.00 0.00 0.00 47.33 47.02 1nl3 h GLY 596 CO 0.25 0.36 -0.04 0.00 0.00 0.00 0.00 176.54 177.11 1nl3 h ALA 597 N 1.27 0.13 -0.95 3.60 0.00 -1.82 0.41 119.26 121.90 1nl3 h ALA 597 Ca 0.27 0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.31 1nl3 h ALA 597 Cb -0.10 0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.77 1nl3 h ALA 597 CO -0.06 -0.47 0.61 0.00 0.00 0.00 0.00 179.25 179.32 1nl3 h ALA 598 N 1.19 1.30 -0.36 0.00 0.00 -1.77 -1.94 119.26 117.68 1nl3 h ALA 598 Ca 0.09 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 1nl3 h ALA 598 Cb 0.14 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1nl3 h ALA 598 CO -0.20 0.42 -0.19 -0.07 0.00 0.00 0.00 179.25 179.21 1nl3 h LEU 599 N 1.13 0.78 -1.05 0.00 4.07 -0.91 -3.02 115.31 116.31 1nl3 h LEU 599 Ca 0.40 -0.41 -0.04 0.00 0.08 0.00 0.00 57.88 57.91 1nl3 h LEU 599 Cb 0.12 -0.22 -0.03 0.00 1.08 0.00 0.00 40.66 41.62 1nl3 h LEU 599 CO -0.16 1.03 0.22 1.05 -1.08 0.00 0.00 178.44 179.50 1nl3 h GLU 600 N 0.54 0.90 -0.56 1.13 -0.00 -0.31 0.44 114.58 116.72 1nl3 h GLU 600 Ca 0.08 -0.15 -0.08 0.00 -0.00 0.00 0.00 59.36 59.20 1nl3 h GLU 600 Cb 0.74 -0.15 -0.02 0.00 -0.00 0.00 0.00 28.75 29.32 1nl3 h GLU 600 CO 0.06 0.75 0.04 1.79 -0.00 0.00 0.00 179.01 181.65 1nl3 h THR 601 N 0.88 1.26 -0.03 -1.06 1.35 -1.42 -0.91 112.91 112.98 1nl3 h THR 601 Ca 0.21 -1.06 -0.00 0.00 -0.55 0.00 0.00 66.41 65.00 1nl3 h THR 601 Cb 0.21 0.84 -0.00 0.00 -1.73 0.00 0.00 68.15 67.46 1nl3 h THR 601 CO -0.01 0.38 0.02 0.25 -0.25 0.00 0.00 175.52 175.90 1nl3 h LEU 602 N 0.85 0.04 -0.99 3.87 5.85 -1.25 0.13 115.31 123.82 1nl3 h LEU 602 Ca 0.16 -0.12 -0.10 0.00 0.84 0.00 0.00 57.88 58.66 1nl3 h LEU 602 Cb 0.49 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 1nl3 h LEU 602 CO 0.02 0.15 -0.41 -0.07 -0.34 0.00 0.00 178.44 177.78 1nl3 h LEU 603 N -0.07 0.19 -1.07 2.25 4.07 -0.91 0.54 115.31 120.32 1nl3 h LEU 603 Ca 0.01 -0.08 -0.10 0.00 0.08 0.00 0.00 57.88 57.80 1nl3 h LEU 603 Cb 0.12 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 41.79 1nl3 h LEU 603 CO -0.00 0.59 -0.41 0.74 -1.08 0.00 0.00 178.44 178.28 1nl3 h THR 604 N 0.15 1.31 -0.18 0.22 2.02 -0.99 -2.07 112.91 113.36 1nl3 h THR 604 Ca 0.01 -1.47 -0.16 0.00 0.77 0.00 0.00 66.41 65.56 1nl3 h THR 604 Cb 0.80 1.73 -0.01 0.00 -1.74 0.00 0.00 68.15 68.94 1nl3 h THR 604 CO 0.06 0.43 -0.56 0.03 0.37 0.00 0.00 175.52 175.86 1nl3 h ARG 605 N 0.09 0.56 -0.91 6.66 3.08 0.44 -3.13 114.38 121.16 1nl3 h ARG 605 Ca 0.01 -0.35 0.00 0.00 0.07 0.00 0.00 59.98 59.70 1nl3 h ARG 605 Cb 0.77 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.86 1nl3 h ARG 605 CO 0.06 0.96 0.00 1.28 -1.07 0.00 0.00 179.97 181.20 1nl3 n LEU 606 N -3.95 0.91 -3.90 3.04 4.77 0.07 -4.85 117.00 113.09 1nl3 n LEU 606 Ca -0.03 -0.46 -0.28 0.00 -0.03 0.00 0.00 56.01 55.21 1nl3 n LEU 606 Cb 0.61 -0.46 0.02 0.00 -2.33 0.00 0.00 43.42 41.26 1nl3 n LEU 606 CO 0.47 0.23 0.03 0.59 -1.33 0.00 0.00 177.39 177.38 1nl3 n ASN 607 N -0.03 -3.43 -4.53 -1.43 3.02 -1.18 -4.98 115.26 102.69 1nl3 n ASN 607 Ca 0.00 -0.83 -0.37 0.00 -0.03 0.00 0.00 54.58 53.35 1nl3 n ASN 607 Cb 0.23 -3.76 -0.12 0.00 -0.61 0.00 0.00 39.78 35.53 1nl3 n ASN 607 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1nl3 s LEU 608 N -7.11 3.78 0.79 3.41 0.20 -0.80 -5.06 118.68 113.89 1nl3 s LEU 608 Ca 0.46 -0.09 -0.11 0.00 0.69 0.00 0.00 54.13 55.08 1nl3 s LEU 608 Cb -0.23 -2.04 0.08 0.00 -0.43 0.00 0.00 46.19 43.57 1nl3 s LEU 608 CO 0.84 -0.04 1.14 -2.16 -0.29 0.00 0.00 176.35 175.84 1nl3 s PRO 609 N 1.70 1.97 0.05 0.98 0.04 -1.26 -4.35 135.00 134.12 1nl3 s PRO 609 Ca 0.07 -0.00 -0.27 0.00 0.04 0.00 0.00 61.00 60.83 1nl3 s PRO 609 Cb -0.16 -2.00 -0.17 0.00 0.04 0.00 0.00 34.50 32.21 1nl3 s PRO 609 CO 0.08 -1.54 1.47 -0.44 0.04 0.00 0.00 177.00 176.61 1nl3 h ASP 610 N -0.97 -0.41 0.00 6.66 5.19 -1.99 -3.25 116.42 121.66 1nl3 h ASP 610 Ca -0.46 -0.08 0.00 0.00 -0.62 0.00 0.00 57.03 55.88 1nl3 h ASP 610 Cb 1.32 0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.94 1nl3 h ASP 610 CO 0.64 -0.17 0.00 -0.90 -3.12 0.00 0.00 179.24 175.69 1nl3 n ASP 611 N -5.24 1.66 -4.15 6.45 5.75 -1.26 -4.23 116.55 115.53 1nl3 n ASP 611 Ca -0.10 -1.66 -0.33 0.00 -0.01 0.00 0.00 54.79 52.68 1nl3 n ASP 611 Cb 0.25 -0.42 -0.15 0.00 -1.03 0.00 0.00 41.12 39.77 1nl3 n ASP 611 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1nl3 s VAL 612 N -0.42 2.45 0.12 2.12 1.01 -1.23 -5.10 120.40 119.35 1nl3 s VAL 612 Ca 0.00 -1.06 -0.35 0.00 0.00 0.00 0.00 61.98 60.57 1nl3 s VAL 612 Cb 0.00 -2.18 -0.16 0.00 0.00 0.00 0.00 36.38 34.04 1nl3 s VAL 612 CO 0.00 0.32 1.36 -2.65 0.00 0.00 0.00 175.10 174.13 1nl3 n PRO 613 N 4.62 1.36 -2.77 2.72 -0.02 -1.26 -4.67 135.00 134.97 1nl3 n PRO 613 Ca -0.18 0.49 -0.42 0.00 -2.02 0.00 0.00 63.50 61.37 1nl3 n PRO 613 Cb 0.48 -2.13 -0.03 0.00 -0.02 0.00 0.00 33.50 31.79 1nl3 n PRO 613 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1nl3 s ILE 614 N 0.44 4.80 -1.05 4.25 1.01 0.36 -4.95 121.20 126.06 1nl3 s ILE 614 Ca 0.81 1.85 0.18 0.00 0.00 0.00 0.00 60.65 63.49 1nl3 s ILE 614 Cb -0.88 -4.23 0.70 0.00 0.01 0.00 0.00 42.46 38.05 1nl3 s ILE 614 CO 0.46 -0.03 1.61 -0.62 0.00 0.00 0.00 174.94 176.35 1nl3 n GLU 615 N 5.46 3.69 -2.30 2.79 -0.58 -1.26 -4.44 120.64 123.99 1nl3 n GLU 615 Ca 0.08 -2.86 -0.43 0.00 -0.42 0.00 0.00 57.16 53.53 1nl3 n GLU 615 Cb 0.48 -1.87 -0.02 0.00 -0.57 0.00 0.00 31.44 29.46 1nl3 n GLU 615 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1nl3 s ALA 616 N -1.87 3.64 0.62 0.62 0.00 -1.26 -4.89 121.76 118.62 1nl3 s ALA 616 Ca 0.50 0.61 0.31 0.00 0.00 0.00 0.00 51.96 53.37 1nl3 s ALA 616 Cb 0.32 -3.65 1.68 0.00 0.00 0.00 0.00 23.12 21.47 1nl3 s ALA 616 CO 0.23 -1.22 2.02 -0.22 0.00 0.00 0.00 175.76 176.57 1nl3 h LYS 617 N 8.56 0.00 0.00 0.00 1.63 -2.00 -2.34 116.57 122.42 1nl3 h LYS 617 Ca -0.31 0.00 -0.20 0.00 -0.85 0.00 0.00 60.65 59.29 1nl3 h LYS 617 Cb 1.13 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.72 1nl3 h LYS 617 CO 0.96 0.00 -1.65 -0.12 -3.45 0.00 0.00 179.45 175.19 1nl3 n MET 618 N -3.38 0.64 0.07 1.90 1.56 -1.26 -2.52 117.12 114.13 1nl3 n MET 618 Ca 0.01 0.16 -0.06 0.00 -0.27 0.00 0.00 57.70 57.54 1nl3 n MET 618 Cb 0.40 -1.74 0.10 0.00 2.15 0.00 0.00 33.22 34.13 1nl3 n MET 618 CO 0.00 0.00 0.00 0.28 -0.73 0.00 0.00 175.97 175.52 1nl3 h VAL 619 N 0.00 1.38 0.28 1.12 2.07 -1.85 -2.56 116.25 116.69 1nl3 h VAL 619 Ca -0.22 -1.98 -0.01 0.00 0.82 0.00 0.00 66.70 65.30 1nl3 h VAL 619 Cb 1.69 1.99 0.00 0.00 -1.52 0.00 0.00 31.29 33.45 1nl3 h VAL 619 CO 0.04 0.59 -0.13 0.74 0.02 0.00 0.00 177.57 178.83 1nl3 h THR 620 N 0.22 0.76 0.00 2.57 2.02 -1.46 -1.94 112.91 115.07 1nl3 h THR 620 Ca -0.01 -0.21 -0.02 0.00 0.77 0.00 0.00 66.41 66.94 1nl3 h THR 620 Cb 1.13 0.88 -0.00 0.00 -1.74 0.00 0.00 68.15 68.41 1nl3 h THR 620 CO 0.10 0.05 -0.08 -0.09 0.37 0.00 0.00 175.52 175.86 1nl3 h ARG 621 N -0.48 0.00 -0.11 6.66 1.12 -1.54 -2.27 114.38 117.76 1nl3 h ARG 621 Ca -0.04 0.00 -0.24 0.00 -1.11 0.00 0.00 59.98 58.60 1nl3 h ARG 621 Cb 0.36 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 30.33 1nl3 h ARG 621 CO 0.06 0.08 -0.85 0.00 -3.11 0.00 0.00 179.97 176.15 1nl3 h ALA 622 N 1.92 0.25 0.42 2.80 0.00 -1.23 -2.31 119.26 121.11 1nl3 h ALA 622 Ca -0.00 -0.63 -0.02 0.00 0.00 0.00 0.00 54.91 54.26 1nl3 h ALA 622 Cb 0.18 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1nl3 h ALA 622 CO 0.01 0.68 -0.20 0.82 0.00 0.00 0.00 179.25 180.55 1nl3 h ILE 623 N 0.49 0.50 -0.86 0.00 2.04 -0.88 -0.82 117.51 117.99 1nl3 h ILE 623 Ca -0.08 -0.49 0.22 0.00 1.00 0.00 0.00 64.86 65.51 1nl3 h ILE 623 Cb 1.49 0.70 -0.13 0.00 -0.74 0.00 0.00 36.82 38.13 1nl3 h ILE 623 CO 0.17 0.08 0.27 0.50 0.00 0.00 0.00 178.15 179.17 1nl3 h LYS 624 N -0.88 0.27 -0.19 2.37 1.63 -1.52 -1.18 116.57 117.06 1nl3 h LYS 624 Ca -0.06 -0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.72 1nl3 h LYS 624 Cb 0.56 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.12 1nl3 h LYS 624 CO 0.09 0.18 0.10 1.03 -3.45 0.00 0.00 179.45 177.41 1nl3 h SER 625 N 0.28 0.24 0.08 4.20 0.87 -1.26 -0.52 113.55 117.44 1nl3 h SER 625 Ca 0.53 -0.09 0.02 0.00 -1.23 0.00 0.00 61.79 61.02 1nl3 h SER 625 Cb 1.02 -0.06 -0.04 0.00 -0.44 0.00 0.00 62.40 62.88 1nl3 h SER 625 CO -0.59 0.26 -0.29 0.00 -0.53 0.00 0.00 176.83 175.69 1nl3 h ALA 626 N 0.99 -0.46 -0.63 6.23 0.00 0.08 0.43 119.26 125.89 1nl3 h ALA 626 Ca 0.07 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1nl3 h ALA 626 Cb 0.08 0.48 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1nl3 h ALA 626 CO -0.01 -0.82 0.41 0.37 0.00 0.00 0.00 179.25 179.21 1nl3 h GLN 627 N -0.48 0.82 -0.64 0.00 4.15 -1.41 -1.09 115.11 116.46 1nl3 h GLN 627 Ca 0.04 -0.05 0.06 0.00 0.77 0.00 0.00 58.65 59.48 1nl3 h GLN 627 Cb 0.53 -0.19 -0.06 0.00 0.21 0.00 0.00 27.48 27.98 1nl3 h GLN 627 CO -0.19 0.54 0.34 1.15 -1.93 0.00 0.00 178.83 178.74 1nl3 h THR 628 N 0.85 0.93 -0.49 2.39 2.02 -0.73 -0.59 112.91 117.29 1nl3 h THR 628 Ca 0.23 -0.21 -0.02 0.00 0.77 0.00 0.00 66.41 67.18 1nl3 h THR 628 Cb -0.09 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 66.55 1nl3 h THR 628 CO -0.05 0.11 0.21 1.56 0.37 0.00 0.00 175.52 177.72 1nl3 h GLN 629 N 0.61 0.69 -0.02 6.66 4.20 -0.22 -0.99 115.11 126.05 1nl3 h GLN 629 Ca 0.29 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.91 1nl3 h GLN 629 Cb 0.22 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 27.87 1nl3 h GLN 629 CO -0.20 0.56 -0.00 0.28 -0.67 0.00 0.00 178.83 178.79 1nl3 h VAL 630 N 0.69 1.28 -0.37 -0.54 2.07 -0.55 -2.11 116.25 116.72 1nl3 h VAL 630 Ca 0.17 -0.84 0.08 0.00 0.82 0.00 0.00 66.70 66.93 1nl3 h VAL 630 Cb 0.11 1.81 -0.08 0.00 -1.52 0.00 0.00 31.29 31.61 1nl3 h VAL 630 CO -0.02 0.22 -0.24 -0.33 0.02 0.00 0.00 177.57 177.22 1nl3 h GLU 631 N -0.31 -0.18 -0.82 1.57 5.08 -0.79 -1.72 114.58 117.41 1nl3 h GLU 631 Ca 0.01 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1nl3 h GLU 631 Cb 0.36 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.62 1nl3 h GLU 631 CO 0.00 -0.12 0.41 1.96 -1.00 0.00 0.00 179.01 180.26 1nl3 h GLN 632 N -0.18 1.17 -0.12 2.33 1.08 -1.23 -1.87 115.11 116.28 1nl3 h GLN 632 Ca 0.18 -0.16 0.04 0.00 -1.45 0.00 0.00 58.65 57.26 1nl3 h GLN 632 Cb 0.47 -0.22 -0.05 0.00 -0.05 0.00 0.00 27.48 27.63 1nl3 h GLN 632 CO -0.48 0.88 -0.17 0.37 -0.95 0.00 0.00 178.83 178.49 1nl3 h GLN 633 N 1.16 -0.21 -0.77 1.46 4.15 -0.88 -1.06 115.11 118.96 1nl3 h GLN 633 Ca 0.28 0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.73 1nl3 h GLN 633 Cb 0.09 0.05 -0.04 0.00 0.21 0.00 0.00 27.48 27.79 1nl3 h GLN 633 CO -0.04 -0.14 0.51 -0.91 -1.93 0.00 0.00 178.83 176.32 1nl3 h ASN 634 N -0.22 0.88 -0.06 -0.69 2.35 -0.99 -1.55 115.58 115.29 1nl3 h ASN 634 Ca 0.09 -0.02 0.03 0.00 -0.55 0.00 0.00 56.30 55.85 1nl3 h ASN 634 Cb 0.36 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.48 1nl3 h ASN 634 CO -0.25 0.63 -0.13 0.15 -1.65 0.00 0.00 177.43 176.18 1nl3 h PHE 635 N 1.03 -0.32 -0.62 1.19 3.57 -1.14 -0.84 116.94 119.81 1nl3 h PHE 635 Ca 0.29 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.89 1nl3 h PHE 635 Cb -0.10 0.15 -0.07 0.00 2.79 0.00 0.00 35.95 38.72 1nl3 h PHE 635 CO -0.02 -0.19 0.26 0.93 -2.23 0.00 0.00 178.31 177.06 1nl3 h GLU 636 N -0.18 0.45 -0.27 1.11 3.07 -0.87 0.10 114.58 117.99 1nl3 h GLU 636 Ca 0.07 -0.03 0.02 0.00 -0.50 0.00 0.00 59.36 58.92 1nl3 h GLU 636 Cb 0.27 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.06 1nl3 h GLU 636 CO -0.17 0.30 0.12 0.28 -1.40 0.00 0.00 179.01 178.14 1nl3 h VAL 637 N 0.47 0.97 0.15 3.13 2.07 -0.76 -0.42 116.25 121.85 1nl3 h VAL 637 Ca 0.31 -0.09 -0.00 0.00 0.82 0.00 0.00 66.70 67.73 1nl3 h VAL 637 Cb 0.34 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 1nl3 h VAL 637 CO -0.28 0.05 -0.15 0.03 0.02 0.00 0.00 177.57 177.24 1nl3 h ARG 638 N 0.26 -0.29 -1.00 1.57 3.08 -0.84 -1.56 114.38 115.61 1nl3 h ARG 638 Ca 0.11 0.02 0.41 0.00 0.07 0.00 0.00 59.98 60.59 1nl3 h ARG 638 Cb 0.05 0.07 -0.18 0.00 0.08 0.00 0.00 29.97 29.99 1nl3 h ARG 638 CO -0.09 -0.19 0.52 -0.22 -1.07 0.00 0.00 179.97 178.92 1nl3 h LYS 639 N -0.30 0.02 0.00 0.04 3.64 -0.63 0.60 116.57 119.96 1nl3 h LYS 639 Ca -0.02 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1nl3 h LYS 639 Cb 0.26 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 1nl3 h LYS 639 CO -0.02 0.02 -0.00 -0.91 -2.27 0.00 0.00 179.45 176.27 1nl3 h ASN 640 N 0.02 -0.00 -0.71 4.20 4.21 -0.88 -2.37 115.58 120.05 1nl3 h ASN 640 Ca 0.83 -0.53 0.15 0.00 1.21 0.00 0.00 56.30 57.97 1nl3 h ASN 640 Cb 2.17 0.00 -0.11 0.00 -1.12 0.00 0.00 38.32 39.26 1nl3 h ASN 640 CO -0.76 0.53 0.12 0.58 -1.29 0.00 0.00 177.43 176.61 1nl3 h VAL 641 N -0.54 0.49 -0.07 2.81 2.07 0.14 0.48 116.25 121.63 1nl3 h VAL 641 Ca -0.00 -0.08 -0.08 0.00 0.82 0.00 0.00 66.70 67.36 1nl3 h VAL 641 Cb 0.53 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 1nl3 h VAL 641 CO 0.00 0.04 -0.28 0.25 0.02 0.00 0.00 177.57 177.60 1nl3 h LEU 642 N 0.22 0.37 -1.46 2.57 5.85 -1.45 -0.48 115.31 120.92 1nl3 h LEU 642 Ca 0.40 -0.63 -0.01 0.00 0.84 0.00 0.00 57.88 58.47 1nl3 h LEU 642 Cb 0.67 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 1nl3 h LEU 642 CO -0.53 0.94 0.22 0.07 -0.34 0.00 0.00 178.44 178.79 1nl3 h LYS 643 N -0.18 0.58 0.00 1.25 2.10 -1.00 0.01 116.57 119.33 1nl3 h LYS 643 Ca -0.01 -0.06 -0.12 0.00 -2.00 0.00 0.00 60.65 58.46 1nl3 h LYS 643 Cb 0.91 -0.12 -0.02 0.00 -0.90 0.00 0.00 32.23 32.11 1nl3 h LYS 643 CO 0.06 0.44 -0.58 1.88 -2.00 0.00 0.00 179.45 179.24 1nl3 h TYR 644 N 0.58 0.00 -0.15 0.07 -1.99 -0.91 -3.28 116.97 111.29 1nl3 h TYR 644 Ca 0.15 0.00 -0.15 0.00 2.00 0.00 0.00 58.73 60.73 1nl3 h TYR 644 Cb 0.04 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.76 1nl3 h TYR 644 CO 0.00 0.58 -0.54 0.22 -0.00 0.00 0.00 178.16 178.42 1nl3 h ASP 645 N 0.00 0.48 -0.78 3.88 3.58 0.43 -3.30 116.42 120.71 1nl3 h ASP 645 Ca -0.01 -0.26 0.17 0.00 0.42 0.00 0.00 57.03 57.36 1nl3 h ASP 645 Cb 1.35 -0.14 -0.11 0.00 1.72 0.00 0.00 39.33 42.15 1nl3 h ASP 645 CO 0.08 0.93 0.22 -0.33 -2.88 0.00 0.00 179.24 177.26 1nl3 h GLU 646 N 0.34 0.29 -0.00 0.28 4.39 -1.12 0.15 114.58 118.90 1nl3 h GLU 646 Ca 0.01 -0.02 0.02 0.00 0.34 0.00 0.00 59.36 59.71 1nl3 h GLU 646 Cb 1.06 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.60 1nl3 h GLU 646 CO 0.10 0.19 -0.44 0.28 -1.16 0.00 0.00 179.01 177.98 1nl3 h VAL 647 N 0.30 0.00 -0.90 3.13 2.07 -1.75 -1.57 116.25 117.53 1nl3 h VAL 647 Ca 0.45 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.95 1nl3 h VAL 647 Cb 0.79 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.51 1nl3 h VAL 647 CO -0.52 0.00 0.50 0.24 0.02 0.00 0.00 177.57 177.81 1nl3 h MET 648 N -0.54 1.25 -0.89 1.57 2.86 -1.50 -2.68 114.93 115.00 1nl3 h MET 648 Ca 0.01 -0.14 0.14 0.00 -2.06 0.00 0.00 59.70 57.65 1nl3 h MET 648 Cb 0.59 -0.25 -0.09 0.00 0.06 0.00 0.00 31.60 31.91 1nl3 h MET 648 CO -0.29 0.91 0.49 -0.97 1.06 0.00 0.00 176.91 178.11 1nl3 h ASN 649 N 1.26 0.64 -0.41 1.22 -0.00 -0.30 0.11 115.58 118.10 1nl3 h ASN 649 Ca 0.32 0.08 -0.06 0.00 -0.00 0.00 0.00 56.30 56.64 1nl3 h ASN 649 Cb 0.02 -0.03 -0.02 0.00 -0.00 0.00 0.00 38.32 38.29 1nl3 h ASN 649 CO -0.05 0.29 0.03 1.56 -0.00 0.00 0.00 177.43 179.26 1nl3 h GLN 650 N 0.72 0.70 -0.57 6.67 1.08 -0.97 -1.97 115.11 120.77 1nl3 h GLN 650 Ca 0.47 -0.21 -0.07 0.00 -1.45 0.00 0.00 58.65 57.40 1nl3 h GLN 650 Cb 0.62 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.96 1nl3 h GLN 650 CO -0.34 0.76 0.08 1.96 -0.95 0.00 0.00 178.83 180.35 1nl3 h GLN 651 N 0.54 0.94 -0.18 1.46 4.20 -1.13 -3.10 115.11 117.84 1nl3 h GLN 651 Ca 0.12 -0.26 -0.16 0.00 0.06 0.00 0.00 58.65 58.41 1nl3 h GLN 651 Cb 0.43 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 1nl3 h GLN 651 CO 0.01 0.91 -0.55 0.07 -0.67 0.00 0.00 178.83 178.61 1nl3 h ARG 652 N 0.84 0.54 -0.43 1.46 0.11 -0.70 -1.63 114.38 114.58 1nl3 h ARG 652 Ca 0.17 -0.34 0.09 0.00 0.10 0.00 0.00 59.98 59.99 1nl3 h ARG 652 Cb 0.43 0.04 -0.08 0.00 1.11 0.00 0.00 29.97 31.47 1nl3 h ARG 652 CO 0.01 0.95 -0.10 0.87 0.10 0.00 0.00 179.97 181.80 1nl3 h LYS 653 N 0.42 0.00 0.04 0.08 1.79 -1.31 0.84 116.57 118.43 1nl3 h LYS 653 Ca 0.01 -0.00 0.02 0.00 -2.18 0.00 0.00 60.65 58.50 1nl3 h LYS 653 Cb 1.09 -0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.71 1nl3 h LYS 653 CO 0.10 0.00 -0.16 0.28 -1.08 0.00 0.00 179.45 178.59 1nl3 h VAL 654 N 0.00 0.62 -0.42 0.50 2.07 -1.42 -1.49 116.25 116.11 1nl3 h VAL 654 Ca 0.21 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.67 1nl3 h VAL 654 Cb 0.31 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1nl3 h VAL 654 CO -0.44 0.00 0.04 0.40 0.02 0.00 0.00 177.57 177.59 1nl3 h ILE 655 N -0.29 1.21 -0.21 4.57 1.08 -0.24 -1.89 117.51 121.74 1nl3 h ILE 655 Ca 0.04 -0.82 -0.04 0.00 -0.39 0.00 0.00 64.86 63.64 1nl3 h ILE 655 Cb 0.33 0.85 -0.01 0.00 -3.07 0.00 0.00 36.82 34.93 1nl3 h ILE 655 CO -0.13 0.29 -0.04 1.88 -0.69 0.00 0.00 178.15 179.47 1nl3 h TYR 656 N 0.63 0.43 -0.69 1.37 -1.99 0.72 -2.17 116.97 115.26 1nl3 h TYR 656 Ca 0.13 -0.09 0.14 0.00 2.00 0.00 0.00 58.73 60.91 1nl3 h TYR 656 Cb 0.33 -0.11 -0.13 0.00 2.00 0.00 0.00 36.73 38.83 1nl3 h TYR 656 CO 0.01 0.62 -0.19 0.00 -0.00 0.00 0.00 178.16 178.60 1nl3 h ALA 657 N 0.75 0.41 0.23 3.88 0.00 -1.00 0.16 119.26 123.69 1nl3 h ALA 657 Ca 0.05 0.26 -0.01 0.00 0.00 0.00 0.00 54.91 55.21 1nl3 h ALA 657 Cb 0.47 0.55 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1nl3 h ALA 657 CO 0.02 -0.44 -0.11 0.93 0.00 0.00 0.00 179.25 179.64 1nl3 h GLU 658 N -0.02 -0.30 -0.87 0.00 4.39 -1.12 -2.35 114.58 114.31 1nl3 h GLU 658 Ca 0.32 0.02 0.01 0.00 0.34 0.00 0.00 59.36 60.06 1nl3 h GLU 658 Cb 0.51 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.19 1nl3 h GLU 658 CO -0.71 -0.20 0.58 0.00 -1.16 0.00 0.00 179.01 177.51 1nl3 h ARG 659 N -0.31 1.14 -0.20 2.33 3.08 -1.00 -2.63 114.38 116.77 1nl3 h ARG 659 Ca -0.03 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.95 1nl3 h ARG 659 Cb 0.24 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.03 1nl3 h ARG 659 CO 0.05 0.75 0.13 -0.09 -1.07 0.00 0.00 179.97 179.74 1nl3 h ARG 660 N 1.17 0.27 0.00 0.04 2.43 -0.51 -0.61 114.38 117.17 1nl3 h ARG 660 Ca 0.32 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.40 1nl3 h ARG 660 Cb -0.13 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 1nl3 h ARG 660 CO -0.07 0.21 -0.32 0.07 -1.51 0.00 0.00 179.97 178.34 1nl3 h ARG 661 N 0.25 0.00 -0.25 0.20 0.11 -1.24 0.23 114.38 113.68 1nl3 h ARG 661 Ca 0.07 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 60.03 1nl3 h ARG 661 Cb 0.00 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.08 1nl3 h ARG 661 CO -0.01 0.32 -0.33 0.82 0.10 0.00 0.00 179.97 180.87 1nl3 h ILE 662 N 0.00 1.31 -0.83 0.08 2.04 -1.08 -2.79 117.51 116.24 1nl3 h ILE 662 Ca -0.00 -1.52 0.02 0.00 1.00 0.00 0.00 64.86 64.36 1nl3 h ILE 662 Cb 0.60 1.70 -0.05 0.00 -0.74 0.00 0.00 36.82 38.33 1nl3 h ILE 662 CO 0.04 0.48 0.54 -0.07 0.00 0.00 0.00 178.15 179.14 1nl3 h LEU 663 N 0.39 0.91 -1.67 1.44 3.38 -0.38 -2.33 115.31 117.05 1nl3 h LEU 663 Ca 0.03 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1nl3 h LEU 663 Cb 0.91 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 1nl3 h LEU 663 CO 0.08 0.64 -0.17 -0.33 0.09 0.00 0.00 178.44 178.74 1nl3 h GLU 664 N 1.07 0.00 0.00 1.13 5.08 -0.52 -3.38 114.58 117.96 1nl3 h GLU 664 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1nl3 h GLU 664 Cb -0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1nl3 h GLU 664 CO -0.10 0.17 0.00 0.41 -1.00 0.00 0.00 179.01 178.50 1nl3 n GLY 665 N -1.02 1.02 3.39 -3.84 0.00 -0.88 -5.07 105.19 98.80 1nl3 n GLY 665 Ca -0.02 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.56 1nl3 n GLY 665 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nl3 n GLU 666 N -1.46 0.22 -2.36 1.61 1.02 -1.12 -4.88 120.64 113.67 1nl3 n GLU 666 Ca 0.00 0.08 -0.43 0.00 -0.02 0.00 0.00 57.16 56.79 1nl3 n GLU 666 Cb 0.00 -1.17 -0.02 0.00 -0.02 0.00 0.00 31.44 30.23 1nl3 n GLU 666 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1nl3 s ASN 667 N -0.96 6.42 -0.07 1.62 3.84 -1.26 -4.91 114.94 119.63 1nl3 s ASN 667 Ca 0.62 0.94 0.18 0.00 0.21 0.00 0.00 52.86 54.80 1nl3 s ASN 667 Cb -0.73 -2.54 0.61 0.00 -0.55 0.00 0.00 41.25 38.05 1nl3 s ASN 667 CO 0.59 -1.34 1.52 0.18 -2.79 0.00 0.00 177.10 175.26 1nl3 n LEU 668 N 8.51 4.15 -0.18 3.21 4.77 -1.26 -4.55 117.00 131.65 1nl3 n LEU 668 Ca 0.16 -2.29 0.13 0.00 -0.03 0.00 0.00 56.01 53.99 1nl3 n LEU 668 Cb 0.48 -0.49 0.46 0.00 -2.33 0.00 0.00 43.42 41.54 1nl3 n LEU 668 CO 0.68 0.84 1.21 0.50 -1.33 0.00 0.00 177.39 179.29 1nl3 h LYS 669 N 3.59 0.49 -0.26 3.23 3.64 -1.92 0.38 116.57 125.71 1nl3 h LYS 669 Ca 0.00 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 1nl3 h LYS 669 Cb 1.20 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.89 1nl3 h LYS 669 CO 0.13 0.32 0.07 -0.44 -2.27 0.00 0.00 179.45 177.26 1nl3 h ASP 670 N 0.50 0.40 0.16 4.20 3.32 -2.00 -1.18 116.42 121.83 1nl3 h ASP 670 Ca 0.37 -0.23 -0.24 0.00 0.02 0.00 0.00 57.03 56.95 1nl3 h ASP 670 Cb 0.73 -0.10 0.01 0.00 0.22 0.00 0.00 39.33 40.19 1nl3 h ASP 670 CO -0.13 0.52 -0.96 0.06 -1.72 0.00 0.00 179.24 177.01 1nl3 h GLN 671 N 0.25 0.56 -0.37 3.56 -0.00 -1.65 -0.54 115.11 116.93 1nl3 h GLN 671 Ca 0.08 -0.58 0.06 0.00 -0.00 0.00 0.00 58.65 58.21 1nl3 h GLN 671 Cb 0.28 0.16 -0.06 0.00 -0.00 0.00 0.00 27.48 27.86 1nl3 h GLN 671 CO 0.00 1.20 0.02 0.00 -0.00 0.00 0.00 178.83 180.05 1nl3 h ALA 672 N 0.60 0.35 -0.16 0.06 0.00 -0.24 0.80 119.26 120.66 1nl3 h ALA 672 Ca -0.10 0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1nl3 h ALA 672 Cb 1.60 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.54 1nl3 h ALA 672 CO 0.18 -0.38 -0.49 -0.07 0.00 0.00 0.00 179.25 178.49 1nl3 h LEU 673 N 0.12 0.45 -1.01 0.00 3.38 -1.22 -2.34 115.31 114.69 1nl3 h LEU 673 Ca 0.18 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.94 1nl3 h LEU 673 Cb 0.24 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 1nl3 h LEU 673 CO -0.28 0.87 0.66 -0.78 0.09 0.00 0.00 178.44 178.99 1nl3 h ASP 674 N 0.33 1.15 -0.02 -0.43 3.58 -0.22 0.37 116.42 121.17 1nl3 h ASP 674 Ca 0.02 -0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.43 1nl3 h ASP 674 Cb 0.98 -0.29 -0.00 0.00 1.72 0.00 0.00 39.33 41.74 1nl3 h ASP 674 CO 0.09 0.84 0.01 0.24 -2.88 0.00 0.00 179.24 177.53 1nl3 h MET 675 N 1.36 0.03 -0.42 0.28 2.86 -0.70 0.70 114.93 119.03 1nl3 h MET 675 Ca 0.37 -0.01 0.09 0.00 -2.06 0.00 0.00 59.70 58.09 1nl3 h MET 675 Cb -0.15 -0.01 -0.09 0.00 0.06 0.00 0.00 31.60 31.41 1nl3 h MET 675 CO -0.08 0.20 -0.20 0.28 1.06 0.00 0.00 176.91 178.17 1nl3 h VAL 676 N -0.14 0.41 0.14 -2.22 2.07 -1.15 0.58 116.25 115.94 1nl3 h VAL 676 Ca 0.01 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.54 1nl3 h VAL 676 Cb 0.18 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 1nl3 h VAL 676 CO -0.00 0.00 -0.25 -0.09 0.02 0.00 0.00 177.57 177.25 1nl3 h ARG 677 N -0.11 -0.44 -0.33 1.57 2.43 -0.70 -1.13 114.38 115.67 1nl3 h ARG 677 Ca 0.21 0.03 0.06 0.00 -0.81 0.00 0.00 59.98 59.47 1nl3 h ARG 677 Cb 0.43 0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 30.03 1nl3 h ARG 677 CO -0.50 -0.30 -0.03 0.22 -1.51 0.00 0.00 179.97 177.85 1nl3 h ASP 678 N -0.46 -0.20 -0.26 -3.80 -0.00 0.11 -0.20 116.42 111.62 1nl3 h ASP 678 Ca 0.02 0.08 -0.02 0.00 -0.00 0.00 0.00 57.03 57.12 1nl3 h ASP 678 Cb 0.47 0.16 -0.01 0.00 -0.00 0.00 0.00 39.33 39.96 1nl3 h ASP 678 CO -0.13 -0.06 0.09 0.58 -0.00 0.00 0.00 179.24 179.72 1nl3 h VAL 679 N 0.05 1.19 -0.60 2.25 2.07 0.26 -0.41 116.25 121.06 1nl3 h VAL 679 Ca 0.16 -0.59 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 1nl3 h VAL 679 Cb 0.23 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 1nl3 h VAL 679 CO -0.30 0.19 0.36 0.40 0.02 0.00 0.00 177.57 178.24 1nl3 h ILE 680 N 0.25 1.18 -0.74 4.57 2.04 -1.07 -2.20 117.51 121.54 1nl3 h ILE 680 Ca 0.08 -0.42 -0.03 0.00 1.00 0.00 0.00 64.86 65.49 1nl3 h ILE 680 Cb 0.22 0.37 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 1nl3 h ILE 680 CO -0.00 0.19 0.34 0.74 0.00 0.00 0.00 178.15 179.42 1nl3 h THR 681 N 0.82 1.24 -0.35 -0.27 2.02 -0.78 -1.13 112.91 114.45 1nl3 h THR 681 Ca 0.22 -0.69 -0.08 0.00 0.77 0.00 0.00 66.41 66.62 1nl3 h THR 681 Cb -0.00 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 66.69 1nl3 h THR 681 CO -0.04 0.29 -0.13 0.00 0.37 0.00 0.00 175.52 176.01 1nl3 h ALA 682 N 1.31 1.12 -0.03 6.16 0.00 -0.89 -1.96 119.26 124.98 1nl3 h ALA 682 Ca 0.26 -0.30 -0.26 0.00 0.00 0.00 0.00 54.91 54.61 1nl3 h ALA 682 Cb 0.13 -0.15 0.02 0.00 0.00 0.00 0.00 17.79 17.79 1nl3 h ALA 682 CO -0.03 0.55 -0.98 1.88 0.00 0.00 0.00 179.25 180.67 1nl3 h TYR 683 N 0.56 1.04 -0.54 0.00 0.05 -0.72 -2.36 116.97 114.99 1nl3 h TYR 683 Ca 0.10 -0.55 -0.04 0.00 0.05 0.00 0.00 58.73 58.29 1nl3 h TYR 683 Cb 0.55 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 38.14 1nl3 h TYR 683 CO 0.02 1.38 0.20 0.28 -1.05 0.00 0.00 178.16 179.00 1nl3 h VAL 684 N 0.41 1.23 -0.40 -2.88 2.07 -1.28 -2.01 116.25 113.38 1nl3 h VAL 684 Ca -0.11 -0.73 0.07 0.00 0.82 0.00 0.00 66.70 66.75 1nl3 h VAL 684 Cb 1.63 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 32.06 1nl3 h VAL 684 CO 0.19 0.27 0.27 -0.78 0.02 0.00 0.00 177.57 177.55 1nl3 h ASP 685 N 0.75 0.22 0.17 0.57 -0.00 -1.25 -2.24 116.42 114.63 1nl3 h ASP 685 Ca 0.18 0.00 -0.35 0.00 -0.00 0.00 0.00 57.03 56.86 1nl3 h ASP 685 Cb 0.23 -0.05 0.00 0.00 -0.00 0.00 0.00 39.33 39.51 1nl3 h ASP 685 CO -0.01 0.14 -1.77 1.23 -0.00 0.00 0.00 179.24 178.84 1nl3 h GLY 686 N 0.25 0.40 1.73 -0.78 0.00 -1.20 -3.01 103.07 100.46 1nl3 h GLY 686 Ca 0.18 -1.02 0.00 0.00 0.00 0.00 0.00 47.33 46.48 1nl3 h GLY 686 CO -0.03 0.90 -0.17 0.00 0.00 0.00 0.00 176.54 177.23 1nl3 n ALA 687 N -2.91 2.56 -0.09 3.60 0.00 -0.78 -4.11 120.51 118.79 1nl3 n ALA 687 Ca -0.26 -0.13 -0.15 0.00 0.00 0.00 0.00 53.44 52.90 1nl3 n ALA 687 Cb 1.05 -1.38 -0.08 0.00 0.00 0.00 0.00 19.45 19.04 1nl3 n ALA 687 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1nl3 n THR 688 N -1.90 1.02 0.00 0.00 -1.04 -0.85 -3.79 114.28 107.72 1nl3 n THR 688 Ca 0.06 -0.35 0.00 0.00 -2.04 0.00 0.00 64.05 61.72 1nl3 n THR 688 Cb 0.39 -1.32 0.00 0.00 -1.82 0.00 0.00 70.33 67.58 1nl3 n THR 688 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1nl3 n GLY 689 N 2.39 0.94 0.00 3.41 0.00 -1.14 -3.01 105.19 107.79 1nl3 n GLY 689 Ca -0.33 0.58 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1nl3 n GLY 689 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nl3 n GLU 690 N 0.00 0.32 -1.74 1.61 4.71 -1.26 -5.03 120.64 119.25 1nl3 n GLU 690 Ca 0.00 -0.01 -0.42 0.00 -0.01 0.00 0.00 57.16 56.72 1nl3 n GLU 690 Cb 0.00 -0.21 -0.00 0.00 -1.01 0.00 0.00 31.44 30.22 1nl3 n GLU 690 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1nl3 n GLY 691 N 0.05 0.90 0.00 0.62 0.00 -1.16 -5.01 105.19 100.59 1nl3 n GLY 691 Ca 0.00 0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.34 1nl3 n GLY 691 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1nl3 n TYR 692 N 0.44 0.00 0.00 1.61 4.02 -1.26 -4.83 117.16 117.13 1nl3 n TYR 692 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.92 1nl3 n TYR 692 Cb 0.37 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.69 1nl3 n TYR 692 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1nl3 n ALA 693 N -3.00 0.00 -0.08 -0.72 0.00 -1.26 -4.76 120.51 110.69 1nl3 n ALA 693 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1nl3 n ALA 693 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1nl3 n ALA 693 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1nl3 n GLU 694 N 0.00 -0.08 0.00 0.00 1.02 -1.26 -3.51 120.64 116.81 1nl3 n GLU 694 Ca 0.00 0.29 0.00 0.00 -0.02 0.00 0.00 57.16 57.43 1nl3 n GLU 694 Cb 0.00 -0.42 0.00 0.00 -0.02 0.00 0.00 31.44 31.00 1nl3 n GLU 694 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1nl3 n ASP 695 N -4.09 0.00 -4.71 1.62 9.92 -1.26 -4.62 116.55 113.40 1nl3 n ASP 695 Ca 0.00 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 53.84 1nl3 n ASP 695 Cb 0.05 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.50 1nl3 n ASP 695 CO 0.00 0.00 0.00 0.26 0.13 0.00 0.00 177.20 177.59 1nl3 s TRP 696 N 0.00 3.23 -0.96 1.24 0.51 -1.23 -4.96 118.94 116.77 1nl3 s TRP 696 Ca 0.00 0.98 -0.22 0.00 -2.12 0.00 0.00 56.10 54.74 1nl3 s TRP 696 Cb 0.00 -3.65 0.07 0.00 -0.81 0.00 0.00 33.47 29.08 1nl3 s TRP 696 CO 0.00 -2.27 1.32 0.34 -0.51 0.00 0.00 176.95 175.83 1nl3 s ASP 697 N 1.18 6.50 0.19 2.95 -1.08 -1.25 -4.82 116.67 120.34 1nl3 s ASP 697 Ca 0.64 -1.55 0.10 0.00 -0.52 0.00 0.00 52.55 51.22 1nl3 s ASP 697 Cb -0.35 -2.51 -0.05 0.00 -1.46 0.00 0.00 42.92 38.55 1nl3 s ASP 697 CO 0.30 -1.39 1.37 -0.07 0.52 0.00 0.00 175.17 175.90 1nl3 h LEU 698 N 12.00 0.00 -0.17 -1.34 -0.00 -1.92 -2.58 115.31 121.30 1nl3 h LEU 698 Ca 0.13 0.00 -0.08 0.00 -0.00 0.00 0.00 57.88 57.93 1nl3 h LEU 698 Cb 1.02 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.68 1nl3 h LEU 698 CO 1.31 0.78 -0.21 0.44 -0.00 0.00 0.00 178.44 180.76 1nl3 h ASP 699 N 0.00 0.48 -0.71 -0.43 3.32 -1.98 0.38 116.42 117.49 1nl3 h ASP 699 Ca -0.01 -0.50 -0.05 0.00 0.02 0.00 0.00 57.03 56.50 1nl3 h ASP 699 Cb 1.57 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 40.95 1nl3 h ASP 699 CO 0.10 0.89 0.26 0.00 -1.72 0.00 0.00 179.24 178.77 1nl3 h ALA 700 N 0.61 0.92 -0.45 3.45 0.00 -1.98 -1.17 119.26 120.64 1nl3 h ALA 700 Ca 0.02 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 1nl3 h ALA 700 Cb 0.76 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1nl3 h ALA 700 CO 0.05 0.56 -0.17 1.25 0.00 0.00 0.00 179.25 180.94 1nl3 h LEU 701 N 1.02 0.93 -0.21 0.00 5.85 -1.36 -1.73 115.31 119.81 1nl3 h LEU 701 Ca 0.23 -0.39 -0.02 0.00 0.84 0.00 0.00 57.88 58.54 1nl3 h LEU 701 Cb 0.24 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 1nl3 h LEU 701 CO -0.02 1.11 0.04 -0.50 -0.34 0.00 0.00 178.44 178.73 1nl3 h TRP 702 N 0.75 0.36 -0.58 1.25 6.55 -0.13 -1.34 115.95 122.81 1nl3 h TRP 702 Ca 0.11 -0.05 -0.05 0.00 0.95 0.00 0.00 58.89 59.85 1nl3 h TRP 702 Cb 0.74 -0.10 -0.02 0.00 -0.86 0.00 0.00 29.16 28.91 1nl3 h TRP 702 CO 0.05 0.47 0.19 1.79 -1.05 0.00 0.00 178.44 179.89 1nl3 h THR 703 N 0.15 1.24 -0.32 1.49 1.35 -1.20 0.12 112.91 115.74 1nl3 h THR 703 Ca 0.07 -0.81 -0.06 0.00 -0.55 0.00 0.00 66.41 65.06 1nl3 h THR 703 Cb 0.30 0.66 -0.02 0.00 -1.73 0.00 0.00 68.15 67.36 1nl3 h THR 703 CO 0.00 0.30 -0.05 0.00 -0.25 0.00 0.00 175.52 175.52 1nl3 h ALA 704 N 1.05 1.31 -0.13 6.62 0.00 -1.26 -2.77 119.26 124.08 1nl3 h ALA 704 Ca 0.19 -0.23 -0.20 0.00 0.00 0.00 0.00 54.91 54.67 1nl3 h ALA 704 Cb 0.28 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.93 1nl3 h ALA 704 CO -0.01 0.47 -0.69 -0.07 0.00 0.00 0.00 179.25 178.95 1nl3 h LEU 705 N 0.49 0.84 -2.47 0.00 4.07 -0.92 -3.29 115.31 114.03 1nl3 h LEU 705 Ca 0.10 -0.64 -0.01 0.00 0.08 0.00 0.00 57.88 57.42 1nl3 h LEU 705 Cb 0.40 -0.25 -0.00 0.00 1.08 0.00 0.00 40.66 41.90 1nl3 h LEU 705 CO 0.02 1.34 -0.02 0.11 -1.08 0.00 0.00 178.44 178.80 1nl3 h LYS 706 N 0.39 0.00 0.41 1.13 1.57 -0.51 -1.01 116.57 118.55 1nl3 h LYS 706 Ca -0.05 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1nl3 h LYS 706 Cb 1.32 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.62 1nl3 h LYS 706 CO 0.14 0.02 -0.34 1.79 -0.57 0.00 0.00 179.45 180.50 1nl3 h THR 707 N 0.00 0.31 -0.39 -0.16 1.35 -1.57 -3.30 112.91 109.16 1nl3 h THR 707 Ca -0.00 0.00 -0.15 0.00 -0.55 0.00 0.00 66.41 65.71 1nl3 h THR 707 Cb 0.13 0.31 -0.01 0.00 -1.73 0.00 0.00 68.15 66.85 1nl3 h THR 707 CO 0.00 0.00 -0.36 -0.07 -0.25 0.00 0.00 175.52 174.84 1nl3 h LEU 708 N -0.75 0.96 -7.36 3.87 3.38 -1.37 -3.47 115.31 110.58 1nl3 h LEU 708 Ca -0.04 -0.43 -0.09 0.00 0.09 0.00 0.00 57.88 57.42 1nl3 h LEU 708 Cb 0.65 -0.27 -0.18 0.00 0.09 0.00 0.00 40.66 40.95 1nl3 h LEU 708 CO -0.02 1.22 -0.12 -0.72 0.09 0.00 0.00 178.44 178.89 1nl3 s TYR 709 N -4.43 -0.30 -1.21 1.13 1.13 -0.97 -4.40 117.35 108.30 1nl3 s TYR 709 Ca -0.11 0.40 -0.22 0.00 -1.41 0.00 0.00 57.07 55.73 1nl3 s TYR 709 Cb 0.11 0.20 -0.07 0.00 -1.10 0.00 0.00 41.96 41.11 1nl3 s TYR 709 CO 0.87 -0.51 1.91 -0.35 -2.51 0.00 0.00 175.55 174.96 1nl3 n PRO 710 N 0.87 1.83 -1.60 -3.49 -0.04 -1.26 -4.23 135.00 127.09 1nl3 n PRO 710 Ca -0.20 -2.59 -0.50 0.00 -0.04 0.00 0.00 63.50 60.17 1nl3 n PRO 710 Cb 0.58 -3.70 -0.06 0.00 -0.04 0.00 0.00 33.50 30.28 1nl3 n PRO 710 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1nl3 n VAL 711 N 7.60 0.38 0.19 0.52 0.31 -1.26 -4.89 118.33 121.18 1nl3 n VAL 711 Ca 0.45 -0.18 0.05 0.00 -0.01 0.00 0.00 64.34 64.65 1nl3 n VAL 711 Cb 0.46 -1.74 0.21 0.00 -0.91 0.00 0.00 33.84 31.86 1nl3 n VAL 711 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1nl3 n GLY 712 N 5.22 1.90 3.18 2.92 0.00 -1.26 -4.89 105.19 112.26 1nl3 n GLY 712 Ca 0.30 -0.48 -0.09 0.00 0.00 0.00 0.00 46.02 45.75 1nl3 n GLY 712 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1nl3 s ILE 713 N -1.82 0.14 0.35 -0.61 -5.25 -1.26 -5.13 121.20 107.62 1nl3 s ILE 713 Ca 0.29 -1.16 0.02 0.00 -0.99 0.00 0.00 60.65 58.81 1nl3 s ILE 713 Cb 0.20 -1.20 -0.02 0.00 2.95 0.00 0.00 42.46 44.38 1nl3 s ILE 713 CO 0.11 -0.64 0.53 0.42 -1.79 0.00 0.00 174.94 173.57 1nl3 s THR 714 N -3.42 4.80 0.27 8.37 -4.23 -1.26 -4.97 115.64 115.20 1nl3 s THR 714 Ca 0.02 -0.62 -0.02 0.00 -1.18 0.00 0.00 61.69 59.88 1nl3 s THR 714 Cb 0.03 -3.74 0.14 0.00 1.34 0.00 0.00 72.50 70.28 1nl3 s THR 714 CO -0.08 -0.43 1.80 0.00 -0.54 0.00 0.00 174.62 175.36 1nl3 h ALA 715 N 0.77 1.16 -0.73 3.99 0.00 -1.99 -1.83 119.26 120.63 1nl3 h ALA 715 Ca -0.49 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.15 1nl3 h ALA 715 Cb 1.23 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 1nl3 h ALA 715 CO 0.60 0.57 0.24 -0.44 0.00 0.00 0.00 179.25 180.21 1nl3 h ASP 716 N 0.83 1.05 -0.10 0.00 3.45 -1.98 -3.22 116.42 116.45 1nl3 h ASP 716 Ca 0.18 -0.19 0.01 0.00 0.43 0.00 0.00 57.03 57.47 1nl3 h ASP 716 Cb 0.33 -0.27 -0.02 0.00 -0.56 0.00 0.00 39.33 38.81 1nl3 h ASP 716 CO 0.00 0.97 -0.04 -0.24 -1.57 0.00 0.00 179.24 178.36 1nl3 n SER 717 N -4.26 -0.07 -2.93 6.45 2.88 -0.69 -1.42 113.62 113.59 1nl3 n SER 717 Ca 0.06 0.17 -0.23 0.00 -1.33 0.00 0.00 58.87 57.54 1nl3 n SER 717 Cb 0.22 -0.04 -0.03 0.00 -0.75 0.00 0.00 64.21 63.61 1nl3 n SER 717 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1nl3 n LEU 718 N -4.14 3.27 -3.48 2.46 -0.00 -1.21 -5.01 117.00 108.89 1nl3 n LEU 718 Ca 0.01 -5.29 -0.17 0.00 -0.00 0.00 0.00 56.01 50.56 1nl3 n LEU 718 Cb 0.04 -0.11 -0.12 0.00 -0.00 0.00 0.00 43.42 43.22 1nl3 n LEU 718 CO -0.01 2.26 -0.19 -0.89 -0.00 0.00 0.00 177.39 178.56 1nl3 s THR 719 N -3.95 -0.35 -0.55 1.47 2.01 -0.51 -5.10 115.64 108.67 1nl3 s THR 719 Ca 0.45 -0.12 0.00 0.00 0.31 0.00 0.00 61.69 62.32 1nl3 s THR 719 Cb 0.33 -0.70 0.00 0.00 0.01 0.00 0.00 72.50 72.14 1nl3 s THR 719 CO -0.12 -0.21 0.00 1.21 -0.69 0.00 0.00 174.62 174.82 1nl3 n GLU 733 N 5.32 0.00 0.00 4.92 0.00 -1.26 -5.09 120.64 124.53 1nl3 n GLU 733 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.11 1nl3 n GLU 733 Cb 0.49 -0.81 0.00 0.00 0.00 0.00 0.00 31.44 31.12 1nl3 n GLU 733 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1nl3 n GLU 734 N 0.05 0.00 0.04 5.31 4.07 -1.26 -2.97 120.64 125.88 1nl3 n GLU 734 Ca 0.00 0.00 -0.04 0.00 -0.06 0.00 0.00 57.16 57.06 1nl3 n GLU 734 Cb 0.00 -0.09 0.17 0.00 -0.06 0.00 0.00 31.44 31.46 1nl3 n GLU 734 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 1nl3 h LEU 735 N 0.00 0.43 0.09 4.31 5.85 -1.99 -2.79 115.31 121.19 1nl3 h LEU 735 Ca 0.00 -0.18 -0.14 0.00 0.84 0.00 0.00 57.88 58.40 1nl3 h LEU 735 Cb 0.00 -0.12 0.02 0.00 0.37 0.00 0.00 40.66 40.93 1nl3 h LEU 735 CO 0.00 0.78 -0.60 0.25 -0.34 0.00 0.00 178.44 178.53 1nl3 h LEU 736 N 0.34 0.38 -1.89 2.25 5.85 -1.97 -2.79 115.31 117.48 1nl3 h LEU 736 Ca 0.03 -0.92 0.03 0.00 0.84 0.00 0.00 57.88 57.86 1nl3 h LEU 736 Cb 0.84 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 1nl3 h LEU 736 CO 0.07 1.27 0.14 -0.08 -0.34 0.00 0.00 178.44 179.50 1nl3 h GLU 737 N -0.44 0.15 0.34 1.25 4.22 -1.82 -0.98 114.58 117.30 1nl3 h GLU 737 Ca -0.10 -0.01 -0.02 0.00 0.08 0.00 0.00 59.36 59.31 1nl3 h GLU 737 Cb 1.44 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.66 1nl3 h GLU 737 CO 0.11 0.10 -0.17 0.00 -2.18 0.00 0.00 179.01 176.88 1nl3 h ALA 738 N 1.89 -0.46 -0.54 2.92 0.00 -1.54 -3.16 119.26 118.37 1nl3 h ALA 738 Ca 0.09 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1nl3 h ALA 738 Cb 0.17 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1nl3 h ALA 738 CO -0.01 -0.58 0.05 -0.07 0.00 0.00 0.00 179.25 178.63 1nl3 h LEU 739 N -0.82 0.89 -0.35 0.00 3.38 -1.16 -2.53 115.31 114.72 1nl3 h LEU 739 Ca -0.05 -0.28 0.08 0.00 0.09 0.00 0.00 57.88 57.72 1nl3 h LEU 739 Cb 0.52 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.96 1nl3 h LEU 739 CO 0.08 0.95 -0.20 -0.07 0.09 0.00 0.00 178.44 179.29 1nl3 h LEU 740 N 0.80 -0.67 -1.12 1.67 4.07 -1.33 0.10 115.31 118.83 1nl3 h LEU 740 Ca 0.16 0.15 -0.02 0.00 0.08 0.00 0.00 57.88 58.24 1nl3 h LEU 740 Cb 0.47 0.35 -0.03 0.00 1.08 0.00 0.00 40.66 42.52 1nl3 h LEU 740 CO 0.02 -0.23 0.36 0.50 -1.08 0.00 0.00 178.44 178.00 1nl3 h LYS 741 N -0.15 0.97 -0.19 1.13 1.63 -1.47 -0.16 116.57 118.33 1nl3 h LYS 741 Ca 0.18 -0.12 -0.03 0.00 -0.85 0.00 0.00 60.65 59.83 1nl3 h LYS 741 Cb 0.42 -0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 31.85 1nl3 h LYS 741 CO -0.44 0.73 0.02 0.22 -3.45 0.00 0.00 179.45 176.53 1nl3 h ASP 742 N 0.98 0.31 -0.75 4.20 3.58 -1.10 -3.07 116.42 120.56 1nl3 h ASP 742 Ca 0.24 -0.28 -0.01 0.00 0.42 0.00 0.00 57.03 57.41 1nl3 h ASP 742 Cb 0.06 -0.08 -0.04 0.00 1.72 0.00 0.00 39.33 40.99 1nl3 h ASP 742 CO -0.04 0.51 0.44 0.00 -2.88 0.00 0.00 179.24 177.27 1nl3 h ALA 743 N 0.81 1.34 -0.58 -0.78 0.00 -0.24 -1.01 119.26 118.80 1nl3 h ALA 743 Ca 0.06 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1nl3 h ALA 743 Cb 0.34 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1nl3 h ALA 743 CO 0.01 0.55 0.06 0.93 0.00 0.00 0.00 179.25 180.80 1nl3 h GLU 744 N 1.05 0.96 -0.01 0.00 5.08 -1.04 -0.46 114.58 120.16 1nl3 h GLU 744 Ca 0.27 -0.26 -0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1nl3 h GLU 744 Cb -0.01 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.13 1nl3 h GLU 744 CO -0.05 0.91 -0.01 -0.09 -1.00 0.00 0.00 179.01 178.78 1nl3 h ARG 745 N 0.90 0.01 -1.00 2.33 2.43 -1.30 -1.46 114.38 116.29 1nl3 h ARG 745 Ca 0.18 -0.01 0.30 0.00 -0.81 0.00 0.00 59.98 59.64 1nl3 h ARG 745 Cb 0.44 0.00 -0.14 0.00 -0.42 0.00 0.00 29.97 29.85 1nl3 h ARG 745 CO 0.02 0.52 0.57 0.00 -1.51 0.00 0.00 179.97 179.56 1nl3 h ALA 746 N 0.50 1.91 0.48 2.80 0.00 -1.11 0.22 119.26 124.06 1nl3 h ALA 746 Ca 0.00 0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1nl3 h ALA 746 Cb 0.51 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1nl3 h ALA 746 CO 0.00 -0.50 -0.23 -0.92 0.00 0.00 0.00 179.25 177.61 1nl3 h TYR 747 N 0.39 -0.60 0.00 0.00 5.03 -0.61 -1.36 116.97 119.82 1nl3 h TYR 747 Ca 0.71 -0.01 -0.00 0.00 2.58 0.00 0.00 58.73 62.01 1nl3 h TYR 747 Cb 1.56 0.20 -0.00 0.00 1.55 0.00 0.00 36.73 40.04 1nl3 h TYR 747 CO -0.01 -0.28 -0.00 0.00 -1.32 0.00 0.00 178.16 176.55 1nl3 h ALA 748 N -0.53 1.82 0.18 1.82 0.00 -0.31 0.27 119.26 122.50 1nl3 h ALA 748 Ca -0.07 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1nl3 h ALA 748 Cb 0.59 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1nl3 h ALA 748 CO 0.11 0.00 -0.09 0.00 0.00 0.00 0.00 179.25 179.27 1nl3 h ALA 749 N 2.00 -0.25 -0.61 0.00 0.00 -0.54 -2.31 119.26 117.57 1nl3 h ALA 749 Ca -0.00 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 54.83 1nl3 h ALA 749 Cb 0.00 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 1nl3 h ALA 749 CO 0.00 -0.54 0.33 -0.09 0.00 0.00 0.00 179.25 178.95 1nl3 h ARG 750 N -0.45 0.61 -0.54 0.00 1.12 0.24 -0.41 114.38 114.97 1nl3 h ARG 750 Ca -0.03 -0.04 0.07 0.00 -1.11 0.00 0.00 59.98 58.87 1nl3 h ARG 750 Cb 0.34 -0.14 -0.06 0.00 -0.01 0.00 0.00 29.97 30.11 1nl3 h ARG 750 CO 0.04 0.40 0.22 1.49 -3.11 0.00 0.00 179.97 179.02 1nl3 h GLU 751 N 0.63 0.41 0.00 0.20 4.81 -0.52 -0.48 114.58 119.63 1nl3 h GLU 751 Ca 0.27 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.40 1nl3 h GLU 751 Cb 0.15 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1nl3 h GLU 751 CO -0.16 0.27 -0.35 0.00 -0.73 0.00 0.00 179.01 178.04 1nl3 h ALA 752 N 1.34 1.03 -0.34 2.92 0.00 -0.95 -1.52 119.26 121.73 1nl3 h ALA 752 Ca 0.25 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1nl3 h ALA 752 Cb 0.25 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1nl3 h ALA 752 CO -0.23 0.44 -0.00 1.49 0.00 0.00 0.00 179.25 180.95 1nl3 h GLU 753 N 0.00 0.53 -0.05 0.00 4.81 0.47 -2.18 114.58 118.16 1nl3 h GLU 753 Ca -0.00 -0.11 -0.17 0.00 -0.13 0.00 0.00 59.36 58.94 1nl3 h GLU 753 Cb 0.85 -0.08 0.01 0.00 0.63 0.00 0.00 28.75 30.16 1nl3 h GLU 753 CO 0.05 0.56 -0.62 -0.07 -0.73 0.00 0.00 179.01 178.19 1nl3 h LEU 754 N 0.51 0.63 -1.20 1.64 4.07 -0.69 -2.67 115.31 117.60 1nl3 h LEU 754 Ca 0.11 -0.71 0.30 0.00 0.08 0.00 0.00 57.88 57.67 1nl3 h LEU 754 Cb 0.33 -0.19 -0.12 0.00 1.08 0.00 0.00 40.66 41.76 1nl3 h LEU 754 CO 0.01 1.24 0.66 -0.33 -1.08 0.00 0.00 178.44 178.94 1nl3 h GLU 755 N 0.07 0.35 0.00 1.13 4.39 -1.17 0.27 114.58 119.63 1nl3 h GLU 755 Ca -0.06 -0.02 -0.17 0.00 0.34 0.00 0.00 59.36 59.44 1nl3 h GLU 755 Cb 1.30 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.84 1nl3 h GLU 755 CO 0.12 0.23 -0.83 1.49 -1.16 0.00 0.00 179.01 178.87 1nl3 h GLU 756 N 0.36 0.00 0.22 2.33 4.81 -1.33 -1.97 114.58 119.01 1nl3 h GLU 756 Ca 0.68 -0.00 -0.34 0.00 -0.13 0.00 0.00 59.36 59.57 1nl3 h GLU 756 Cb 1.67 0.00 0.03 0.00 0.63 0.00 0.00 28.75 31.07 1nl3 h GLU 756 CO -0.44 0.83 -1.58 0.82 -0.73 0.00 0.00 179.01 177.91 1nl3 h ILE 757 N 0.00 1.16 0.00 2.32 2.04 -0.22 -3.44 117.51 119.37 1nl3 h ILE 757 Ca -0.01 -2.65 -0.09 0.00 1.00 0.00 0.00 64.86 63.10 1nl3 h ILE 757 Cb 1.46 2.93 -0.12 0.00 -0.74 0.00 0.00 36.82 40.35 1nl3 h ILE 757 CO 0.11 0.83 -0.03 0.00 0.00 0.00 0.00 178.15 179.06 1nl3 n ALA 758 N -2.76 -3.20 -2.82 1.87 0.00 0.20 -5.10 120.51 108.69 1nl3 n ALA 758 Ca -0.19 -0.44 -0.13 0.00 0.00 0.00 0.00 53.44 52.67 1nl3 n ALA 758 Cb 1.09 -3.02 0.05 0.00 0.00 0.00 0.00 19.45 17.57 1nl3 n ALA 758 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nl3 n GLY 759 N 1.11 1.51 0.30 0.00 0.00 -0.74 -4.42 105.19 102.95 1nl3 n GLY 759 Ca -0.01 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.90 1nl3 n GLY 759 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1nl3 n GLU 760 N -1.80 0.00 -0.02 1.61 2.13 -1.26 -4.71 120.64 116.59 1nl3 n GLU 760 Ca 0.09 0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.92 1nl3 n GLU 760 Cb 0.33 -0.30 0.00 0.00 0.27 0.00 0.00 31.44 31.73 1nl3 n GLU 760 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1nl3 n GLY 761 N -0.29 0.85 0.34 8.31 0.00 -1.26 -4.99 105.19 108.15 1nl3 n GLY 761 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1nl3 n GLY 761 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nl3 h ALA 762 N 0.00 1.22 0.00 4.61 0.00 -1.84 -0.83 119.26 122.41 1nl3 h ALA 762 Ca 0.00 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 1nl3 h ALA 762 Cb 0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1nl3 h ALA 762 CO 0.00 0.38 -0.32 1.98 0.00 0.00 0.00 179.25 181.29 1nl3 h MET 763 N 1.08 0.00 -0.32 0.00 -1.53 -1.91 0.23 114.93 112.48 1nl3 h MET 763 Ca 0.38 0.00 -0.06 0.00 -3.44 0.00 0.00 59.70 56.58 1nl3 h MET 763 Cb 0.10 0.00 -0.01 0.00 -0.55 0.00 0.00 31.60 31.14 1nl3 h MET 763 CO -0.15 0.32 -0.03 0.00 0.14 0.00 0.00 176.91 177.19 1nl3 h ARG 764 N 0.00 0.58 0.11 0.39 -0.00 -1.61 -2.17 114.38 111.68 1nl3 h ARG 764 Ca -0.00 -0.20 -0.01 0.00 -0.50 0.00 0.00 59.98 59.27 1nl3 h ARG 764 Cb 0.79 -0.05 0.00 0.00 0.00 0.00 0.00 29.97 30.72 1nl3 h ARG 764 CO 0.04 0.73 -0.05 0.37 0.00 0.00 0.00 179.97 181.06 1nl3 h GLN 765 N 0.37 -0.14 -1.02 0.04 5.75 -0.98 -3.05 115.11 116.08 1nl3 h GLN 765 Ca 0.09 0.01 0.27 0.00 -0.15 0.00 0.00 58.65 58.87 1nl3 h GLN 765 Cb 0.49 0.03 -0.13 0.00 1.07 0.00 0.00 27.48 28.94 1nl3 h GLN 765 CO 0.02 0.27 0.61 1.25 -2.65 0.00 0.00 178.83 178.33 1nl3 h LEU 766 N -0.60 0.59 0.07 -2.39 5.85 -0.60 0.19 115.31 118.42 1nl3 h LEU 766 Ca -0.01 0.14 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 1nl3 h LEU 766 Cb 0.48 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.56 1nl3 h LEU 766 CO 0.02 0.03 -0.05 -0.33 -0.34 0.00 0.00 178.44 177.78 1nl3 h GLU 767 N 0.47 -0.12 0.71 1.25 5.08 -1.39 -1.26 114.58 119.33 1nl3 h GLU 767 Ca 0.67 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 59.00 1nl3 h GLU 767 Cb 1.43 0.03 0.01 0.00 0.50 0.00 0.00 28.75 30.71 1nl3 h GLU 767 CO -0.48 -0.08 -0.34 0.00 -1.00 0.00 0.00 179.01 177.12 1nl3 h ARG 768 N -0.12 -0.91 -0.49 2.33 3.08 -0.85 -2.08 114.38 115.33 1nl3 h ARG 768 Ca -0.00 0.06 0.10 0.00 0.07 0.00 0.00 59.98 60.21 1nl3 h ARG 768 Cb 0.10 0.21 -0.10 0.00 0.08 0.00 0.00 29.97 30.26 1nl3 h ARG 768 CO 0.00 -0.59 -0.23 -0.91 -1.07 0.00 0.00 179.97 177.18 1nl3 h ASN 769 N -1.03 -0.79 -0.21 7.04 4.21 -0.74 -1.08 115.58 122.97 1nl3 h ASN 769 Ca -0.10 0.18 -0.04 0.00 1.21 0.00 0.00 56.30 57.56 1nl3 h ASN 769 Cb 0.75 0.43 -0.01 0.00 -1.12 0.00 0.00 38.32 38.37 1nl3 h ASN 769 CO 0.16 -0.25 -0.02 0.58 -1.29 0.00 0.00 177.43 176.61 1nl3 h VAL 770 N -0.12 1.27 0.28 2.81 2.07 -1.27 -2.84 116.25 118.45 1nl3 h VAL 770 Ca 0.23 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.82 1nl3 h VAL 770 Cb 0.48 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.68 1nl3 h VAL 770 CO -0.57 0.29 -0.42 -0.07 0.02 0.00 0.00 177.57 176.82 1nl3 h LEU 771 N 0.13 -1.18 -0.06 2.57 3.38 -0.80 -0.98 115.31 118.37 1nl3 h LEU 771 Ca 0.06 0.11 0.03 0.00 0.09 0.00 0.00 57.88 58.17 1nl3 h LEU 771 Cb 0.44 0.42 -0.06 0.00 0.09 0.00 0.00 40.66 41.54 1nl3 h LEU 771 CO 0.01 -0.53 -0.48 0.25 0.09 0.00 0.00 178.44 177.78 1nl3 h LEU 772 N -0.76 -1.49 -0.58 1.67 5.85 -1.26 0.14 115.31 118.89 1nl3 h LEU 772 Ca -0.01 0.18 0.05 0.00 0.84 0.00 0.00 57.88 58.94 1nl3 h LEU 772 Cb 0.72 0.58 -0.07 0.00 0.37 0.00 0.00 40.66 42.26 1nl3 h LEU 772 CO -0.14 -0.48 -0.34 0.59 -0.34 0.00 0.00 178.44 177.73 1nl3 n ASN 773 N -5.45 -0.61 -0.06 1.25 4.13 -1.07 -1.17 115.26 112.28 1nl3 n ASN 773 Ca -0.06 1.29 -0.08 0.00 1.68 0.00 0.00 54.58 57.42 1nl3 n ASN 773 Cb 0.38 -0.27 -0.01 0.00 -1.54 0.00 0.00 39.78 38.34 1nl3 n ASN 773 CO 0.00 0.00 0.00 0.58 0.28 0.00 0.00 177.26 178.12 1nl3 h VAL 774 N 0.00 0.87 0.44 2.41 2.07 -0.04 -2.04 116.25 119.96 1nl3 h VAL 774 Ca 0.09 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 1nl3 h VAL 774 Cb 0.24 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 1nl3 h VAL 774 CO -0.54 0.02 -0.36 0.40 0.02 0.00 0.00 177.57 177.11 1nl3 h ILE 775 N 0.13 0.26 -0.34 4.57 2.04 0.09 -0.20 117.51 124.05 1nl3 h ILE 775 Ca 0.12 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.05 1nl3 h ILE 775 Cb 0.13 0.26 -0.07 0.00 -0.74 0.00 0.00 36.82 36.39 1nl3 h ILE 775 CO -0.17 0.00 -0.15 0.44 0.00 0.00 0.00 178.15 178.27 1nl3 h ASP 776 N -0.80 -0.51 -0.57 1.72 3.32 -1.03 0.22 116.42 118.76 1nl3 h ASP 776 Ca -0.04 0.13 -0.04 0.00 0.02 0.00 0.00 57.03 57.09 1nl3 h ASP 776 Cb 0.69 0.29 -0.03 0.00 0.22 0.00 0.00 39.33 40.50 1nl3 h ASP 776 CO -0.01 -0.18 0.22 -0.09 -1.72 0.00 0.00 179.24 177.45 1nl3 h ARG 777 N -0.09 0.90 -0.00 3.56 2.43 -1.12 0.03 114.38 120.09 1nl3 h ARG 777 Ca 0.17 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1nl3 h ARG 777 Cb 0.35 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 1nl3 h ARG 777 CO -0.40 0.76 -0.31 1.63 -1.51 0.00 0.00 179.97 180.14 1nl3 n LYS 778 N -4.30 0.23 -0.09 0.20 5.02 -0.11 -3.10 118.16 116.01 1nl3 n LYS 778 Ca 0.05 -0.11 -0.23 0.00 -2.02 0.00 0.00 58.31 56.00 1nl3 n LYS 778 Cb 0.18 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.58 1nl3 n LYS 778 CO 0.00 0.00 0.00 1.87 -0.52 0.00 0.00 177.40 178.75 1nl3 n TRP 779 N -1.29 0.67 -0.27 2.13 -0.00 0.02 -2.85 117.44 115.84 1nl3 n TRP 779 Ca 0.08 0.23 0.03 0.00 -0.00 0.00 0.00 57.50 57.84 1nl3 n TRP 779 Cb 0.33 -1.08 0.12 0.00 -0.00 0.00 0.00 31.31 30.68 1nl3 n TRP 779 CO 0.00 0.00 0.00 -0.09 -0.00 0.00 0.00 177.69 177.60 1nl3 h ARG 780 N -0.63 0.02 -0.10 5.87 2.43 -1.12 0.69 114.38 121.55 1nl3 h ARG 780 Ca -0.49 -0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 58.58 1nl3 h ARG 780 Cb 1.63 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.16 1nl3 h ARG 780 CO -0.18 0.01 -0.40 0.93 -1.51 0.00 0.00 179.97 178.82 1nl3 h GLU 781 N 0.02 0.22 -0.24 0.20 5.08 -1.67 -1.53 114.58 116.66 1nl3 h GLU 781 Ca 0.40 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.64 1nl3 h GLU 781 Cb 0.64 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 1nl3 h GLU 781 CO -0.78 0.58 0.07 1.25 -1.00 0.00 0.00 179.01 179.13 1nl3 h HIS 782 N 0.18 0.39 -0.71 4.33 2.76 -0.81 -2.03 115.15 119.25 1nl3 h HIS 782 Ca 0.02 -0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.11 1nl3 h HIS 782 Cb 0.79 -0.11 -0.03 0.00 1.55 0.00 0.00 27.41 29.60 1nl3 h HIS 782 CO 0.01 0.45 0.30 -0.07 -1.30 0.00 0.00 177.93 177.32 1nl3 h LEU 783 N 0.21 0.95 -0.98 0.26 3.38 -0.42 0.61 115.31 119.31 1nl3 h LEU 783 Ca 0.08 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.83 1nl3 h LEU 783 Cb 0.25 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1nl3 h LEU 783 CO -0.00 0.83 -0.21 0.22 0.09 0.00 0.00 178.44 179.38 1nl3 h TYR 784 N 1.02 0.55 0.15 1.13 3.20 -1.23 0.27 116.97 122.07 1nl3 h TYR 784 Ca 0.24 -0.10 -0.30 0.00 3.14 0.00 0.00 58.73 61.71 1nl3 h TYR 784 Cb 0.17 -0.14 0.01 0.00 1.54 0.00 0.00 36.73 38.31 1nl3 h TYR 784 CO 0.01 0.67 -1.40 0.93 -1.64 0.00 0.00 178.16 176.74 1nl3 h GLU 785 N 0.45 0.33 -0.73 1.82 4.39 -0.55 -3.22 114.58 117.07 1nl3 h GLU 785 Ca 0.07 -0.56 0.04 0.00 0.34 0.00 0.00 59.36 59.25 1nl3 h GLU 785 Cb 0.61 0.21 -0.04 0.00 -0.10 0.00 0.00 28.75 29.43 1nl3 h GLU 785 CO 0.04 1.24 0.48 0.52 -1.16 0.00 0.00 179.01 180.13 1nl3 h MET 786 N 0.09 0.85 0.06 2.33 2.86 0.35 -2.13 114.93 119.35 1nl3 h MET 786 Ca -0.20 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.41 1nl3 h MET 786 Cb 2.03 -0.19 -0.05 0.00 0.06 0.00 0.00 31.60 33.45 1nl3 h MET 786 CO 0.21 0.56 -0.46 -0.44 1.06 0.00 0.00 176.91 177.84 1nl3 h ASP 787 N 0.88 -1.40 0.09 1.22 3.32 -0.46 -2.18 116.42 117.89 1nl3 h ASP 787 Ca 0.29 0.16 -0.03 0.00 0.02 0.00 0.00 57.03 57.47 1nl3 h ASP 787 Cb 0.06 0.53 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 1nl3 h ASP 787 CO -0.08 -0.50 -0.11 1.88 -1.72 0.00 0.00 179.24 178.70 1nl3 h TYR 788 N -0.66 0.05 -0.33 4.55 0.05 -1.50 -2.67 116.97 116.47 1nl3 h TYR 788 Ca 0.02 -0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.69 1nl3 h TYR 788 Cb 0.70 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 38.42 1nl3 h TYR 788 CO -0.43 0.17 -0.20 1.25 -1.05 0.00 0.00 178.16 177.89 1nl3 h LEU 789 N 0.05 0.75 0.26 3.88 5.85 -0.98 -2.80 115.31 122.33 1nl3 h LEU 789 Ca 0.01 -0.43 -0.01 0.00 0.84 0.00 0.00 57.88 58.29 1nl3 h LEU 789 Cb 0.23 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.05 1nl3 h LEU 789 CO 0.01 1.02 -0.15 0.50 -0.34 0.00 0.00 178.44 179.48 1nl3 h LYS 790 N 0.49 -0.36 -0.88 1.25 3.64 -1.06 -0.96 116.57 118.70 1nl3 h LYS 790 Ca 0.07 0.02 0.26 0.00 -1.27 0.00 0.00 60.65 59.73 1nl3 h LYS 790 Cb 0.75 0.08 -0.16 0.00 -0.41 0.00 0.00 32.23 32.49 1nl3 h LYS 790 CO 0.06 -0.24 0.07 0.39 -2.27 0.00 0.00 179.45 177.45 1nl3 n GLU 791 N -3.14 -0.07 0.08 1.90 -0.58 -1.14 -1.60 120.64 116.09 1nl3 n GLU 791 Ca -0.05 1.31 -0.13 0.00 -0.42 0.00 0.00 57.16 57.87 1nl3 n GLU 791 Cb 0.15 -2.11 -0.13 0.00 -0.57 0.00 0.00 31.44 28.78 1nl3 n GLU 791 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1nl3 h GLY 792 N 0.00 0.20 -0.13 0.62 0.00 -1.45 -3.36 103.07 98.95 1nl3 h GLY 792 Ca 0.56 -0.52 0.30 0.00 0.00 0.00 0.00 47.33 47.68 1nl3 h GLY 792 CO -0.81 0.45 0.77 1.19 0.00 0.00 0.00 176.54 178.14 1nl3 h ILE 793 N 0.05 0.45 -0.34 2.60 6.09 -0.17 -1.19 117.51 125.00 1nl3 h ILE 793 Ca -0.12 0.00 0.07 0.00 -1.37 0.00 0.00 64.86 63.43 1nl3 h ILE 793 Cb 1.92 0.46 -0.08 0.00 0.47 0.00 0.00 36.82 39.59 1nl3 h ILE 793 CO 0.17 0.00 -0.38 1.23 -3.07 0.00 0.00 178.15 176.09 1nl3 h GLY 794 N 0.00 -0.47 1.63 8.18 0.00 -1.72 -3.02 103.07 107.68 1nl3 h GLY 794 Ca 0.50 0.49 -0.02 0.00 0.00 0.00 0.00 47.33 48.30 1nl3 h GLY 794 CO -0.01 -0.20 0.13 1.41 0.00 0.00 0.00 176.54 177.87 1nl3 h LEU 795 N -0.34 0.43 -5.30 3.11 3.38 -1.50 -3.14 115.31 111.95 1nl3 h LEU 795 Ca 0.14 -0.04 -0.67 0.00 0.09 0.00 0.00 57.88 57.40 1nl3 h LEU 795 Cb 0.57 -0.11 -0.12 0.00 0.09 0.00 0.00 40.66 41.09 1nl3 h LEU 795 CO -0.52 0.40 1.97 0.54 0.09 0.00 0.00 178.44 180.92 1nl3 n ARG 796 N -4.39 3.98 -3.86 1.13 1.74 -1.14 -4.84 116.66 109.27 1nl3 n ARG 796 Ca 0.02 -3.06 -0.29 0.00 -0.77 0.00 0.00 57.85 53.75 1nl3 n ARG 796 Cb 0.14 -2.51 -0.16 0.00 -1.02 0.00 0.00 32.46 28.91 1nl3 n ARG 796 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1nl3 s ALA 797 N -1.02 1.51 0.54 7.54 0.00 -1.19 -4.91 121.76 124.23 1nl3 s ALA 797 Ca 0.57 -0.98 -0.01 0.00 0.00 0.00 0.00 51.96 51.54 1nl3 s ALA 797 Cb 0.23 -1.25 0.05 0.00 0.00 0.00 0.00 23.12 22.15 1nl3 s ALA 797 CO -0.12 -1.05 0.33 0.00 0.00 0.00 0.00 175.76 174.92 1nl3 n MET 798 N 4.85 0.32 -0.52 0.00 0.00 -1.26 -4.91 117.12 115.59 1nl3 n MET 798 Ca -0.11 -0.86 -0.31 0.00 0.00 0.00 0.00 57.70 56.42 1nl3 n MET 798 Cb 0.46 -0.23 -0.07 0.00 0.00 0.00 0.00 33.22 33.38 1nl3 n MET 798 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1nl3 n ALA 799 N -3.00 1.72 -0.10 3.17 0.00 -1.26 -4.26 120.51 116.79 1nl3 n ALA 799 Ca -0.05 -2.08 0.00 0.00 0.00 0.00 0.00 53.44 51.31 1nl3 n ALA 799 Cb 0.19 -3.35 0.00 0.00 0.00 0.00 0.00 19.45 16.29 1nl3 n ALA 799 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1nl3 n GLN 800 N 6.70 0.00 0.10 0.00 3.00 -1.26 -5.13 117.38 120.79 1nl3 n GLN 800 Ca 0.36 0.07 0.00 0.00 -0.01 0.00 0.00 57.00 57.41 1nl3 n GLN 800 Cb 0.28 -0.03 0.00 0.00 0.00 0.00 0.00 30.24 30.49 1nl3 n GLN 800 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.06 179.95 1nl3 n ARG 801 N 2.59 0.00 -2.39 -1.09 -4.01 -1.26 -5.10 116.66 105.40 1nl3 n ARG 801 Ca 0.00 0.00 -0.04 0.00 -1.04 0.00 0.00 57.85 56.77 1nl3 n ARG 801 Cb 0.00 0.00 -0.03 0.00 -3.04 0.00 0.00 32.46 29.39 1nl3 n ARG 801 CO 0.00 0.00 0.00 -3.47 -3.04 0.00 0.00 177.63 171.12 1nl3 n ASP 802 N -2.90 -1.40 0.13 2.89 2.03 -1.26 -4.82 116.55 111.23 1nl3 n ASP 802 Ca 0.00 1.09 0.10 0.00 0.52 0.00 0.00 54.79 56.50 1nl3 n ASP 802 Cb 0.00 -4.43 0.50 0.00 -0.72 0.00 0.00 41.12 36.47 1nl3 n ASP 802 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1nl3 n PRO 803 N 1.26 0.13 0.02 -0.67 -0.04 -1.26 -2.42 135.00 132.03 1nl3 n PRO 803 Ca -0.30 0.56 -0.11 0.00 -0.04 0.00 0.00 63.50 63.61 1nl3 n PRO 803 Cb 0.47 -1.88 0.02 0.00 -0.04 0.00 0.00 33.50 32.07 1nl3 n PRO 803 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1nl3 h LEU 804 N 0.00 0.61 -0.35 1.53 5.85 -1.96 -0.29 115.31 120.70 1nl3 h LEU 804 Ca 0.00 -0.37 0.03 0.00 0.84 0.00 0.00 57.88 58.38 1nl3 h LEU 804 Cb 0.09 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 1nl3 h LEU 804 CO 0.00 1.11 0.16 0.58 -0.34 0.00 0.00 178.44 179.95 1nl3 h VAL 805 N 0.38 0.96 -0.85 1.05 2.07 -1.79 0.24 116.25 118.31 1nl3 h VAL 805 Ca -0.02 -0.11 -0.03 0.00 0.82 0.00 0.00 66.70 67.35 1nl3 h VAL 805 Cb 1.24 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 31.57 1nl3 h VAL 805 CO 0.12 0.06 0.40 -0.08 0.02 0.00 0.00 177.57 178.10 1nl3 h GLU 806 N 0.33 1.22 -0.09 1.57 4.22 -1.53 0.26 114.58 120.57 1nl3 h GLU 806 Ca 0.15 -0.18 -0.19 0.00 0.08 0.00 0.00 59.36 59.22 1nl3 h GLU 806 Cb 0.08 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 29.10 1nl3 h GLU 806 CO -0.12 0.94 -0.73 -0.92 -2.18 0.00 0.00 179.01 176.00 1nl3 h TYR 807 N 1.21 0.62 0.11 0.92 3.20 -0.83 -2.02 116.97 120.18 1nl3 h TYR 807 Ca 0.29 -0.27 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 1nl3 h TYR 807 Cb 0.12 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.30 1nl3 h TYR 807 CO 0.02 1.04 -0.05 1.96 -1.64 0.00 0.00 178.16 179.48 1nl3 h GLN 808 N 0.31 -0.15 -0.10 1.82 4.20 0.29 -0.13 115.11 121.36 1nl3 h GLN 808 Ca -0.03 0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.70 1nl3 h GLN 808 Cb 1.31 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 29.10 1nl3 h GLN 808 CO 0.13 0.26 -0.24 -0.09 -0.67 0.00 0.00 178.83 178.22 1nl3 h ARG 809 N -0.60 -0.22 0.00 1.46 2.43 -0.54 -0.89 114.38 116.02 1nl3 h ARG 809 Ca -0.02 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1nl3 h ARG 809 Cb 0.47 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.07 1nl3 h ARG 809 CO 0.03 -0.15 -0.04 0.93 -1.51 0.00 0.00 179.97 179.23 1nl3 h GLU 810 N -0.23 0.00 0.02 0.20 5.08 -1.42 -2.78 114.58 115.46 1nl3 h GLU 810 Ca 0.02 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.32 1nl3 h GLU 810 Cb 0.28 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 1nl3 h GLU 810 CO -0.21 0.04 -0.30 0.78 -1.00 0.00 0.00 179.01 178.32 1nl3 h GLY 811 N 0.45 0.05 1.47 -3.84 0.00 -0.21 -3.09 103.07 97.90 1nl3 h GLY 811 Ca -0.00 -0.13 -0.05 0.00 0.00 0.00 0.00 47.33 47.15 1nl3 h GLY 811 CO 0.00 0.11 0.06 -0.97 0.00 0.00 0.00 176.54 175.75 1nl3 h TYR 812 N -0.90 0.68 -0.09 5.60 0.05 -1.13 -2.59 116.97 118.59 1nl3 h TYR 812 Ca -0.07 -0.06 0.03 0.00 0.05 0.00 0.00 58.73 58.67 1nl3 h TYR 812 Cb 1.14 -0.20 -0.06 0.00 1.01 0.00 0.00 36.73 38.62 1nl3 h TYR 812 CO 0.24 0.61 -0.54 -0.44 -1.05 0.00 0.00 178.16 176.98 1nl3 h ASP 813 N 0.64 -1.72 -0.03 3.88 3.32 -1.55 0.17 116.42 121.12 1nl3 h ASP 813 Ca 0.14 0.20 0.01 0.00 0.02 0.00 0.00 57.03 57.40 1nl3 h ASP 813 Cb 0.30 0.66 -0.00 0.00 0.22 0.00 0.00 39.33 40.52 1nl3 h ASP 813 CO 0.00 -0.50 0.04 0.00 -1.72 0.00 0.00 179.24 177.07 1nl3 h MET 814 N -0.62 0.00 -0.06 3.56 -0.00 -1.46 -0.99 114.93 115.36 1nl3 h MET 814 Ca 0.03 0.00 -0.07 0.00 -0.00 0.00 0.00 59.70 59.65 1nl3 h MET 814 Cb 0.70 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.30 1nl3 h MET 814 CO -0.41 0.00 -0.26 0.35 -0.00 0.00 0.00 176.91 176.59 1nl3 h PHE 815 N 0.00 0.37 -0.20 -0.10 3.57 -0.38 0.66 116.94 120.86 1nl3 h PHE 815 Ca 0.01 -0.16 -0.00 0.00 3.53 0.00 0.00 57.97 61.35 1nl3 h PHE 815 Cb 0.10 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 1nl3 h PHE 815 CO 0.00 0.88 0.12 0.52 -2.23 0.00 0.00 178.31 177.60 1nl3 h MET 816 N -0.24 0.27 -0.93 1.11 2.86 -0.53 -0.33 114.93 117.14 1nl3 h MET 816 Ca -0.02 -0.03 0.15 0.00 -2.06 0.00 0.00 59.70 57.75 1nl3 h MET 816 Cb 0.90 -0.06 -0.08 0.00 0.06 0.00 0.00 31.60 32.43 1nl3 h MET 816 CO 0.05 0.24 0.60 0.00 1.06 0.00 0.00 176.91 178.85 1nl3 h ALA 817 N 1.02 1.77 -0.33 6.32 0.00 -1.18 0.79 119.26 127.66 1nl3 h ALA 817 Ca 0.07 0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.85 1nl3 h ALA 817 Cb 0.03 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1nl3 h ALA 817 CO -0.01 -0.04 -0.40 1.98 0.00 0.00 0.00 179.25 180.79 1nl3 h MET 818 N 0.75 0.85 -0.37 0.00 -1.53 -0.28 -1.73 114.93 112.62 1nl3 h MET 818 Ca 0.48 -0.47 -0.14 0.00 -3.44 0.00 0.00 59.70 56.13 1nl3 h MET 818 Cb 0.73 0.03 -0.01 0.00 -0.55 0.00 0.00 31.60 31.80 1nl3 h MET 818 CO -0.24 1.11 -0.32 -0.07 0.14 0.00 0.00 176.91 177.53 1nl3 h LEU 819 N 0.64 0.86 -0.37 3.39 3.38 0.50 -1.44 115.31 122.26 1nl3 h LEU 819 Ca 0.04 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.65 1nl3 h LEU 819 Cb 0.99 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 1nl3 h LEU 819 CO 0.09 1.10 0.21 0.44 0.09 0.00 0.00 178.44 180.38 1nl3 h ASP 820 N 0.69 0.46 0.32 -0.43 3.32 -0.86 -1.09 116.42 118.84 1nl3 h ASP 820 Ca 0.07 -0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.02 1nl3 h ASP 820 Cb 0.87 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 40.30 1nl3 h ASP 820 CO 0.08 0.41 -0.10 1.23 -1.72 0.00 0.00 179.24 179.14 1nl3 h GLY 821 N 0.48 0.00 0.69 2.75 0.00 -1.23 -2.31 103.07 103.45 1nl3 h GLY 821 Ca 0.13 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.39 1nl3 h GLY 821 CO -0.02 0.00 -0.21 1.98 0.00 0.00 0.00 176.54 178.29 1nl3 h MET 822 N 0.00 0.32 0.48 4.80 -1.53 -0.10 -2.80 114.93 116.11 1nl3 h MET 822 Ca -0.00 -0.21 -0.02 0.00 -3.44 0.00 0.00 59.70 56.03 1nl3 h MET 822 Cb 0.29 0.03 0.00 0.00 -0.55 0.00 0.00 31.60 31.37 1nl3 h MET 822 CO 0.01 0.80 -0.23 0.87 0.14 0.00 0.00 176.91 178.51 1nl3 h LYS 823 N -0.13 -0.62 -0.41 0.39 1.57 -1.00 -1.67 116.57 114.70 1nl3 h LYS 823 Ca 0.00 0.04 0.04 0.00 -1.87 0.00 0.00 60.65 58.87 1nl3 h LYS 823 Cb 0.80 0.14 -0.06 0.00 0.08 0.00 0.00 32.23 33.19 1nl3 h LYS 823 CO 0.05 -0.38 -0.36 0.93 -0.57 0.00 0.00 179.45 179.12 1nl3 h GLU 824 N -0.72 -0.14 0.00 3.15 5.08 -1.48 -0.89 114.58 119.59 1nl3 h GLU 824 Ca -0.07 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1nl3 h GLU 824 Cb 0.53 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 1nl3 h GLU 824 CO 0.11 -0.09 -0.12 0.93 -1.00 0.00 0.00 179.01 178.83 1nl3 h GLU 825 N -0.15 0.00 0.56 2.33 5.08 -1.49 -1.31 114.58 119.60 1nl3 h GLU 825 Ca 0.07 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.40 1nl3 h GLU 825 Cb 0.33 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.58 1nl3 h GLU 825 CO -0.46 0.12 -0.27 0.77 -1.00 0.00 0.00 179.01 178.17 1nl3 h SER 826 N 0.00 -0.63 -0.33 1.42 0.02 -0.20 -1.14 113.55 112.69 1nl3 h SER 826 Ca -0.00 -0.05 0.04 0.00 -0.84 0.00 0.00 61.79 60.95 1nl3 h SER 826 Cb 0.32 0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.98 1nl3 h SER 826 CO 0.02 -0.29 0.09 -0.37 -1.14 0.00 0.00 176.83 175.13 1nl3 h VAL 827 N -1.00 0.87 -0.12 2.27 -1.51 -0.82 0.37 116.25 116.31 1nl3 h VAL 827 Ca -0.08 -0.07 0.01 0.00 -1.23 0.00 0.00 66.70 65.33 1nl3 h VAL 827 Cb 0.64 0.64 -0.01 0.00 -2.13 0.00 0.00 31.29 30.42 1nl3 h VAL 827 CO 0.13 0.04 -0.07 0.61 -1.23 0.00 0.00 177.57 177.04 1nl3 n GLY 828 N -1.22 -2.25 0.21 5.19 0.00 -0.54 -1.17 105.19 105.42 1nl3 n GLY 828 Ca 0.01 0.51 0.05 0.00 0.00 0.00 0.00 46.02 46.58 1nl3 n GLY 828 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1nl3 h PHE 829 N 0.00 0.00 -0.76 1.61 0.04 0.16 -2.04 116.94 115.95 1nl3 h PHE 829 Ca 0.02 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.79 1nl3 h PHE 829 Cb 0.05 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.16 1nl3 h PHE 829 CO -0.70 0.24 0.47 -0.07 -0.60 0.00 0.00 178.31 177.64 1nl3 h LEU 830 N 0.00 0.90 0.08 1.54 3.38 0.12 -1.83 115.31 119.49 1nl3 h LEU 830 Ca -0.00 -0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.77 1nl3 h LEU 830 Cb 0.43 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.96 1nl3 h LEU 830 CO 0.03 0.68 -0.72 -0.26 0.09 0.00 0.00 178.44 178.27 1nl3 h PHE 831 N 1.04 0.31 -0.03 1.13 0.04 -1.05 -3.42 116.94 114.96 1nl3 h PHE 831 Ca 0.27 -0.23 0.00 0.00 2.80 0.00 0.00 57.97 60.82 1nl3 h PHE 831 Cb -0.06 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.08 1nl3 h PHE 831 CO 0.00 1.28 0.00 0.09 -0.60 0.00 0.00 178.31 179.08 1nl3 n ASN 832 N -4.26 2.41 -4.74 2.17 4.13 -0.79 -5.01 115.26 109.17 1nl3 n ASN 832 Ca -0.16 -1.70 -0.41 0.00 1.68 0.00 0.00 54.58 53.99 1nl3 n ASN 832 Cb 0.72 -0.01 -0.04 0.00 -1.54 0.00 0.00 39.78 38.91 1nl3 n ASN 832 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1nl3 s VAL 833 N -1.38 3.97 0.17 2.41 0.11 -0.70 -3.42 120.40 121.56 1nl3 s VAL 833 Ca 0.20 1.75 -0.32 0.00 -2.93 0.00 0.00 61.98 60.68 1nl3 s VAL 833 Cb 0.14 -4.11 -0.11 0.00 -1.53 0.00 0.00 36.38 30.76 1nl3 s VAL 833 CO 0.21 0.32 1.79 -0.89 -3.33 0.00 0.00 175.10 173.20 1nl3 s THR 834 N -0.42 2.23 0.00 5.04 2.01 0.58 -4.99 115.64 120.08 1nl3 s THR 834 Ca 0.47 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.47 1nl3 s THR 834 Cb -0.28 -3.00 0.00 0.00 0.01 0.00 0.00 72.50 69.23 1nl3 s THR 834 CO 0.34 0.00 0.44 0.52 -0.69 0.00 0.00 174.62 175.23