#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h1k n PRO 3 N 0.00 0.00 -0.10 0.00 -0.04 -1.26 -4.75 135.00 128.86 3h1k n PRO 3 Ca 0.00 0.43 -0.04 0.00 -0.04 0.00 0.00 63.50 63.84 3h1k n PRO 3 Cb 0.00 -1.30 0.04 0.00 -0.04 0.00 0.00 33.50 32.20 3h1k n PRO 3 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 3h1k n ASN 4 N -1.61 -1.71 -0.69 3.54 6.94 -1.26 -4.99 115.26 115.48 3h1k n ASN 4 Ca 0.00 -0.37 0.06 0.00 -0.02 0.00 0.00 54.58 54.25 3h1k n ASN 4 Cb 0.00 -0.15 0.16 0.00 -2.36 0.00 0.00 39.78 37.44 3h1k n ASN 4 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 3h1k n ILE 5 N -3.11 1.71 -0.30 1.53 2.08 -1.26 -4.62 119.36 115.38 3h1k n ILE 5 Ca 0.02 -2.63 0.00 0.00 0.56 0.00 0.00 62.75 60.70 3h1k n ILE 5 Cb 0.09 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 38.98 3h1k n ILE 5 CO 0.00 0.00 0.00 -2.11 0.56 0.00 0.00 176.55 175.00 3h1k n ARG 6 N -0.84 1.58 0.00 0.38 1.85 -1.26 -4.44 116.66 113.93 3h1k n ARG 6 Ca 0.16 -1.04 0.00 0.00 -1.00 0.00 0.00 57.85 55.97 3h1k n ARG 6 Cb 0.76 -0.85 0.00 0.00 -1.05 0.00 0.00 32.46 31.33 3h1k n ARG 6 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 3h1k n LYS 7 N -0.28 1.49 -0.08 2.89 5.02 -1.26 -2.85 118.16 123.09 3h1k n LYS 7 Ca 0.00 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.36 3h1k n LYS 7 Cb 0.28 -0.88 0.10 0.00 -0.02 0.00 0.00 35.03 34.52 3h1k n LYS 7 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 3h1k n SER 8 N -1.31 2.48 -4.37 4.39 3.41 -1.26 -4.88 113.62 112.08 3h1k n SER 8 Ca 0.00 -1.72 -0.40 0.00 -0.26 0.00 0.00 58.87 56.50 3h1k n SER 8 Cb 0.00 -0.10 -0.11 0.00 -0.26 0.00 0.00 64.21 63.74 3h1k n SER 8 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 3h1k s HIS 9 N -1.08 3.23 -1.34 7.33 5.04 -1.26 -4.91 115.29 122.29 3h1k s HIS 9 Ca 0.20 -0.96 0.00 0.00 -1.54 0.00 0.00 55.06 52.76 3h1k s HIS 9 Cb 0.12 -2.39 0.00 0.00 0.04 0.00 0.00 32.58 30.35 3h1k s HIS 9 CO 0.18 -0.62 0.29 -0.35 -2.34 0.00 0.00 174.74 171.89 3h1k n PRO 10 N 4.96 0.00 0.01 2.88 -0.04 -1.26 -0.66 135.00 140.89 3h1k n PRO 10 Ca -0.12 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.31 3h1k n PRO 10 Cb 0.46 -1.43 -0.01 0.00 -0.04 0.00 0.00 33.50 32.49 3h1k n PRO 10 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3h1k n LEU 11 N -0.77 0.72 0.31 1.53 4.77 -1.26 -4.63 117.00 117.67 3h1k n LEU 11 Ca 0.00 0.10 0.20 0.00 -0.03 0.00 0.00 56.01 56.28 3h1k n LEU 11 Cb 0.00 -0.24 1.01 0.00 -2.33 0.00 0.00 43.42 41.86 3h1k n LEU 11 CO 0.00 -0.29 1.11 -0.07 -1.33 0.00 0.00 177.39 176.81 3h1k h LEU 12 N -0.13 0.00 0.00 2.23 3.38 -1.78 0.38 115.31 119.40 3h1k h LEU 12 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3h1k h LEU 12 Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 3h1k h LEU 12 CO -0.03 0.01 0.00 1.17 0.09 0.00 0.00 178.44 179.68 3h1k n LYS 13 N -3.16 0.28 -0.00 1.13 4.81 0.17 -0.61 118.16 120.78 3h1k n LYS 13 Ca -0.02 0.10 0.03 0.00 -0.87 0.00 0.00 58.31 57.55 3h1k n LYS 13 Cb 0.16 -1.50 -0.04 0.00 0.02 0.00 0.00 35.03 33.67 3h1k n LYS 13 CO 0.00 0.00 0.00 -1.33 1.17 0.00 0.00 177.40 177.24 3h1k n MET 14 N -1.28 1.88 0.01 1.64 2.81 0.13 -3.39 117.12 118.92 3h1k n MET 14 Ca 0.09 -0.03 0.11 0.00 -1.81 0.00 0.00 57.70 56.06 3h1k n MET 14 Cb 0.15 -1.01 0.06 0.00 -0.71 0.00 0.00 33.22 31.71 3h1k n MET 14 CO 0.00 0.00 0.00 -0.89 1.51 0.00 0.00 175.97 176.59 3h1k n ILE 15 N -1.51 0.08 0.00 2.02 5.41 -0.88 -4.45 119.36 120.03 3h1k n ILE 15 Ca -0.00 -0.11 0.00 0.00 1.00 0.00 0.00 62.75 63.63 3h1k n ILE 15 Cb 0.13 0.40 0.00 0.00 -0.71 0.00 0.00 39.64 39.46 3h1k n ILE 15 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 3h1k n ASN 16 N -1.71 0.00 -3.24 4.38 5.15 0.22 -4.15 115.26 115.90 3h1k n ASN 16 Ca 0.04 0.00 -0.22 0.00 -0.60 0.00 0.00 54.58 53.80 3h1k n ASN 16 Cb 0.38 -0.41 -0.03 0.00 -0.53 0.00 0.00 39.78 39.19 3h1k n ASN 16 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 3h1k n ASN 17 N -2.34 2.60 0.00 1.20 3.02 -1.22 -0.59 115.26 117.93 3h1k n ASN 17 Ca 0.00 -2.31 0.00 0.00 -0.03 0.00 0.00 54.58 52.24 3h1k n ASN 17 Cb 0.00 -0.85 0.00 0.00 -0.61 0.00 0.00 39.78 38.32 3h1k n ASN 17 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3h1k n SER 18 N 5.54 0.00 0.00 6.41 3.41 -1.26 -4.81 113.62 122.91 3h1k n SER 18 Ca 0.32 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.93 3h1k n SER 18 Cb 0.17 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 3h1k n SER 18 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3h1k n LEU 19 N 0.00 0.00 0.00 1.04 4.77 0.25 -4.91 117.00 118.15 3h1k n LEU 19 Ca 0.00 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 3h1k n LEU 19 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3h1k n LEU 19 CO 0.00 0.19 -0.05 -0.38 -1.33 0.00 0.00 177.39 175.82 3h1k n ILE 20 N 0.00 0.00 1.01 -0.08 5.41 0.09 -4.45 119.36 121.35 3h1k n ILE 20 Ca 0.00 0.00 0.12 0.00 1.00 0.00 0.00 62.75 63.87 3h1k n ILE 20 Cb 0.25 -0.35 0.10 0.00 -0.71 0.00 0.00 39.64 38.93 3h1k n ILE 20 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 3h1k n ASP 21 N -2.12 2.87 -4.68 4.38 9.92 -1.15 -3.44 116.55 122.34 3h1k n ASP 21 Ca 0.00 -1.94 -0.48 0.00 -0.53 0.00 0.00 54.79 51.84 3h1k n ASP 21 Cb 0.05 0.05 -0.05 0.00 -0.64 0.00 0.00 41.12 40.53 3h1k n ASP 21 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 3h1k n LEU 22 N 1.18 3.28 -4.63 0.64 7.94 -1.26 -4.76 117.00 119.39 3h1k n LEU 22 Ca 0.14 1.01 -0.43 0.00 -1.11 0.00 0.00 56.01 55.62 3h1k n LEU 22 Cb 0.58 -1.37 -0.03 0.00 0.53 0.00 0.00 43.42 43.14 3h1k n LEU 22 CO 0.17 -0.15 1.38 -2.84 -1.11 0.00 0.00 177.39 174.84 3h1k s PRO 23 N 3.21 3.79 0.03 1.96 0.02 -1.26 -1.31 135.00 141.44 3h1k s PRO 23 Ca 0.89 1.69 0.08 0.00 0.02 0.00 0.00 61.00 63.69 3h1k s PRO 23 Cb -0.71 -4.04 -0.03 0.00 0.02 0.00 0.00 34.50 29.74 3h1k s PRO 23 CO 0.49 -1.30 -0.24 0.00 -0.33 0.00 0.00 177.00 175.62 3h1k s ALA 24 N 5.22 2.03 1.00 -1.55 0.00 0.14 -4.70 121.76 123.90 3h1k s ALA 24 Ca 0.72 -1.15 -0.13 0.00 0.00 0.00 0.00 51.96 51.40 3h1k s ALA 24 Cb -0.25 -0.44 0.09 0.00 0.00 0.00 0.00 23.12 22.51 3h1k s ALA 24 CO 0.29 0.48 0.48 -2.30 0.00 0.00 0.00 175.76 174.71 3h1k n PRO 25 N 1.96 -0.73 0.00 0.00 -0.02 -1.26 0.11 135.00 135.05 3h1k n PRO 25 Ca -0.17 -0.17 0.11 0.00 -2.02 0.00 0.00 63.50 61.24 3h1k n PRO 25 Cb 0.52 -1.93 -0.03 0.00 -0.02 0.00 0.00 33.50 32.05 3h1k n PRO 25 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3h1k n SER 26 N -2.10 0.86 -0.59 2.55 3.41 -1.20 -4.27 113.62 112.27 3h1k n SER 26 Ca 0.06 -0.79 0.06 0.00 -0.26 0.00 0.00 58.87 57.94 3h1k n SER 26 Cb 0.55 0.82 0.16 0.00 -0.26 0.00 0.00 64.21 65.47 3h1k n SER 26 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3h1k n ASN 27 N -1.51 2.99 -4.77 4.04 6.94 -1.26 -5.02 115.26 116.67 3h1k n ASN 27 Ca 0.04 -2.24 -0.38 0.00 -0.02 0.00 0.00 54.58 51.98 3h1k n ASN 27 Cb 0.34 -0.27 -0.01 0.00 -2.36 0.00 0.00 39.78 37.48 3h1k n ASN 27 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 3h1k s ILE 28 N -1.43 2.95 0.00 1.53 -4.36 -1.26 -4.54 121.20 114.09 3h1k s ILE 28 Ca 0.24 0.75 0.00 0.00 -0.26 0.00 0.00 60.65 61.38 3h1k s ILE 28 Cb 0.16 -3.40 0.00 0.00 1.25 0.00 0.00 42.46 40.47 3h1k s ILE 28 CO 0.12 0.02 0.00 -1.54 0.24 0.00 0.00 174.94 173.78 3h1k n SER 29 N -0.35 0.00 0.28 4.36 3.41 -1.26 -4.99 113.62 115.07 3h1k n SER 29 Ca 0.07 -0.29 0.17 0.00 -0.26 0.00 0.00 58.87 58.55 3h1k n SER 29 Cb 0.47 0.00 0.79 0.00 -0.26 0.00 0.00 64.21 65.21 3h1k n SER 29 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h1k h ALA 30 N -0.68 1.05 0.00 7.33 0.00 -2.02 -2.56 119.26 122.37 3h1k h ALA 30 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3h1k h ALA 30 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3h1k h ALA 30 CO 0.00 0.05 0.00 0.91 0.00 0.00 0.00 179.25 180.21 3h1k n TRP 31 N -3.21 0.00 0.35 0.00 7.02 -1.26 -2.14 117.44 118.20 3h1k n TRP 31 Ca -0.01 0.00 0.05 0.00 -1.02 0.00 0.00 57.50 56.52 3h1k n TRP 31 Cb 0.26 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 29.09 3h1k n TRP 31 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 3h1k n TRP 32 N -0.50 0.00 0.16 -5.99 8.01 -0.97 -4.49 117.44 113.67 3h1k n TRP 32 Ca 0.00 0.00 0.02 0.00 -1.31 0.00 0.00 57.50 56.21 3h1k n TRP 32 Cb 0.00 -0.05 0.27 0.00 -2.01 0.00 0.00 31.31 29.52 3h1k n TRP 32 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 177.69 175.77 3h1k h ASN 33 N 0.00 0.00 -0.02 -0.99 4.21 -1.60 -3.08 115.58 114.09 3h1k h ASN 33 Ca 0.00 0.00 0.01 0.00 1.21 0.00 0.00 56.30 57.52 3h1k h ASN 33 Cb 0.27 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.46 3h1k h ASN 33 CO 0.00 0.49 0.16 -0.26 -1.29 0.00 0.00 177.43 176.53 3h1k h PHE 34 N 0.00 0.00 0.20 1.19 0.04 -1.79 -1.81 116.94 114.77 3h1k h PHE 34 Ca -0.00 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 3h1k h PHE 34 Cb 0.94 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.09 3h1k h PHE 34 CO 0.00 0.00 -0.10 0.78 -0.60 0.00 0.00 178.31 178.39 3h1k h GLY 35 N 0.00 -0.28 0.69 -1.45 0.00 -1.86 0.14 103.07 100.30 3h1k h GLY 35 Ca 0.01 0.10 0.05 0.00 0.00 0.00 0.00 47.33 47.49 3h1k h GLY 35 CO -0.00 -0.10 0.21 1.48 0.00 0.00 0.00 176.54 178.13 3h1k h SER 36 N -0.27 0.27 -0.34 0.19 4.64 -1.68 -1.85 113.55 114.52 3h1k h SER 36 Ca -0.03 0.04 0.07 0.00 -0.47 0.00 0.00 61.79 61.40 3h1k h SER 36 Cb 0.21 -0.01 -0.08 0.00 -0.31 0.00 0.00 62.40 62.20 3h1k h SER 36 CO 0.05 0.20 -0.32 -0.07 -0.87 0.00 0.00 176.83 175.81 3h1k h LEU 37 N 0.41 -1.04 -0.80 5.97 3.38 -1.32 0.46 115.31 122.38 3h1k h LEU 37 Ca 0.21 0.18 0.19 0.00 0.09 0.00 0.00 57.88 58.54 3h1k h LEU 37 Cb 0.15 0.48 -0.12 0.00 0.09 0.00 0.00 40.66 41.26 3h1k h LEU 37 CO -0.17 -0.32 0.22 -0.07 0.09 0.00 0.00 178.44 178.18 3h1k h LEU 38 N -0.28 0.05 0.00 1.67 3.38 -0.03 1.05 115.31 121.15 3h1k h LEU 38 Ca 0.16 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.29 3h1k h LEU 38 Cb 0.53 0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.49 3h1k h LEU 38 CO -0.49 -0.06 0.00 0.00 0.09 0.00 0.00 178.44 177.98 3h1k n ALA 39 N -2.66 -0.36 -0.30 1.53 0.00 0.77 -2.03 120.51 117.46 3h1k n ALA 39 Ca 0.17 0.00 0.22 0.00 0.00 0.00 0.00 53.44 53.83 3h1k n ALA 39 Cb 0.54 0.00 0.42 0.00 0.00 0.00 0.00 19.45 20.41 3h1k n ALA 39 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3h1k n VAL 40 N -1.65 -0.38 -0.06 0.00 0.31 0.13 0.15 118.33 116.82 3h1k n VAL 40 Ca 0.00 1.88 -0.08 0.00 -0.01 0.00 0.00 64.34 66.13 3h1k n VAL 40 Cb 0.00 -2.93 -0.02 0.00 -0.91 0.00 0.00 33.84 29.99 3h1k n VAL 40 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3h1k h LEU 42 N -0.25 -0.54 -1.46 0.00 5.85 0.20 -0.70 115.31 118.41 3h1k h LEU 42 Ca 0.15 0.05 0.35 0.00 0.84 0.00 0.00 57.88 59.27 3h1k h LEU 42 Cb 0.48 0.19 -0.10 0.00 0.37 0.00 0.00 40.66 41.59 3h1k h LEU 42 CO -0.42 -0.30 0.78 0.24 -0.34 0.00 0.00 178.44 178.40 3h1k h MET 43 N -0.44 0.21 0.00 1.25 2.86 -0.70 -1.85 114.93 116.26 3h1k h MET 43 Ca -0.00 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 3h1k h MET 43 Cb 0.41 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.02 3h1k h MET 43 CO -0.05 0.14 -0.09 1.15 1.06 0.00 0.00 176.91 179.12 3h1k h THR 44 N 0.22 0.47 -0.80 2.22 2.02 -0.23 -3.18 112.91 113.63 3h1k h THR 44 Ca 0.69 -1.37 0.16 0.00 0.77 0.00 0.00 66.41 66.67 3h1k h THR 44 Cb 2.07 0.90 -0.15 0.00 -1.74 0.00 0.00 68.15 69.23 3h1k h THR 44 CO -0.31 0.16 -0.17 1.56 0.37 0.00 0.00 175.52 177.12 3h1k h GLN 45 N -1.00 0.01 -0.51 6.66 1.08 -0.73 0.29 115.11 120.91 3h1k h GLN 45 Ca -0.01 -0.00 0.08 0.00 -1.45 0.00 0.00 58.65 57.27 3h1k h GLN 45 Cb 0.33 -0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 27.70 3h1k h GLN 45 CO -0.01 0.01 0.15 0.82 -0.95 0.00 0.00 178.83 178.85 3h1k h ILE 46 N 0.01 0.77 0.15 2.54 2.04 -1.51 2.01 117.51 123.52 3h1k h ILE 46 Ca 0.39 -0.10 -0.01 0.00 1.00 0.00 0.00 64.86 66.14 3h1k h ILE 46 Cb 0.62 0.44 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 3h1k h ILE 46 CO -0.81 0.06 -0.07 0.25 0.00 0.00 0.00 178.15 177.57 3h1k h LEU 47 N 0.31 -0.17 -0.97 1.44 5.85 -0.54 -0.33 115.31 120.89 3h1k h LEU 47 Ca 0.25 -0.17 -0.08 0.00 0.84 0.00 0.00 57.88 58.72 3h1k h LEU 47 Cb 0.31 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 3h1k h LEU 47 CO -0.29 0.07 -0.13 0.71 -0.34 0.00 0.00 178.44 178.46 3h1k h THR 48 N -0.42 1.25 -0.43 1.05 1.35 -0.49 -2.12 112.91 113.09 3h1k h THR 48 Ca -0.02 -1.11 0.06 0.00 -0.55 0.00 0.00 66.41 64.79 3h1k h THR 48 Cb 0.33 1.14 -0.05 0.00 -1.73 0.00 0.00 68.15 67.84 3h1k h THR 48 CO 0.03 0.37 0.14 1.23 -0.25 0.00 0.00 175.52 177.04 3h1k h GLY 49 N 0.96 0.56 0.68 5.82 0.00 0.35 -1.65 103.07 109.78 3h1k h GLY 49 Ca 0.09 -0.08 -0.03 0.00 0.00 0.00 0.00 47.33 47.32 3h1k h GLY 49 CO 0.03 0.01 -0.33 1.41 0.00 0.00 0.00 176.54 177.67 3h1k h LEU 50 N 0.30 -0.78 -1.26 3.11 3.38 -0.85 -1.16 115.31 118.06 3h1k h LEU 50 Ca 0.20 0.03 0.42 0.00 0.09 0.00 0.00 57.88 58.62 3h1k h LEU 50 Cb 0.21 0.20 -0.11 0.00 0.09 0.00 0.00 40.66 41.05 3h1k h LEU 50 CO -0.22 -0.48 0.83 0.18 0.09 0.00 0.00 178.44 178.84 3h1k n LEU 51 N -4.88 0.15 -0.06 1.67 4.77 -0.82 0.13 117.00 117.96 3h1k n LEU 51 Ca -0.11 1.13 -0.08 0.00 -0.03 0.00 0.00 56.01 56.91 3h1k n LEU 51 Cb 0.36 -0.55 -0.07 0.00 -2.33 0.00 0.00 43.42 40.83 3h1k n LEU 51 CO 0.27 -1.21 0.18 -0.07 -1.33 0.00 0.00 177.39 175.24 3h1k h LEU 52 N 0.00 0.00 -1.48 2.23 3.38 -1.18 -3.28 115.31 114.98 3h1k h LEU 52 Ca 0.76 -0.53 0.25 0.00 0.09 0.00 0.00 57.88 58.46 3h1k h LEU 52 Cb 2.56 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 43.27 3h1k h LEU 52 CO -0.33 0.79 0.94 0.00 0.09 0.00 0.00 178.44 179.93 3h1k h ALA 53 N -0.47 2.73 0.00 1.53 0.00 0.24 1.50 119.26 124.78 3h1k h ALA 53 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3h1k h ALA 53 Cb 0.56 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3h1k h ALA 53 CO -0.00 -1.40 0.00 -1.33 0.00 0.00 0.00 179.25 176.52 3h1k n MET 54 N -3.49 0.54 0.00 0.00 2.81 0.25 -3.10 117.12 114.13 3h1k n MET 54 Ca 0.19 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 56.11 3h1k n MET 54 Cb 1.23 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 32.24 3h1k n MET 54 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 3h1k n HIS 55 N -1.16 0.00 -3.06 2.03 8.25 0.51 -5.08 115.22 116.71 3h1k n HIS 55 Ca 0.15 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 57.30 3h1k n HIS 55 Cb 0.15 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.21 3h1k n HIS 55 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 3h1k s TYR 56 N -0.03 3.44 -0.25 4.41 5.04 -0.88 -4.77 117.35 124.30 3h1k s TYR 56 Ca 0.00 1.02 -0.01 0.00 -2.44 0.00 0.00 57.07 55.64 3h1k s TYR 56 Cb 0.00 -2.40 0.07 0.00 0.35 0.00 0.00 41.96 39.98 3h1k s TYR 56 CO 0.00 0.03 0.03 0.99 -1.34 0.00 0.00 175.55 175.25 3h1k s THR 57 N -2.16 1.01 -1.13 4.34 2.01 -1.26 -4.98 115.64 113.47 3h1k s THR 57 Ca 0.51 -1.08 -0.22 0.00 0.31 0.00 0.00 61.69 61.20 3h1k s THR 57 Cb -0.10 -1.52 -0.03 0.00 0.01 0.00 0.00 72.50 70.85 3h1k s THR 57 CO 0.26 -0.33 1.85 0.00 -0.69 0.00 0.00 174.62 175.71 3h1k s ALA 58 N 1.61 2.15 -0.25 7.40 0.00 -1.26 -2.84 121.76 128.57 3h1k s ALA 58 Ca 0.01 -2.17 -0.12 0.00 0.00 0.00 0.00 51.96 49.68 3h1k s ALA 58 Cb -0.18 -4.63 0.09 0.00 0.00 0.00 0.00 23.12 18.40 3h1k s ALA 58 CO -0.12 -4.61 0.58 0.34 0.00 0.00 0.00 175.76 171.95 3h1k s ASP 59 N 6.26 -0.80 0.00 0.00 2.15 -1.26 -4.51 116.67 118.51 3h1k s ASP 59 Ca 0.64 1.31 0.00 0.00 0.43 0.00 0.00 52.55 54.93 3h1k s ASP 59 Cb -0.01 1.41 0.00 0.00 -0.30 0.00 0.00 42.92 44.02 3h1k s ASP 59 CO 0.07 -0.22 0.00 0.35 -0.17 0.00 0.00 175.17 175.19 3h1k n THR 60 N 4.66 0.00 -1.39 1.71 -2.24 -1.26 0.16 114.28 115.91 3h1k n THR 60 Ca -0.18 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 3h1k n THR 60 Cb 0.55 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.37 3h1k n THR 60 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3h1k n SER 61 N -0.17 0.00 0.00 3.42 3.41 -1.26 -4.86 113.62 114.15 3h1k n SER 61 Ca 0.00 -1.33 0.00 0.00 -0.26 0.00 0.00 58.87 57.28 3h1k n SER 61 Cb 0.00 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 63.88 3h1k n SER 61 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3h1k n LEU 62 N 0.00 0.00 0.23 1.04 4.77 0.42 -4.90 117.00 118.55 3h1k n LEU 62 Ca 0.00 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.82 3h1k n LEU 62 Cb 0.57 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.58 3h1k n LEU 62 CO 0.00 0.00 0.61 0.00 -1.33 0.00 0.00 177.39 176.67 3h1k h ALA 63 N 0.00 -0.81 0.39 -1.18 0.00 0.07 0.34 119.26 118.07 3h1k h ALA 63 Ca 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3h1k h ALA 63 Cb 0.00 0.55 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3h1k h ALA 63 CO 0.00 -1.00 -0.34 0.35 0.00 0.00 0.00 179.25 178.26 3h1k h PHE 64 N -0.77 -0.92 -0.21 0.00 3.57 -1.82 -2.02 116.94 114.78 3h1k h PHE 64 Ca -0.03 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.54 3h1k h PHE 64 Cb 0.70 0.35 -0.01 0.00 2.79 0.00 0.00 35.95 39.78 3h1k h PHE 64 CO -0.22 -0.49 0.17 0.66 -2.23 0.00 0.00 178.31 176.19 3h1k h SER 65 N -0.74 0.00 0.02 0.41 4.64 -1.89 -0.19 113.55 115.81 3h1k h SER 65 Ca -0.03 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.29 3h1k h SER 65 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 3h1k h SER 65 CO -0.03 0.00 -0.01 0.77 -0.87 0.00 0.00 176.83 176.69 3h1k h SER 66 N 0.00 -0.02 -0.62 4.97 4.64 0.02 -0.69 113.55 121.85 3h1k h SER 66 Ca 0.10 -0.67 0.11 0.00 -0.47 0.00 0.00 61.79 60.86 3h1k h SER 66 Cb 0.43 0.01 -0.08 0.00 -0.31 0.00 0.00 62.40 62.44 3h1k h SER 66 CO -0.00 0.68 0.19 0.58 -0.87 0.00 0.00 176.83 177.41 3h1k h VAL 67 N -0.75 0.70 -0.00 0.95 2.07 -0.85 0.85 116.25 119.21 3h1k h VAL 67 Ca -0.00 -0.12 0.02 0.00 0.82 0.00 0.00 66.70 67.42 3h1k h VAL 67 Cb 0.69 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 3h1k h VAL 67 CO 0.00 0.06 -0.08 0.00 0.02 0.00 0.00 177.57 177.57 3h1k h ALA 68 N 1.46 -0.09 -0.45 1.67 0.00 -1.06 -1.43 119.26 119.37 3h1k h ALA 68 Ca 0.32 0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.29 3h1k h ALA 68 Cb 0.45 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 3h1k h ALA 68 CO -0.36 -0.58 0.17 1.25 0.00 0.00 0.00 179.25 179.74 3h1k h HIS 69 N -0.14 0.31 -1.00 0.00 -0.00 0.51 0.22 115.15 115.04 3h1k h HIS 69 Ca 0.03 0.02 0.18 0.00 -0.00 0.00 0.00 60.37 60.60 3h1k h HIS 69 Cb 0.19 -0.07 -0.10 0.00 -0.00 0.00 0.00 27.41 27.42 3h1k h HIS 69 CO -0.15 0.12 0.61 1.15 -0.00 0.00 0.00 177.93 179.66 3h1k h THR 70 N 0.35 0.74 -0.01 6.26 2.02 0.12 1.15 112.91 123.55 3h1k h THR 70 Ca 0.21 -0.27 -0.08 0.00 0.77 0.00 0.00 66.41 67.04 3h1k h THR 70 Cb 0.19 -0.13 0.01 0.00 -1.74 0.00 0.00 68.15 66.48 3h1k h THR 70 CO -0.20 0.14 -0.29 0.00 0.37 0.00 0.00 175.52 175.54 3h1k h ARG 72 N -0.42 0.00 0.00 0.00 3.08 0.35 -3.24 114.38 114.15 3h1k h ARG 72 Ca -0.03 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.81 3h1k h ARG 72 Cb 1.03 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.04 3h1k h ARG 72 CO 0.06 0.56 -1.75 0.09 -1.07 0.00 0.00 179.97 177.86 3h1k n ASN 73 N -3.21 2.68 -4.75 7.04 3.02 0.39 -5.01 115.26 115.41 3h1k n ASN 73 Ca 0.00 -0.03 -0.41 0.00 -0.03 0.00 0.00 54.58 54.11 3h1k n ASN 73 Cb 0.78 -0.24 -0.03 0.00 -0.61 0.00 0.00 39.78 39.69 3h1k n ASN 73 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3h1k s VAL 74 N -2.26 2.93 0.24 2.41 1.01 -1.16 -4.94 120.40 118.63 3h1k s VAL 74 Ca -0.18 0.86 -0.31 0.00 0.00 0.00 0.00 61.98 62.34 3h1k s VAL 74 Cb 0.05 -3.55 -0.13 0.00 0.00 0.00 0.00 36.38 32.75 3h1k s VAL 74 CO 0.29 0.17 1.41 0.00 0.00 0.00 0.00 175.10 176.97 3h1k n GLN 75 N 1.65 2.03 -0.52 2.72 1.13 -1.26 -0.32 117.38 122.82 3h1k n GLN 75 Ca 0.03 0.72 -0.01 0.00 -1.94 0.00 0.00 57.00 55.80 3h1k n GLN 75 Cb 0.42 -2.38 -0.01 0.00 0.11 0.00 0.00 30.24 28.38 3h1k n GLN 75 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 3h1k n TYR 76 N 1.91 -0.28 -0.03 1.08 4.02 -1.26 -4.73 117.16 117.88 3h1k n TYR 76 Ca 0.12 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.91 3h1k n TYR 76 Cb 0.31 -1.04 -0.03 0.00 -0.02 0.00 0.00 39.34 38.56 3h1k n TYR 76 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 3h1k h GLY 77 N 0.00 -0.38 0.23 2.72 0.00 -0.84 0.48 103.07 105.28 3h1k h GLY 77 Ca -0.03 0.39 0.07 0.00 0.00 0.00 0.00 47.33 47.76 3h1k h GLY 77 CO 0.04 -0.21 -0.11 0.11 0.00 0.00 0.00 176.54 176.36 3h1k h TRP 78 N -0.35 -0.26 -0.02 5.60 5.08 -1.65 0.36 115.95 124.71 3h1k h TRP 78 Ca 0.11 0.03 0.03 0.00 1.08 0.00 0.00 58.89 60.15 3h1k h TRP 78 Cb 0.54 0.17 -0.05 0.00 -3.00 0.00 0.00 29.16 26.81 3h1k h TRP 78 CO -0.43 -0.18 -0.36 1.25 -1.28 0.00 0.00 178.44 177.44 3h1k h LEU 79 N -0.04 -1.08 -1.33 0.11 5.85 -1.44 0.58 115.31 117.97 3h1k h LEU 79 Ca 0.17 0.14 0.15 0.00 0.84 0.00 0.00 57.88 59.18 3h1k h LEU 79 Cb 0.30 0.43 -0.07 0.00 0.37 0.00 0.00 40.66 41.70 3h1k h LEU 79 CO -0.39 -0.41 0.57 0.40 -0.34 0.00 0.00 178.44 178.27 3h1k h ILE 80 N -0.50 0.82 0.38 4.05 2.04 0.83 -1.92 117.51 123.21 3h1k h ILE 80 Ca 0.06 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 3h1k h ILE 80 Cb 0.59 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 3h1k h ILE 80 CO -0.30 0.12 -0.18 -0.09 0.00 0.00 0.00 178.15 177.70 3h1k h ARG 81 N 0.64 -0.50 0.00 2.37 2.43 0.18 -2.94 114.38 116.57 3h1k h ARG 81 Ca 0.44 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.65 3h1k h ARG 81 Cb 0.76 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.42 3h1k h ARG 81 CO -0.20 -0.18 0.00 0.09 -1.51 0.00 0.00 179.97 178.17 3h1k n ASN 82 N -5.16 0.00 -0.20 -3.80 5.03 -0.15 -0.25 115.26 110.73 3h1k n ASN 82 Ca -0.09 0.89 0.13 0.00 0.87 0.00 0.00 54.58 56.37 3h1k n ASN 82 Cb 0.28 -0.39 0.24 0.00 -1.02 0.00 0.00 39.78 38.90 3h1k n ASN 82 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 3h1k n LEU 83 N -2.42 0.05 0.14 3.41 4.77 -0.77 0.10 117.00 122.28 3h1k n LEU 83 Ca 0.00 0.98 -0.12 0.00 -0.03 0.00 0.00 56.01 56.83 3h1k n LEU 83 Cb 0.00 -0.41 -0.08 0.00 -2.33 0.00 0.00 43.42 40.61 3h1k n LEU 83 CO 0.00 -1.04 0.49 -0.74 -1.33 0.00 0.00 177.39 174.77 3h1k h HIS 84 N 0.00 -0.36 -0.86 -1.77 2.76 -0.43 0.86 115.15 115.35 3h1k h HIS 84 Ca 0.41 -0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.58 3h1k h HIS 84 Cb 0.97 0.12 -0.04 0.00 1.55 0.00 0.00 27.41 30.01 3h1k h HIS 84 CO -0.17 -0.01 0.57 0.00 -1.30 0.00 0.00 177.93 177.02 3h1k h ALA 85 N -0.31 1.39 0.06 5.26 0.00 0.91 -1.28 119.26 125.28 3h1k h ALA 85 Ca -0.04 -0.06 -0.24 0.00 0.00 0.00 0.00 54.91 54.57 3h1k h ALA 85 Cb 0.51 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3h1k h ALA 85 CO 0.07 0.57 -1.08 -0.91 0.00 0.00 0.00 179.25 177.89 3h1k h ASN 86 N 1.17 0.36 -0.87 0.00 4.21 -0.84 -3.07 115.58 116.54 3h1k h ASN 86 Ca 0.32 -0.35 0.18 0.00 1.21 0.00 0.00 56.30 57.66 3h1k h ASN 86 Cb -0.13 -0.12 -0.07 0.00 -1.12 0.00 0.00 38.32 36.89 3h1k h ASN 86 CO -0.07 1.22 0.57 1.23 -1.29 0.00 0.00 177.43 179.09 3h1k h GLY 87 N 1.73 0.94 0.39 2.83 0.00 0.18 0.23 103.07 109.37 3h1k h GLY 87 Ca -0.09 -0.22 0.03 0.00 0.00 0.00 0.00 47.33 47.06 3h1k h GLY 87 CO 0.17 0.03 -0.26 0.00 0.00 0.00 0.00 176.54 176.48 3h1k h ALA 88 N 1.62 -0.33 0.48 3.60 0.00 -1.18 0.21 119.26 123.66 3h1k h ALA 88 Ca 0.45 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.34 3h1k h ALA 88 Cb 0.99 0.46 0.00 0.00 0.00 0.00 0.00 17.79 19.25 3h1k h ALA 88 CO -0.18 -0.75 -0.24 0.77 0.00 0.00 0.00 179.25 178.85 3h1k h SER 89 N -0.38 -0.58 -0.78 0.00 0.02 -0.72 -1.63 113.55 109.47 3h1k h SER 89 Ca 0.07 0.02 0.28 0.00 -0.84 0.00 0.00 61.79 61.32 3h1k h SER 89 Cb 0.48 0.16 -0.14 0.00 0.14 0.00 0.00 62.40 63.03 3h1k h SER 89 CO -0.24 -0.40 0.24 0.33 -1.14 0.00 0.00 176.83 175.62 3h1k n PHE 90 N -3.82 0.73 0.30 3.45 7.35 -0.19 0.12 117.46 125.40 3h1k n PHE 90 Ca -0.08 0.93 -0.15 0.00 -0.76 0.00 0.00 57.45 57.39 3h1k n PHE 90 Cb 0.26 -1.23 -0.08 0.00 0.35 0.00 0.00 39.48 38.78 3h1k n PHE 90 CO 0.00 0.00 0.00 0.35 -0.76 0.00 0.00 176.76 176.35 3h1k h PHE 91 N 0.00 -1.09 -0.50 -5.13 3.04 0.01 -1.60 116.94 111.68 3h1k h PHE 91 Ca 0.58 -0.00 0.06 0.00 3.98 0.00 0.00 57.97 62.59 3h1k h PHE 91 Cb 1.41 0.40 -0.05 0.00 2.56 0.00 0.00 35.95 40.27 3h1k h PHE 91 CO -0.18 -0.57 0.19 0.74 -2.02 0.00 0.00 178.31 176.47 3h1k h PHE 92 N -0.90 0.34 0.03 0.41 -1.00 0.18 0.59 116.94 116.59 3h1k h PHE 92 Ca -0.07 0.02 0.01 0.00 2.81 0.00 0.00 57.97 60.74 3h1k h PHE 92 Cb 0.75 -0.08 -0.03 0.00 3.61 0.00 0.00 35.95 40.19 3h1k h PHE 92 CO -0.13 0.13 -0.32 0.82 -1.61 0.00 0.00 178.31 177.19 3h1k h ILE 93 N 0.38 0.00 -0.88 -0.55 2.04 -0.87 0.22 117.51 117.85 3h1k h ILE 93 Ca 0.24 0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.33 3h1k h ILE 93 Cb 0.23 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 36.17 3h1k h ILE 93 CO -0.22 0.00 0.27 0.00 0.00 0.00 0.00 178.15 178.19 3h1k h ILE 95 N 0.24 1.23 -0.65 0.00 2.10 0.11 0.03 117.51 120.57 3h1k h ILE 95 Ca 0.55 -0.67 -0.05 0.00 1.08 0.00 0.00 64.86 65.77 3h1k h ILE 95 Cb 1.11 0.47 -0.03 0.00 -1.09 0.00 0.00 36.82 37.28 3h1k h ILE 95 CO -0.63 0.27 0.19 -0.26 -1.08 0.00 0.00 178.15 176.65 3h1k h PHE 96 N 0.90 1.05 0.66 2.19 0.04 0.22 0.44 116.94 122.44 3h1k h PHE 96 Ca 0.22 -0.11 -0.03 0.00 2.80 0.00 0.00 57.97 60.85 3h1k h PHE 96 Cb 0.15 -0.30 0.01 0.00 2.20 0.00 0.00 35.95 38.01 3h1k h PHE 96 CO 0.01 0.86 -0.32 -0.07 -0.60 0.00 0.00 178.31 178.19 3h1k h LEU 97 N 0.94 -0.75 -0.92 1.54 3.38 -0.97 0.39 115.31 118.91 3h1k h LEU 97 Ca 0.21 -0.01 0.14 0.00 0.09 0.00 0.00 57.88 58.31 3h1k h LEU 97 Cb 0.31 0.19 -0.15 0.00 0.09 0.00 0.00 40.66 41.10 3h1k h LEU 97 CO -0.00 -0.45 -0.42 -0.74 0.09 0.00 0.00 178.44 176.92 3h1k h HIS 98 N -1.01 -1.20 0.36 1.13 2.76 -0.62 0.11 115.15 116.69 3h1k h HIS 98 Ca -0.09 0.10 -0.01 0.00 -2.20 0.00 0.00 60.37 58.17 3h1k h HIS 98 Cb 0.71 0.66 -0.00 0.00 1.55 0.00 0.00 27.41 30.32 3h1k h HIS 98 CO -0.01 -0.40 -0.22 0.82 -1.30 0.00 0.00 177.93 176.83 3h1k h ILE 99 N -0.03 0.55 -0.34 6.26 2.04 0.04 -2.32 117.51 123.71 3h1k h ILE 99 Ca 0.30 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.23 3h1k h ILE 99 Cb 0.56 0.55 -0.08 0.00 -0.74 0.00 0.00 36.82 37.11 3h1k h ILE 99 CO -0.93 0.00 -0.25 1.23 0.00 0.00 0.00 178.15 178.20 3h1k h GLY 100 N -0.55 -0.10 -0.54 5.37 0.00 0.50 -1.79 103.07 105.96 3h1k h GLY 100 Ca -0.04 0.31 0.05 0.00 0.00 0.00 0.00 47.33 47.66 3h1k h GLY 100 CO 0.04 -0.20 -0.39 -0.09 0.00 0.00 0.00 176.54 175.90 3h1k h ARG 101 N -0.21 -0.09 -0.46 4.80 1.12 -0.63 0.72 114.38 119.64 3h1k h ARG 101 Ca 0.17 0.01 0.13 0.00 -1.11 0.00 0.00 59.98 59.18 3h1k h ARG 101 Cb 0.47 0.02 -0.02 0.00 -0.01 0.00 0.00 29.97 30.43 3h1k h ARG 101 CO -0.46 -0.06 0.47 0.78 -3.11 0.00 0.00 179.97 177.60 3h1k h GLY 102 N -0.09 0.00 0.25 2.80 0.00 -0.79 0.38 103.07 105.62 3h1k h GLY 102 Ca 0.09 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.40 3h1k h GLY 102 CO -0.56 0.00 -0.09 -2.00 0.00 0.00 0.00 176.54 173.90 3h1k h LEU 103 N 0.00 0.07 0.00 3.11 5.85 0.10 0.11 115.31 124.56 3h1k h LEU 103 Ca 0.22 -0.83 0.00 0.00 0.84 0.00 0.00 57.88 58.11 3h1k h LEU 103 Cb 1.16 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.17 3h1k h LEU 103 CO -0.00 0.89 0.00 0.00 -0.34 0.00 0.00 178.44 178.99 3h1k n TYR 104 N -4.62 0.00 -1.19 1.25 9.36 0.50 -2.42 117.16 120.04 3h1k n TYR 104 Ca -0.10 0.00 0.02 0.00 3.32 0.00 0.00 57.90 61.15 3h1k n TYR 104 Cb 0.44 -0.30 0.03 0.00 -0.63 0.00 0.00 39.34 38.89 3h1k n TYR 104 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 3h1k n TYR 105 N -1.30 0.00 -2.72 2.98 4.02 -0.50 -2.50 117.16 117.14 3h1k n TYR 105 Ca 0.05 -0.31 -0.17 0.00 -0.01 0.00 0.00 57.90 57.47 3h1k n TYR 105 Cb 0.10 -0.06 -0.00 0.00 -0.02 0.00 0.00 39.34 39.36 3h1k n TYR 105 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3h1k n GLY 106 N -0.41 -0.50 0.29 2.72 0.00 -0.76 -4.13 105.19 102.41 3h1k n GLY 106 Ca 0.04 0.04 0.16 0.00 0.00 0.00 0.00 46.02 46.25 3h1k n GLY 106 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3h1k h SER 107 N -0.39 0.00 0.00 1.61 0.02 -1.09 -0.61 113.55 113.09 3h1k h SER 107 Ca -0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 3h1k h SER 107 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 3h1k h SER 107 CO 0.43 0.04 0.00 0.00 -1.14 0.00 0.00 176.83 176.17 3h1k n TYR 108 N -3.54 0.00 1.44 3.45 0.18 -1.22 -0.38 117.16 117.08 3h1k n TYR 108 Ca -0.02 0.00 0.14 0.00 1.88 0.00 0.00 57.90 59.90 3h1k n TYR 108 Cb 0.15 0.00 0.57 0.00 -0.38 0.00 0.00 39.34 39.68 3h1k n TYR 108 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 3h1k n LEU 109 N -0.79 0.74 -2.24 -3.48 4.77 -0.24 -3.37 117.00 112.39 3h1k n LEU 109 Ca 0.03 -0.14 -0.24 0.00 -0.03 0.00 0.00 56.01 55.62 3h1k n LEU 109 Cb 0.01 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 3h1k n LEU 109 CO 0.02 0.13 1.41 -1.22 -1.33 0.00 0.00 177.39 176.41 3h1k n TYR 110 N -0.69 1.83 0.00 -1.77 4.01 0.49 -4.89 117.16 116.13 3h1k n TYR 110 Ca 0.16 -2.09 0.00 0.00 -0.16 0.00 0.00 57.90 55.80 3h1k n TYR 110 Cb 0.29 -1.20 0.00 0.00 -0.31 0.00 0.00 39.34 38.12 3h1k n TYR 110 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 3h1k n LYS 111 N 0.38 0.00 0.11 -0.72 5.02 -1.22 -0.25 118.16 121.49 3h1k n LYS 111 Ca 0.43 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.63 3h1k n LYS 111 Cb 0.56 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 35.52 3h1k n LYS 111 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3h1k h GLU 112 N 0.00 -0.42 -1.23 1.97 3.07 -1.92 0.73 114.58 116.77 3h1k h GLU 112 Ca 0.00 0.03 0.45 0.00 -0.50 0.00 0.00 59.36 59.34 3h1k h GLU 112 Cb 0.00 0.10 -0.15 0.00 -0.84 0.00 0.00 28.75 27.85 3h1k h GLU 112 CO 0.00 -0.28 0.75 1.15 -1.40 0.00 0.00 179.01 179.23 3h1k h THR 113 N -0.44 0.01 0.33 1.13 2.02 -0.90 0.46 112.91 115.52 3h1k h THR 113 Ca -0.02 -0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.14 3h1k h THR 113 Cb 0.40 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.81 3h1k h THR 113 CO -0.07 0.00 -0.16 -0.25 0.37 0.00 0.00 175.52 175.42 3h1k h TRP 114 N 0.01 -0.41 -0.82 3.16 2.91 -0.84 -2.19 115.95 117.78 3h1k h TRP 114 Ca 0.87 -0.01 0.18 0.00 1.13 0.00 0.00 58.89 61.05 3h1k h TRP 114 Cb 2.60 0.13 -0.11 0.00 -0.51 0.00 0.00 29.16 31.27 3h1k h TRP 114 CO -0.01 -0.25 0.33 -0.91 -1.03 0.00 0.00 178.44 176.57 3h1k h ASN 115 N -0.70 0.27 -0.43 2.65 2.35 1.00 0.84 115.58 121.57 3h1k h ASN 115 Ca -0.04 0.13 0.04 0.00 -0.55 0.00 0.00 56.30 55.87 3h1k h ASN 115 Cb 0.34 0.12 -0.04 0.00 0.05 0.00 0.00 38.32 38.79 3h1k h ASN 115 CO 0.07 0.05 0.21 0.71 -1.65 0.00 0.00 177.43 176.82 3h1k h THR 116 N 0.41 0.96 -0.09 2.81 1.35 -1.09 -0.66 112.91 116.60 3h1k h THR 116 Ca 0.48 -0.14 0.02 0.00 -0.55 0.00 0.00 66.41 66.21 3h1k h THR 116 Cb 0.81 0.51 -0.04 0.00 -1.73 0.00 0.00 68.15 67.70 3h1k h THR 116 CO -0.47 0.08 -0.32 1.23 -0.25 0.00 0.00 175.52 175.79 3h1k h GLY 117 N 0.42 -1.30 -0.95 5.82 0.00 0.12 0.17 103.07 107.35 3h1k h GLY 117 Ca 0.18 0.69 0.16 0.00 0.00 0.00 0.00 47.33 48.36 3h1k h GLY 117 CO -0.13 -0.36 -0.35 -2.08 0.00 0.00 0.00 176.54 173.61 3h1k h VAL 118 N -0.34 0.02 0.16 4.60 2.07 -0.16 0.32 116.25 122.92 3h1k h VAL 118 Ca 0.02 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.56 3h1k h VAL 118 Cb 0.40 0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 30.14 3h1k h VAL 118 CO -0.26 0.00 -0.36 0.40 0.02 0.00 0.00 177.57 177.37 3h1k h ILE 119 N -0.01 0.25 -0.91 4.57 2.04 -0.10 0.63 117.51 123.97 3h1k h ILE 119 Ca 0.37 0.00 0.22 0.00 1.00 0.00 0.00 64.86 66.45 3h1k h ILE 119 Cb 0.62 0.25 -0.17 0.00 -0.74 0.00 0.00 36.82 36.78 3h1k h ILE 119 CO -0.98 0.00 -0.04 -0.07 0.00 0.00 0.00 178.15 177.06 3h1k h LEU 120 N -0.62 -0.54 0.39 1.44 3.38 0.25 0.40 115.31 120.02 3h1k h LEU 120 Ca 0.02 0.26 -0.02 0.00 0.09 0.00 0.00 57.88 58.23 3h1k h LEU 120 Cb 0.63 0.47 -0.00 0.00 0.09 0.00 0.00 40.66 41.85 3h1k h LEU 120 CO -0.19 -0.29 -0.22 0.25 0.09 0.00 0.00 178.44 178.08 3h1k h LEU 121 N 0.04 -0.54 -0.66 1.67 5.85 0.40 0.42 115.31 122.49 3h1k h LEU 121 Ca 0.51 0.03 0.13 0.00 0.84 0.00 0.00 57.88 59.39 3h1k h LEU 121 Cb 0.96 0.15 -0.13 0.00 0.37 0.00 0.00 40.66 42.02 3h1k h LEU 121 CO -0.86 -0.36 -0.20 -0.07 -0.34 0.00 0.00 178.44 176.61 3h1k h LEU 122 N -0.58 -0.72 -0.09 2.25 3.38 0.18 0.41 115.31 120.14 3h1k h LEU 122 Ca -0.05 0.21 0.02 0.00 0.09 0.00 0.00 57.88 58.15 3h1k h LEU 122 Cb 0.46 0.45 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 3h1k h LEU 122 CO 0.06 -0.24 -0.01 0.74 0.09 0.00 0.00 178.44 179.08 3h1k h THR 123 N -0.03 0.92 -0.35 0.22 2.02 -0.36 0.45 112.91 115.79 3h1k h THR 123 Ca 0.31 -0.01 0.06 0.00 0.77 0.00 0.00 66.41 67.54 3h1k h THR 123 Cb 0.51 0.90 -0.05 0.00 -1.74 0.00 0.00 68.15 67.77 3h1k h THR 123 CO -0.69 0.00 0.03 0.25 0.37 0.00 0.00 175.52 175.48 3h1k h LEU 124 N 0.02 -0.07 0.26 2.58 5.85 0.85 0.41 115.31 125.21 3h1k h LEU 124 Ca 0.04 0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.84 3h1k h LEU 124 Cb 0.06 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 3h1k h LEU 124 CO -0.08 -0.00 -0.36 0.24 -0.34 0.00 0.00 178.44 177.90 3h1k h MET 125 N 0.14 -0.66 -0.32 1.25 2.86 0.23 -1.07 114.93 117.37 3h1k h MET 125 Ca 0.17 0.04 0.06 0.00 -2.06 0.00 0.00 59.70 57.91 3h1k h MET 125 Cb 0.21 0.15 -0.06 0.00 0.06 0.00 0.00 31.60 31.96 3h1k h MET 125 CO -0.25 -0.44 -0.06 0.00 1.06 0.00 0.00 176.91 177.22 3h1k h ALA 126 N -0.17 0.23 -0.54 6.32 0.00 -0.53 -2.19 119.26 122.38 3h1k h ALA 126 Ca -0.00 0.12 0.10 0.00 0.00 0.00 0.00 54.91 55.12 3h1k h ALA 126 Cb 0.65 0.22 -0.11 0.00 0.00 0.00 0.00 17.79 18.55 3h1k h ALA 126 CO -0.12 -0.45 -0.32 1.15 0.00 0.00 0.00 179.25 179.51 3h1k h THR 127 N 0.02 0.20 0.27 0.00 2.02 0.38 -1.35 112.91 114.45 3h1k h THR 127 Ca 0.15 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.34 3h1k h THR 127 Cb 0.23 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 66.82 3h1k h THR 127 CO -0.31 0.00 -0.26 0.00 0.37 0.00 0.00 175.52 175.32 3h1k h ALA 128 N 0.97 -0.55 -0.95 6.16 0.00 -0.85 -1.94 119.26 122.09 3h1k h ALA 128 Ca 0.22 -0.08 0.38 0.00 0.00 0.00 0.00 54.91 55.42 3h1k h ALA 128 Cb 0.54 0.37 -0.17 0.00 0.00 0.00 0.00 17.79 18.53 3h1k h ALA 128 CO -0.63 -0.84 0.43 0.34 0.00 0.00 0.00 179.25 178.55 3h1k n PHE 129 N -5.38 1.03 0.02 0.00 7.35 -0.55 0.68 117.46 120.60 3h1k n PHE 129 Ca -0.09 1.13 -0.18 0.00 -0.76 0.00 0.00 57.45 57.55 3h1k n PHE 129 Cb 0.29 -1.48 -0.14 0.00 0.35 0.00 0.00 39.48 38.51 3h1k n PHE 129 CO 0.00 0.00 0.00 -0.39 -0.76 0.00 0.00 176.76 175.61 3h1k h VAL 130 N 0.00 1.56 -0.46 -2.13 -1.51 -1.16 -3.21 116.25 109.33 3h1k h VAL 130 Ca 0.77 -2.39 0.13 0.00 -1.23 0.00 0.00 66.70 63.98 3h1k h VAL 130 Cb 1.98 3.12 -0.02 0.00 -2.13 0.00 0.00 31.29 34.25 3h1k h VAL 130 CO -0.76 0.67 0.41 1.23 -1.23 0.00 0.00 177.57 177.89 3h1k h GLY 131 N -0.46 0.00 1.15 5.19 0.00 0.10 0.24 103.07 109.29 3h1k h GLY 131 Ca -0.10 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.06 3h1k h GLY 131 CO 0.11 0.00 -0.45 -1.82 0.00 0.00 0.00 176.54 174.38 3h1k h TYR 132 N 0.00 1.12 -0.36 5.60 3.20 -0.68 -3.12 116.97 122.73 3h1k h TYR 132 Ca 0.22 -0.36 -0.05 0.00 3.14 0.00 0.00 58.73 61.68 3h1k h TYR 132 Cb 1.04 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 39.07 3h1k h TYR 132 CO 0.00 1.19 0.02 0.28 -1.64 0.00 0.00 178.16 178.01 3h1k h VAL 133 N 0.73 1.20 -0.97 1.81 2.07 -1.00 -3.31 116.25 116.78 3h1k h VAL 133 Ca 0.04 -0.77 0.13 0.00 0.82 0.00 0.00 66.70 66.92 3h1k h VAL 133 Cb 1.05 0.90 -0.15 0.00 -1.52 0.00 0.00 31.29 31.58 3h1k h VAL 133 CO 0.11 0.27 -0.42 0.18 0.02 0.00 0.00 177.57 177.72 3h1k n LEU 134 N -4.28 -0.72 0.00 2.57 4.77 -1.16 0.10 117.00 118.28 3h1k n LEU 134 Ca 0.02 1.70 0.01 0.00 -0.03 0.00 0.00 56.01 57.70 3h1k n LEU 134 Cb 0.24 -0.35 0.04 0.00 -2.33 0.00 0.00 43.42 41.02 3h1k n LEU 134 CO 0.39 -1.49 0.42 -0.81 -1.33 0.00 0.00 177.39 174.58 3h1k n PRO 135 N -5.37 0.02 -4.13 3.23 -0.04 -1.25 -4.66 135.00 122.80 3h1k n PRO 135 Ca 0.08 0.27 -0.42 0.00 -0.04 0.00 0.00 63.50 63.39 3h1k n PRO 135 Cb 0.35 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.31 3h1k n PRO 135 CO 0.00 0.00 0.00 1.87 -0.04 0.00 0.00 175.50 177.33 3h1k n TRP 136 N -1.29 -1.29 -3.41 0.54 -0.00 0.29 -3.81 117.44 108.47 3h1k n TRP 136 Ca 0.01 0.17 -0.18 0.00 -0.00 0.00 0.00 57.50 57.49 3h1k n TRP 136 Cb 0.01 -2.67 0.03 0.00 -0.00 0.00 0.00 31.31 28.68 3h1k n TRP 136 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3h1k n GLY 137 N -2.19 2.36 0.37 5.87 0.00 -1.26 -2.57 105.19 107.78 3h1k n GLY 137 Ca -0.16 -2.24 -0.14 0.00 0.00 0.00 0.00 46.02 43.49 3h1k n GLY 137 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3h1k h GLN 138 N 0.00 -0.58 -0.90 1.61 1.08 -0.39 0.82 115.11 116.75 3h1k h GLN 138 Ca -0.25 0.04 0.02 0.00 -1.45 0.00 0.00 58.65 57.01 3h1k h GLN 138 Cb 1.02 0.13 -0.05 0.00 -0.05 0.00 0.00 27.48 28.53 3h1k h GLN 138 CO 0.37 -0.39 0.59 1.98 -0.95 0.00 0.00 178.83 180.44 3h1k h MET 139 N -0.60 1.14 -0.07 1.46 4.05 -1.86 0.15 114.93 119.20 3h1k h MET 139 Ca 0.02 -0.07 0.02 0.00 -0.28 0.00 0.00 59.70 59.40 3h1k h MET 139 Cb 0.63 -0.26 -0.05 0.00 -0.80 0.00 0.00 31.60 31.12 3h1k h MET 139 CO -0.20 0.75 -0.46 0.77 0.23 0.00 0.00 176.91 178.00 3h1k h SER 140 N 1.17 -1.44 0.44 1.39 0.02 -1.63 0.38 113.55 113.88 3h1k h SER 140 Ca 0.35 0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 61.45 3h1k h SER 140 Cb -0.06 0.56 -0.03 0.00 0.14 0.00 0.00 62.40 63.01 3h1k h SER 140 CO -0.10 -0.43 -0.51 0.15 -1.14 0.00 0.00 176.83 174.81 3h1k h PHE 141 N -0.53 -1.42 -0.56 3.45 3.57 -0.26 -2.42 116.94 118.76 3h1k h PHE 141 Ca 0.02 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.50 3h1k h PHE 141 Cb 0.59 0.56 -0.03 0.00 2.79 0.00 0.00 35.95 39.87 3h1k h PHE 141 CO -0.54 -0.66 0.21 -1.49 -2.23 0.00 0.00 178.31 173.60 3h1k h TRP 142 N -0.96 0.83 -0.59 0.41 4.06 -0.87 -1.64 115.95 117.18 3h1k h TRP 142 Ca -0.05 -0.05 0.04 0.00 2.06 0.00 0.00 58.89 60.89 3h1k h TRP 142 Cb 0.85 -0.25 -0.05 0.00 -1.00 0.00 0.00 29.16 28.71 3h1k h TRP 142 CO -0.29 0.65 0.33 0.78 -3.56 0.00 0.00 178.44 176.35 3h1k h GLY 143 N 0.94 0.85 0.15 1.49 0.00 -0.15 0.18 103.07 106.53 3h1k h GLY 143 Ca 0.19 -0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 3h1k h GLY 143 CO -0.01 0.16 -0.24 0.00 0.00 0.00 0.00 176.54 176.45 3h1k h ALA 144 N 1.29 -0.85 -0.60 3.60 0.00 -0.83 -2.34 119.26 119.53 3h1k h ALA 144 Ca 0.25 -0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.21 3h1k h ALA 144 Cb 0.12 0.56 -0.12 0.00 0.00 0.00 0.00 17.79 18.35 3h1k h ALA 144 CO -0.15 -0.89 -0.21 1.79 0.00 0.00 0.00 179.25 179.79 3h1k h THR 145 N -0.41 0.31 0.37 0.00 1.35 -0.86 0.49 112.91 114.15 3h1k h THR 145 Ca -0.02 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.84 3h1k h THR 145 Cb 0.38 0.31 -0.02 0.00 -1.73 0.00 0.00 68.15 67.09 3h1k h THR 145 CO -0.08 0.00 -0.37 0.58 -0.25 0.00 0.00 175.52 175.41 3h1k h VAL 146 N -0.06 0.25 0.25 6.82 2.07 -0.59 -1.37 116.25 123.61 3h1k h VAL 146 Ca 0.28 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.79 3h1k h VAL 146 Cb 0.49 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 3h1k h VAL 146 CO -0.65 0.00 -0.12 0.40 0.02 0.00 0.00 177.57 177.23 3h1k h ILE 147 N -0.75 0.00 -1.42 4.57 1.08 -1.04 -2.88 117.51 117.06 3h1k h ILE 147 Ca -0.03 -0.02 0.43 0.00 -0.39 0.00 0.00 64.86 64.85 3h1k h ILE 147 Cb 0.68 0.00 -0.10 0.00 -3.07 0.00 0.00 36.82 34.33 3h1k h ILE 147 CO -0.06 0.00 0.97 0.71 -0.69 0.00 0.00 178.15 179.08 3h1k h THR 148 N -0.35 0.19 0.00 -0.27 1.35 -1.00 1.37 112.91 114.21 3h1k h THR 148 Ca -0.03 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.80 3h1k h THR 148 Cb 0.26 0.10 0.00 0.00 -1.73 0.00 0.00 68.15 66.78 3h1k h THR 148 CO 0.06 0.02 0.00 -3.20 -0.25 0.00 0.00 175.52 172.14 3h1k n ASN 149 N -4.41 0.18 -0.09 5.36 4.05 -0.52 -2.67 115.26 117.17 3h1k n ASN 149 Ca 0.35 0.55 -0.14 0.00 0.45 0.00 0.00 54.58 55.80 3h1k n ASN 149 Cb 1.48 -0.59 -0.05 0.00 1.23 0.00 0.00 39.78 41.86 3h1k n ASN 149 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 3h1k h LEU 150 N 0.00 0.76 -1.97 1.20 3.38 0.19 -3.12 115.31 115.75 3h1k h LEU 150 Ca 0.00 -0.49 0.41 0.00 0.09 0.00 0.00 57.88 57.89 3h1k h LEU 150 Cb 0.26 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 40.74 3h1k h LEU 150 CO 0.00 1.09 1.04 -0.26 0.09 0.00 0.00 178.44 180.40 3h1k h PHE 151 N 0.44 0.00 0.00 1.13 0.05 -1.64 0.32 116.94 117.24 3h1k h PHE 151 Ca 0.04 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.83 3h1k h PHE 151 Cb 0.90 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.85 3h1k h PHE 151 CO 0.08 0.00 0.00 -1.13 -0.18 0.00 0.00 178.31 177.08 3h1k n SER 152 N -4.05 0.00 0.15 2.17 3.41 -1.18 -2.01 113.62 112.11 3h1k n SER 152 Ca 0.31 -0.27 0.10 0.00 -0.26 0.00 0.00 58.87 58.75 3h1k n SER 152 Cb 1.49 -0.08 0.07 0.00 -0.26 0.00 0.00 64.21 65.42 3h1k n SER 152 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3h1k h ALA 153 N 2.77 0.73 -1.97 7.33 0.00 -0.57 -3.40 119.26 124.16 3h1k h ALA 153 Ca 0.00 -0.11 -0.57 0.00 0.00 0.00 0.00 54.91 54.24 3h1k h ALA 153 Cb 0.03 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 3h1k h ALA 153 CO 0.00 0.13 1.13 0.42 0.00 0.00 0.00 179.25 180.93 3h1k s ILE 154 N -3.23 3.73 0.38 0.00 1.01 -0.85 -4.73 121.20 117.50 3h1k s ILE 154 Ca 0.03 0.80 -0.25 0.00 0.00 0.00 0.00 60.65 61.22 3h1k s ILE 154 Cb 0.07 -3.80 -0.12 0.00 0.01 0.00 0.00 42.46 38.62 3h1k s ILE 154 CO 0.74 -0.39 1.01 -2.65 0.00 0.00 0.00 174.94 173.65 3h1k n PRO 155 N 7.82 1.38 0.00 2.79 -0.02 -1.26 -0.59 135.00 145.12 3h1k n PRO 155 Ca 0.19 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 3h1k n PRO 155 Cb 0.46 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 3h1k n PRO 155 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3h1k n TYR 156 N -0.25 0.00 0.51 6.00 0.53 -1.26 -4.06 117.16 118.64 3h1k n TYR 156 Ca 0.09 0.00 0.06 0.00 -1.02 0.00 0.00 57.90 57.03 3h1k n TYR 156 Cb 0.37 0.00 0.28 0.00 -1.03 0.00 0.00 39.34 38.96 3h1k n TYR 156 CO 0.00 0.00 0.00 0.44 -1.02 0.00 0.00 176.86 176.28 3h1k n ILE 157 N 0.00 0.80 0.00 -0.72 -5.35 -1.26 -3.92 119.36 108.91 3h1k n ILE 157 Ca 0.00 0.20 0.00 0.00 -0.27 0.00 0.00 62.75 62.68 3h1k n ILE 157 Cb 0.00 -1.01 0.00 0.00 -1.74 0.00 0.00 39.64 36.89 3h1k n ILE 157 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3h1k n GLY 158 N -0.32 -2.65 0.24 3.28 0.00 0.24 0.10 105.19 106.08 3h1k n GLY 158 Ca 0.05 0.05 -0.01 0.00 0.00 0.00 0.00 46.02 46.11 3h1k n GLY 158 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3h1k h HIS 159 N 0.00 -0.33 0.62 1.61 3.86 -1.77 -1.00 115.15 118.13 3h1k h HIS 159 Ca 0.00 0.05 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 3h1k h HIS 159 Cb 0.00 0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.70 3h1k h HIS 159 CO 0.10 -0.26 -0.47 1.15 0.86 0.00 0.00 177.93 179.31 3h1k h THR 160 N -0.01 0.00 -1.00 2.45 2.02 -1.69 -2.19 112.91 112.49 3h1k h THR 160 Ca 0.29 0.00 0.22 0.00 0.77 0.00 0.00 66.41 67.69 3h1k h THR 160 Cb 0.44 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.75 3h1k h THR 160 CO -0.62 0.00 0.62 0.25 0.37 0.00 0.00 175.52 176.14 3h1k h LEU 161 N -1.04 0.61 0.41 2.58 5.85 0.11 -2.45 115.31 121.39 3h1k h LEU 161 Ca -0.08 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 3h1k h LEU 161 Cb 0.86 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.88 3h1k h LEU 161 CO 0.02 0.18 -0.20 0.58 -0.34 0.00 0.00 178.44 178.69 3h1k h VAL 162 N 0.57 0.46 0.00 1.05 2.07 -0.91 -0.97 116.25 118.53 3h1k h VAL 162 Ca 0.57 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 67.55 3h1k h VAL 162 Cb 1.16 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.60 3h1k h VAL 162 CO -0.34 0.08 0.00 -0.33 0.02 0.00 0.00 177.57 177.00 3h1k h GLU 163 N -0.93 0.00 0.01 1.57 5.08 -1.18 0.64 114.58 119.77 3h1k h GLU 163 Ca -0.06 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 3h1k h GLU 163 Cb 0.56 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 3h1k h GLU 163 CO 0.09 0.00 -0.14 2.35 -1.00 0.00 0.00 179.01 180.32 3h1k h TRP 164 N 0.00 0.04 -0.55 4.33 7.01 -1.32 -2.55 115.95 122.91 3h1k h TRP 164 Ca 0.00 -0.03 0.07 0.00 2.11 0.00 0.00 58.89 61.04 3h1k h TRP 164 Cb 0.04 -0.00 -0.03 0.00 -2.10 0.00 0.00 29.16 27.06 3h1k h TRP 164 CO 0.00 1.05 0.37 0.00 -2.79 0.00 0.00 178.44 177.07 3h1k h ALA 165 N -0.02 1.90 0.00 2.65 0.00 0.45 -1.85 119.26 122.39 3h1k h ALA 165 Ca -0.03 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.70 3h1k h ALA 165 Cb 1.07 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 3h1k h ALA 165 CO -0.00 -0.00 -0.95 -1.49 0.00 0.00 0.00 179.25 176.81 3h1k h TRP 166 N 0.48 0.00 0.00 0.00 6.55 -1.07 -3.46 115.95 118.45 3h1k h TRP 166 Ca 0.24 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.08 3h1k h TRP 166 Cb 0.34 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.64 3h1k h TRP 166 CO -0.00 0.70 0.00 0.41 -1.05 0.00 0.00 178.44 178.50 3h1k n GLY 167 N 1.33 0.59 0.00 1.49 0.00 -0.70 -3.01 105.19 104.89 3h1k n GLY 167 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 3h1k n GLY 167 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h1k n GLY 168 N -2.82 3.36 0.13 -0.02 0.00 -1.13 -4.91 105.19 99.79 3h1k n GLY 168 Ca 0.00 -0.15 0.04 0.00 0.00 0.00 0.00 46.02 45.91 3h1k n GLY 168 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3h1k n PHE 169 N 0.00 0.00 -3.66 1.61 3.01 -1.26 -4.52 117.46 112.64 3h1k n PHE 169 Ca 0.00 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.37 3h1k n PHE 169 Cb 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.45 3h1k n PHE 169 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 3h1k s SER 170 N -1.24 -0.39 -0.15 4.37 1.04 -1.26 -5.02 113.70 111.04 3h1k s SER 170 Ca 0.05 -0.33 -0.29 0.00 0.48 0.00 0.00 55.95 55.87 3h1k s SER 170 Cb 0.06 0.66 -0.05 0.00 0.10 0.00 0.00 66.02 66.78 3h1k s SER 170 CO 0.21 -1.15 1.90 -0.69 0.98 0.00 0.00 173.24 174.48 3h1k s VAL 171 N -3.80 3.30 0.06 5.02 1.01 -1.26 -4.87 120.40 119.85 3h1k s VAL 171 Ca 0.07 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.38 3h1k s VAL 171 Cb -0.04 -3.31 -0.00 0.00 0.00 0.00 0.00 36.38 33.04 3h1k s VAL 171 CO -0.02 -0.13 0.07 -0.67 0.00 0.00 0.00 175.10 174.35 3h1k n ASP 172 N 9.22 -0.20 -0.40 3.32 -0.08 -1.26 -5.01 116.55 122.14 3h1k n ASP 172 Ca 0.22 -1.35 -0.07 0.00 -1.51 0.00 0.00 54.79 52.08 3h1k n ASP 172 Cb 0.44 0.40 -0.04 0.00 2.34 0.00 0.00 41.12 44.26 3h1k n ASP 172 CO 0.00 0.00 0.00 -3.20 0.12 0.00 0.00 177.20 174.12 3h1k n ASN 173 N -2.31 -0.87 -0.60 1.67 5.15 -1.26 0.78 115.26 117.81 3h1k n ASN 173 Ca 0.01 1.74 0.48 0.00 -0.60 0.00 0.00 54.58 56.21 3h1k n ASN 173 Cb 0.11 -0.30 0.78 0.00 -0.53 0.00 0.00 39.78 39.83 3h1k n ASN 173 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 3h1k h PRO 174 N 0.00 0.01 0.00 1.20 0.13 -1.91 0.17 132.00 131.61 3h1k h PRO 174 Ca 0.24 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.37 3h1k h PRO 174 Cb 0.49 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.61 3h1k h PRO 174 CO -0.95 0.01 -0.11 1.15 -0.23 0.00 0.00 178.00 177.87 3h1k h THR 175 N 0.01 0.00 -0.22 1.56 2.02 0.46 -3.20 112.91 113.55 3h1k h THR 175 Ca 0.87 -0.94 0.02 0.00 0.77 0.00 0.00 66.41 67.13 3h1k h THR 175 Cb 3.34 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 69.72 3h1k h THR 175 CO -0.11 0.00 -0.13 -0.11 0.37 0.00 0.00 175.52 175.54 3h1k n LEU 176 N -4.58 -0.23 -0.24 2.58 7.94 0.52 -0.04 117.00 122.94 3h1k n LEU 176 Ca -0.02 0.92 0.01 0.00 -1.11 0.00 0.00 56.01 55.82 3h1k n LEU 176 Cb 0.06 -0.31 0.09 0.00 0.53 0.00 0.00 43.42 43.78 3h1k n LEU 176 CO 0.02 -0.58 0.74 0.71 -1.11 0.00 0.00 177.39 177.17 3h1k h THR 177 N 0.00 0.31 0.00 1.96 1.35 -1.51 0.23 112.91 115.25 3h1k h THR 177 Ca 0.04 -0.01 -0.06 0.00 -0.55 0.00 0.00 66.41 65.83 3h1k h THR 177 Cb 0.09 0.29 -0.01 0.00 -1.73 0.00 0.00 68.15 66.79 3h1k h THR 177 CO -0.21 0.00 -0.26 0.08 -0.25 0.00 0.00 175.52 174.88 3h1k h ARG 178 N 0.02 0.00 -0.08 4.72 0.11 -0.60 -1.98 114.38 116.57 3h1k h ARG 178 Ca 0.35 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.37 3h1k h ARG 178 Cb 0.55 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.63 3h1k h ARG 178 CO -0.71 0.26 -0.16 0.74 0.10 0.00 0.00 179.97 180.20 3h1k h PHE 179 N 0.00 0.32 -0.36 4.08 -1.00 0.26 -1.87 116.94 118.36 3h1k h PHE 179 Ca -0.00 -0.11 0.08 0.00 2.81 0.00 0.00 57.97 60.74 3h1k h PHE 179 Cb 0.65 -0.06 -0.08 0.00 3.61 0.00 0.00 35.95 40.08 3h1k h PHE 179 CO 0.00 0.76 -0.14 0.35 -1.61 0.00 0.00 178.31 177.67 3h1k h PHE 180 N -0.22 -0.32 -0.43 -0.55 3.04 -0.42 0.58 116.94 118.63 3h1k h PHE 180 Ca 0.00 0.04 0.08 0.00 3.98 0.00 0.00 57.97 62.07 3h1k h PHE 180 Cb 0.74 0.20 -0.07 0.00 2.56 0.00 0.00 35.95 39.37 3h1k h PHE 180 CO 0.11 -0.21 -0.02 0.00 -2.02 0.00 0.00 178.31 176.16 3h1k h ALA 181 N 1.25 0.37 -1.01 2.41 0.00 -1.36 0.89 119.26 121.82 3h1k h ALA 181 Ca 0.18 0.14 0.02 0.00 0.00 0.00 0.00 54.91 55.24 3h1k h ALA 181 Cb 0.34 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.32 3h1k h ALA 181 CO -0.41 -0.41 0.67 1.25 0.00 0.00 0.00 179.25 180.35 3h1k h LEU 182 N 0.08 1.14 -1.13 0.00 6.46 -0.04 -0.68 115.31 121.14 3h1k h LEU 182 Ca 0.21 -0.02 -0.09 0.00 -0.12 0.00 0.00 57.88 57.86 3h1k h LEU 182 Cb 0.31 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 39.95 3h1k h LEU 182 CO -0.38 0.81 -0.41 -0.74 -0.62 0.00 0.00 178.44 177.10 3h1k h HIS 183 N 1.34 0.00 -0.04 1.25 2.76 0.13 -1.48 115.15 119.11 3h1k h HIS 183 Ca 0.38 0.00 -0.20 0.00 -2.20 0.00 0.00 60.37 58.35 3h1k h HIS 183 Cb -0.11 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 28.85 3h1k h HIS 183 CO -0.00 0.41 -0.83 0.35 -1.30 0.00 0.00 177.93 176.56 3h1k h PHE 184 N 0.00 0.54 0.06 5.26 3.57 0.21 -3.38 116.94 123.20 3h1k h PHE 184 Ca -0.00 -0.27 -0.00 0.00 3.53 0.00 0.00 57.97 61.23 3h1k h PHE 184 Cb 0.79 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.46 3h1k h PHE 184 CO 0.00 1.05 -0.03 1.25 -2.23 0.00 0.00 178.31 178.35 3h1k h LEU 185 N 0.24 -0.07 -0.71 0.59 5.85 -0.85 -3.40 115.31 116.96 3h1k h LEU 185 Ca -0.05 0.00 0.24 0.00 0.84 0.00 0.00 57.88 58.91 3h1k h LEU 185 Cb 1.43 0.02 -0.13 0.00 0.37 0.00 0.00 40.66 42.35 3h1k h LEU 185 CO 0.14 0.03 0.16 0.18 -0.34 0.00 0.00 178.44 178.61 3h1k n LEU 186 N -2.66 0.05 -0.23 2.25 4.77 -0.58 -0.03 117.00 120.57 3h1k n LEU 186 Ca -0.01 1.19 0.01 0.00 -0.03 0.00 0.00 56.01 57.17 3h1k n LEU 186 Cb 0.03 -0.49 0.13 0.00 -2.33 0.00 0.00 43.42 40.76 3h1k n LEU 186 CO 0.03 -1.26 1.03 -0.65 -1.33 0.00 0.00 177.39 175.21 3h1k h PRO 187 N 0.00 0.50 -0.44 3.23 0.11 -1.77 0.85 132.00 134.48 3h1k h PRO 187 Ca 0.50 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.56 3h1k h PRO 187 Cb 1.17 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 3h1k h PRO 187 CO -0.62 0.33 0.22 0.74 -0.21 0.00 0.00 178.00 178.47 3h1k h PHE 188 N 0.52 0.63 -0.79 0.65 0.05 -0.68 -0.73 116.94 116.59 3h1k h PHE 188 Ca 0.34 -0.03 0.13 0.00 3.82 0.00 0.00 57.97 62.24 3h1k h PHE 188 Cb 0.39 -0.20 -0.06 0.00 2.00 0.00 0.00 35.95 38.09 3h1k h PHE 188 CO -0.13 0.50 0.52 0.00 -0.18 0.00 0.00 178.31 179.02 3h1k h ALA 189 N 1.07 1.96 0.43 2.45 0.00 -0.99 0.17 119.26 124.35 3h1k h ALA 189 Ca 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 3h1k h ALA 189 Cb 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3h1k h ALA 189 CO -0.02 -0.17 -0.21 0.82 0.00 0.00 0.00 179.25 179.68 3h1k h ILE 190 N 0.55 0.52 -0.91 0.00 2.04 0.21 -1.33 117.51 118.58 3h1k h ILE 190 Ca 0.39 -0.42 0.22 0.00 1.00 0.00 0.00 64.86 66.04 3h1k h ILE 190 Cb 0.72 0.70 -0.12 0.00 -0.74 0.00 0.00 36.82 37.38 3h1k h ILE 190 CO -0.15 0.07 0.43 0.00 0.00 0.00 0.00 178.15 178.51 3h1k h ALA 191 N -0.41 1.48 0.11 1.87 0.00 -0.04 0.34 119.26 122.61 3h1k h ALA 191 Ca -0.06 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3h1k h ALA 191 Cb 0.55 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 3h1k h ALA 191 CO 0.10 -0.30 -0.10 0.78 0.00 0.00 0.00 179.25 179.73 3h1k h GLY 192 N 0.46 -0.74 0.14 0.00 0.00 -0.33 -2.64 103.07 99.95 3h1k h GLY 192 Ca 0.56 0.32 0.16 0.00 0.00 0.00 0.00 47.33 48.38 3h1k h GLY 192 CO -0.50 -0.26 0.41 -2.22 0.00 0.00 0.00 176.54 173.97 3h1k h ILE 193 N -0.20 0.67 -1.03 2.60 2.04 -0.53 0.33 117.51 121.39 3h1k h ILE 193 Ca -0.01 -0.19 0.30 0.00 1.00 0.00 0.00 64.86 65.95 3h1k h ILE 193 Cb 0.17 0.07 -0.04 0.00 -0.74 0.00 0.00 36.82 36.28 3h1k h ILE 193 CO -0.01 0.10 0.75 0.74 0.00 0.00 0.00 178.15 179.74 3h1k h THR 194 N 0.55 0.46 0.00 -0.27 2.02 -0.18 0.80 112.91 116.30 3h1k h THR 194 Ca 0.47 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.65 3h1k h THR 194 Cb 0.72 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 3h1k h THR 194 CO -0.40 0.00 -0.00 0.40 0.37 0.00 0.00 175.52 175.89 3h1k h ILE 195 N 0.00 1.33 -0.82 3.11 1.08 0.02 -1.76 117.51 120.47 3h1k h ILE 195 Ca 0.49 -0.99 0.03 0.00 -0.39 0.00 0.00 64.86 63.99 3h1k h ILE 195 Cb 1.99 2.01 -0.05 0.00 -3.07 0.00 0.00 36.82 37.70 3h1k h ILE 195 CO -0.01 0.26 0.53 0.40 -0.69 0.00 0.00 178.15 178.65 3h1k h ILE 196 N -0.43 1.15 0.28 -0.67 1.08 -0.13 -1.08 117.51 117.71 3h1k h ILE 196 Ca -0.00 -0.36 -0.00 0.00 -0.39 0.00 0.00 64.86 64.11 3h1k h ILE 196 Cb 0.43 0.01 -0.03 0.00 -3.07 0.00 0.00 36.82 34.15 3h1k h ILE 196 CO 0.00 0.19 -0.45 -0.74 -0.69 0.00 0.00 178.15 176.47 3h1k h HIS 197 N 1.05 -1.27 -0.14 1.37 2.76 0.42 -0.71 115.15 118.63 3h1k h HIS 197 Ca 0.32 0.02 0.04 0.00 -2.20 0.00 0.00 60.37 58.55 3h1k h HIS 197 Cb -0.03 0.52 -0.01 0.00 1.55 0.00 0.00 27.41 29.44 3h1k h HIS 197 CO -0.02 -0.55 0.20 -0.07 -1.30 0.00 0.00 177.93 176.19 3h1k h LEU 198 N -0.77 0.00 0.25 0.26 3.38 -0.86 -2.46 115.31 115.11 3h1k h LEU 198 Ca -0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 3h1k h LEU 198 Cb 0.71 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.46 3h1k h LEU 198 CO -0.15 0.00 -0.12 0.74 0.09 0.00 0.00 178.44 179.01 3h1k h THR 199 N 0.00 0.51 -0.39 0.22 2.02 0.12 -2.01 112.91 113.38 3h1k h THR 199 Ca 0.07 -0.92 0.11 0.00 0.77 0.00 0.00 66.41 66.44 3h1k h THR 199 Cb 0.47 0.85 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 3h1k h THR 199 CO -0.00 0.13 0.39 -0.26 0.37 0.00 0.00 175.52 176.15 3h1k h PHE 200 N -0.97 0.00 0.50 3.16 0.04 -0.90 -1.33 116.94 117.45 3h1k h PHE 200 Ca -0.03 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.71 3h1k h PHE 200 Cb 0.47 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.62 3h1k h PHE 200 CO 0.05 0.00 -0.24 1.25 -0.60 0.00 0.00 178.31 178.77 3h1k h LEU 201 N 0.00 -0.57 0.00 1.54 5.85 -1.36 -2.98 115.31 117.79 3h1k h LEU 201 Ca 0.19 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.93 3h1k h LEU 201 Cb 0.97 0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.15 3h1k h LEU 201 CO -0.00 -0.21 0.00 1.41 -0.34 0.00 0.00 178.44 179.30 3h1k n HIS 202 N -4.89 0.00 0.59 1.25 8.25 -0.53 -0.06 115.22 119.83 3h1k n HIS 202 Ca -0.08 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.50 3h1k n HIS 202 Cb 0.27 0.00 0.15 0.00 1.12 0.00 0.00 29.99 31.53 3h1k n HIS 202 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 3h1k n GLU 203 N -0.68 0.28 0.00 -0.41 -0.58 -1.02 -4.48 120.64 113.75 3h1k n GLU 203 Ca 0.00 0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.81 3h1k n GLU 203 Cb 0.00 -1.66 0.00 0.00 -0.57 0.00 0.00 31.44 29.21 3h1k n GLU 203 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 3h1k n SER 204 N -2.07 0.92 0.00 1.62 3.41 0.91 -5.13 113.62 113.29 3h1k n SER 204 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 3h1k n SER 204 Cb 0.43 0.15 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 3h1k n SER 204 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h1k n GLY 205 N 0.63 -0.36 3.77 5.00 0.00 -0.40 -4.95 105.19 108.88 3h1k n GLY 205 Ca 0.00 -1.74 -0.37 0.00 0.00 0.00 0.00 46.02 43.91 3h1k n GLY 205 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3h1k s SER 206 N -2.56 6.22 0.34 1.61 0.01 -1.26 -4.89 113.70 113.17 3h1k s SER 206 Ca 0.00 2.35 -0.18 0.00 1.31 0.00 0.00 55.95 59.43 3h1k s SER 206 Cb 0.00 -2.61 -0.10 0.00 0.21 0.00 0.00 66.02 63.53 3h1k s SER 206 CO 0.00 -0.89 0.81 0.21 0.41 0.00 0.00 173.24 173.78 3h1k s ASN 207 N -1.26 6.89 0.10 2.44 3.04 -1.26 -4.76 114.94 120.12 3h1k s ASN 207 Ca 0.62 1.45 0.09 0.00 0.04 0.00 0.00 52.86 55.06 3h1k s ASN 207 Cb -0.30 -2.44 -0.04 0.00 -1.54 0.00 0.00 41.25 36.93 3h1k s ASN 207 CO 0.37 -0.22 -0.21 0.54 -3.04 0.00 0.00 177.10 174.54 3h1k s ASN 208 N -2.14 3.66 0.39 -4.21 2.20 -1.26 -4.92 114.94 108.67 3h1k s ASN 208 Ca 0.55 -0.58 0.31 0.00 -0.94 0.00 0.00 52.86 52.19 3h1k s ASN 208 Cb -0.11 -0.45 1.29 0.00 -2.00 0.00 0.00 41.25 39.98 3h1k s ASN 208 CO 0.17 0.20 1.29 -0.81 -2.94 0.00 0.00 177.10 175.01 3h1k n PRO 209 N 1.06 -0.02 0.12 3.55 -0.04 -1.26 0.18 135.00 138.59 3h1k n PRO 209 Ca -0.16 1.00 0.00 0.00 -0.04 0.00 0.00 63.50 64.29 3h1k n PRO 209 Cb 0.53 -2.05 0.01 0.00 -0.04 0.00 0.00 33.50 31.94 3h1k n PRO 209 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3h1k h LEU 210 N 0.00 0.00 -0.71 1.53 3.38 -1.95 -3.43 115.31 114.13 3h1k h LEU 210 Ca 0.74 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.64 3h1k h LEU 210 Cb 2.57 0.00 0.02 0.00 0.09 0.00 0.00 40.66 43.33 3h1k h LEU 210 CO -0.28 0.62 -0.11 0.61 0.09 0.00 0.00 178.44 179.37 3h1k n GLY 211 N 1.19 0.62 3.06 0.83 0.00 0.13 -4.63 105.19 106.39 3h1k n GLY 211 Ca 0.01 -0.56 -0.11 0.00 0.00 0.00 0.00 46.02 45.36 3h1k n GLY 211 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3h1k s ILE 212 N -2.90 0.05 -0.20 -0.61 -4.36 -1.26 -4.62 121.20 107.30 3h1k s ILE 212 Ca 0.08 -0.43 -0.19 0.00 -0.26 0.00 0.00 60.65 59.86 3h1k s ILE 212 Cb -0.04 -0.33 -0.08 0.00 1.25 0.00 0.00 42.46 43.26 3h1k s ILE 212 CO 0.10 -0.23 0.66 -0.24 0.24 0.00 0.00 174.94 175.47 3h1k n SER 213 N 2.09 0.46 0.08 4.36 2.88 -1.26 -4.83 113.62 117.40 3h1k n SER 213 Ca -0.19 0.45 0.12 0.00 -1.33 0.00 0.00 58.87 57.92 3h1k n SER 213 Cb 0.57 -0.35 0.09 0.00 -0.75 0.00 0.00 64.21 63.77 3h1k n SER 213 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 3h1k h SER 214 N 2.17 0.00 -1.51 -3.46 0.02 -1.93 -3.37 113.55 105.47 3h1k h SER 214 Ca -0.16 -0.15 0.46 0.00 -0.84 0.00 0.00 61.79 61.10 3h1k h SER 214 Cb 0.55 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 62.99 3h1k h SER 214 CO 0.39 0.08 1.04 0.44 -1.14 0.00 0.00 176.83 177.64 3h1k h ASP 215 N 0.00 0.13 0.32 3.07 3.45 -2.00 0.86 116.42 122.25 3h1k h ASP 215 Ca 0.00 0.06 0.00 0.00 0.43 0.00 0.00 57.03 57.52 3h1k h ASP 215 Cb 0.84 0.06 0.00 0.00 -0.56 0.00 0.00 39.33 39.67 3h1k h ASP 215 CO 0.00 -0.08 0.00 -1.54 -1.57 0.00 0.00 179.24 176.05 3h1k n SER 216 N -4.35 0.59 -2.84 6.45 3.41 -1.26 -4.34 113.62 111.28 3h1k n SER 216 Ca 0.37 0.71 -0.00 0.00 -0.26 0.00 0.00 58.87 59.69 3h1k n SER 216 Cb 1.57 -0.81 0.01 0.00 -0.26 0.00 0.00 64.21 64.72 3h1k n SER 216 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3h1k s ASP 217 N -4.09 -0.71 0.07 4.04 3.68 0.30 -5.16 116.67 114.80 3h1k s ASP 217 Ca 0.01 -0.52 0.07 0.00 2.13 0.00 0.00 52.55 54.24 3h1k s ASP 217 Cb 0.07 0.91 -0.04 0.00 -1.45 0.00 0.00 42.92 42.42 3h1k s ASP 217 CO 0.28 -0.06 -0.14 -0.54 0.13 0.00 0.00 175.17 174.84 3h1k s LYS 218 N 1.59 2.11 0.26 4.34 1.02 -1.22 -3.27 119.74 124.56 3h1k s LYS 218 Ca 0.19 -0.99 0.11 0.00 0.02 0.00 0.00 55.97 55.29 3h1k s LYS 218 Cb 0.03 -2.26 -0.05 0.00 -0.52 0.00 0.00 37.83 35.04 3h1k s LYS 218 CO -0.11 0.53 -0.12 0.96 -0.92 0.00 0.00 175.35 175.68 3h1k s ILE 219 N -1.06 2.89 -0.05 2.17 -4.36 0.30 -4.85 121.20 116.23 3h1k s ILE 219 Ca 0.18 -2.12 -0.30 0.00 -0.26 0.00 0.00 60.65 58.15 3h1k s ILE 219 Cb -0.11 -2.51 -0.03 0.00 1.25 0.00 0.00 42.46 41.06 3h1k s ILE 219 CO 0.09 -0.33 1.23 -2.16 0.24 0.00 0.00 174.94 174.01 3h1k s PRO 220 N -3.42 4.34 0.40 0.37 0.04 -1.26 0.24 135.00 135.71 3h1k s PRO 220 Ca 0.29 1.72 0.29 0.00 0.04 0.00 0.00 61.00 63.34 3h1k s PRO 220 Cb -0.06 -3.57 1.37 0.00 0.04 0.00 0.00 34.50 32.28 3h1k s PRO 220 CO 0.16 -0.48 1.44 0.34 0.04 0.00 0.00 177.00 178.50 3h1k n PHE 221 N 5.30 0.67 -4.79 0.56 7.35 -0.43 -3.81 117.46 122.30 3h1k n PHE 221 Ca 0.11 0.67 -0.33 0.00 -0.76 0.00 0.00 57.45 57.15 3h1k n PHE 221 Cb 0.46 -1.10 -0.14 0.00 0.35 0.00 0.00 39.48 39.05 3h1k n PHE 221 CO 0.00 0.00 0.00 -1.58 -0.76 0.00 0.00 176.76 174.42 3h1k s HIS 222 N -5.13 2.79 -1.33 -5.13 2.46 -1.22 -0.18 115.29 107.55 3h1k s HIS 222 Ca -0.07 -0.42 0.26 0.00 0.47 0.00 0.00 55.06 55.30 3h1k s HIS 222 Cb 0.29 -1.77 0.68 0.00 -0.13 0.00 0.00 32.58 31.65 3h1k s HIS 222 CO 0.75 -0.03 1.53 -0.35 -2.47 0.00 0.00 174.74 174.17 3h1k n PRO 223 N 3.03 0.36 -0.02 2.88 -0.04 -1.26 -4.95 135.00 135.00 3h1k n PRO 223 Ca -0.18 -0.20 -0.01 0.00 -0.04 0.00 0.00 63.50 63.08 3h1k n PRO 223 Cb 0.53 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.48 3h1k n PRO 223 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 3h1k h TYR 224 N 0.49 -0.12 0.00 0.54 0.99 -1.65 0.84 116.97 118.05 3h1k h TYR 224 Ca 0.00 0.01 -0.04 0.00 2.00 0.00 0.00 58.73 60.70 3h1k h TYR 224 Cb 0.49 0.06 -0.01 0.00 1.00 0.00 0.00 36.73 38.28 3h1k h TYR 224 CO 0.00 -0.03 -0.51 1.88 -0.00 0.00 0.00 178.16 179.50 3h1k h TYR 225 N -0.01 0.00 -0.20 4.88 -1.99 -0.78 -1.90 116.97 116.97 3h1k h TYR 225 Ca 0.01 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.70 3h1k h TYR 225 Cb 0.03 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.75 3h1k h TYR 225 CO -0.83 0.17 -0.03 0.66 -0.00 0.00 0.00 178.16 178.13 3h1k h SER 226 N 0.00 0.37 0.25 3.88 4.64 -0.92 0.38 113.55 122.15 3h1k h SER 226 Ca -0.02 -0.35 -0.01 0.00 -0.47 0.00 0.00 61.79 60.94 3h1k h SER 226 Cb 1.15 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 3h1k h SER 226 CO 0.02 0.63 -0.12 -0.26 -0.87 0.00 0.00 176.83 176.23 3h1k h PHE 227 N 0.11 -0.32 -0.46 4.77 0.04 -0.88 -1.71 116.94 118.50 3h1k h PHE 227 Ca 0.05 -0.01 0.09 0.00 2.80 0.00 0.00 57.97 60.91 3h1k h PHE 227 Cb 0.46 0.10 -0.09 0.00 2.20 0.00 0.00 35.95 38.62 3h1k h PHE 227 CO 0.05 -0.09 -0.12 -0.22 -0.60 0.00 0.00 178.31 177.32 3h1k h LYS 228 N -0.49 -0.00 -0.33 1.51 3.64 -1.29 -2.13 116.57 117.47 3h1k h LYS 228 Ca -0.03 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.42 3h1k h LYS 228 Cb 0.36 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.11 3h1k h LYS 228 CO 0.06 -0.00 -0.17 -0.44 -2.27 0.00 0.00 179.45 176.63 3h1k h ASP 229 N -0.00 -0.56 -0.68 4.20 3.45 -0.00 0.12 116.42 122.94 3h1k h ASP 229 Ca 0.22 0.13 -0.01 0.00 0.43 0.00 0.00 57.03 57.80 3h1k h ASP 229 Cb 0.34 0.30 -0.03 0.00 -0.56 0.00 0.00 39.33 39.38 3h1k h ASP 229 CO -0.48 -0.20 0.39 0.40 -1.57 0.00 0.00 179.24 177.77 3h1k h ILE 230 N -0.12 1.20 0.59 0.35 2.04 -0.76 0.83 117.51 121.65 3h1k h ILE 230 Ca 0.17 -0.50 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 3h1k h ILE 230 Cb 0.37 0.26 0.01 0.00 -0.74 0.00 0.00 36.82 36.72 3h1k h ILE 230 CO -0.40 0.22 -0.28 0.25 0.00 0.00 0.00 178.15 177.94 3h1k h LEU 231 N 0.96 -0.67 -0.91 1.44 5.85 -0.71 -1.86 115.31 119.41 3h1k h LEU 231 Ca 0.25 -0.01 0.25 0.00 0.84 0.00 0.00 57.88 59.21 3h1k h LEU 231 Cb 0.01 0.17 -0.14 0.00 0.37 0.00 0.00 40.66 41.07 3h1k h LEU 231 CO -0.04 -0.42 0.30 1.23 -0.34 0.00 0.00 178.44 179.17 3h1k h GLY 232 N -0.87 1.51 0.44 3.75 0.00 -0.11 0.86 103.07 108.65 3h1k h GLY 232 Ca -0.08 -0.07 0.01 0.00 0.00 0.00 0.00 47.33 47.19 3h1k h GLY 232 CO 0.13 -0.40 -0.36 -2.00 0.00 0.00 0.00 176.54 173.92 3h1k h LEU 233 N 0.23 -1.02 -1.18 3.11 5.85 -0.25 -2.82 115.31 119.23 3h1k h LEU 233 Ca 0.59 0.11 0.01 0.00 0.84 0.00 0.00 57.88 59.43 3h1k h LEU 233 Cb 1.23 0.37 -0.04 0.00 0.37 0.00 0.00 40.66 42.59 3h1k h LEU 233 CO -0.65 -0.46 0.56 0.71 -0.34 0.00 0.00 178.44 178.26 3h1k h THR 234 N -0.63 1.20 0.00 1.05 1.35 -0.11 0.37 112.91 116.15 3h1k h THR 234 Ca 0.01 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 3h1k h THR 234 Cb 0.63 -0.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.03 3h1k h THR 234 CO -0.17 0.21 0.00 0.18 -0.25 0.00 0.00 175.52 175.48 3h1k n LEU 235 N -4.42 0.00 -0.00 3.87 4.77 -0.39 -2.30 117.00 118.53 3h1k n LEU 235 Ca 0.10 0.30 -0.04 0.00 -0.03 0.00 0.00 56.01 56.35 3h1k n LEU 235 Cb 0.04 -0.30 -0.01 0.00 -2.33 0.00 0.00 43.42 40.82 3h1k n LEU 235 CO 0.36 -0.18 -0.27 0.23 -1.33 0.00 0.00 177.39 176.21 3h1k n MET 236 N -1.30 0.20 -0.49 3.23 2.81 -0.49 -4.61 117.12 116.47 3h1k n MET 236 Ca 0.06 0.08 0.40 0.00 -1.81 0.00 0.00 57.70 56.43 3h1k n MET 236 Cb 0.11 -0.85 0.65 0.00 -0.71 0.00 0.00 33.22 32.42 3h1k n MET 236 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 3h1k n LEU 237 N -3.85 0.14 0.18 4.03 7.94 0.12 -1.14 117.00 124.42 3h1k n LEU 237 Ca -0.06 1.17 -0.10 0.00 -1.11 0.00 0.00 56.01 55.92 3h1k n LEU 237 Cb 0.21 -0.58 -0.05 0.00 0.53 0.00 0.00 43.42 43.53 3h1k n LEU 237 CO 0.08 -1.25 0.51 0.74 -1.11 0.00 0.00 177.39 176.36 3h1k h THR 238 N 0.00 0.00 -0.92 1.96 2.02 -1.69 0.16 112.91 114.44 3h1k h THR 238 Ca 0.82 0.00 0.05 0.00 0.77 0.00 0.00 66.41 68.05 3h1k h THR 238 Cb 2.83 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 69.18 3h1k h THR 238 CO -0.32 0.00 0.59 -0.65 0.37 0.00 0.00 175.52 175.51 3h1k h PRO 239 N -0.56 1.06 -0.48 6.66 0.11 -1.41 1.18 132.00 138.56 3h1k h PRO 239 Ca -0.04 -0.06 0.10 0.00 0.11 0.00 0.00 66.00 66.10 3h1k h PRO 239 Cb 0.47 -0.24 -0.10 0.00 0.11 0.00 0.00 31.00 31.25 3h1k h PRO 239 CO -0.00 0.70 -0.16 0.35 -0.21 0.00 0.00 178.00 178.68 3h1k h PHE 240 N 1.09 -0.37 -0.14 0.65 -0.00 -1.32 0.55 116.94 117.41 3h1k h PHE 240 Ca 0.39 0.05 -0.15 0.00 -0.00 0.00 0.00 57.97 58.25 3h1k h PHE 240 Cb 0.11 0.24 0.01 0.00 -0.00 0.00 0.00 35.95 36.30 3h1k h PHE 240 CO -0.02 -0.25 -0.50 -0.07 -0.00 0.00 0.00 178.31 177.48 3h1k h LEU 241 N -0.05 0.69 -0.88 0.59 3.38 0.30 -2.36 115.31 116.98 3h1k h LEU 241 Ca 0.23 -0.61 0.18 0.00 0.09 0.00 0.00 57.88 57.77 3h1k h LEU 241 Cb 0.40 -0.20 -0.11 0.00 0.09 0.00 0.00 40.66 40.84 3h1k h LEU 241 CO -0.52 1.18 0.44 0.74 0.09 0.00 0.00 178.44 180.36 3h1k h THR 242 N 0.24 0.63 0.16 0.22 2.02 0.28 0.45 112.91 116.90 3h1k h THR 242 Ca -0.02 -0.19 -0.21 0.00 0.77 0.00 0.00 66.41 66.76 3h1k h THR 242 Cb 1.13 0.03 0.02 0.00 -1.74 0.00 0.00 68.15 67.59 3h1k h THR 242 CO 0.11 0.10 -0.93 0.17 0.37 0.00 0.00 175.52 175.33 3h1k h LEU 243 N 0.55 0.55 0.00 2.58 8.10 -0.00 -2.69 115.31 124.39 3h1k h LEU 243 Ca 0.51 -0.94 0.00 0.00 0.11 0.00 0.00 57.88 57.56 3h1k h LEU 243 Cb 0.84 -0.18 0.00 0.00 -0.44 0.00 0.00 40.66 40.88 3h1k h LEU 243 CO -0.43 1.45 0.00 0.00 -4.11 0.00 0.00 178.44 175.35 3h1k n ALA 244 N -2.68 2.18 0.00 0.17 0.00 -0.77 0.74 120.51 120.15 3h1k n ALA 244 Ca -0.14 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.18 3h1k n ALA 244 Cb 0.87 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.99 3h1k n ALA 244 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3h1k n LEU 245 N -1.11 0.00 0.00 0.00 4.77 0.15 -4.54 117.00 116.27 3h1k n LEU 245 Ca 0.13 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.86 3h1k n LEU 245 Cb 0.10 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3h1k n LEU 245 CO 0.13 0.00 -0.44 0.49 -1.33 0.00 0.00 177.39 176.24 3h1k n PHE 246 N -1.16 0.00 -2.81 -1.77 3.01 -1.01 -4.84 117.46 108.87 3h1k n PHE 246 Ca 0.00 0.00 -0.00 0.00 1.01 0.00 0.00 57.45 58.46 3h1k n PHE 246 Cb 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 39.48 39.52 3h1k n PHE 246 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 3h1k n SER 247 N -1.48 1.62 0.00 4.37 2.88 0.23 -5.02 113.62 116.22 3h1k n SER 247 Ca 0.00 -2.06 0.00 0.00 -1.33 0.00 0.00 58.87 55.48 3h1k n SER 247 Cb 0.13 -0.47 0.00 0.00 -0.75 0.00 0.00 64.21 63.12 3h1k n SER 247 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 3h1k n PRO 248 N -0.56 0.00 -0.12 -1.46 -0.02 -0.68 0.10 135.00 132.26 3h1k n PRO 248 Ca 0.08 0.00 0.04 0.00 -2.02 0.00 0.00 63.50 61.60 3h1k n PRO 248 Cb 0.82 0.00 0.11 0.00 -0.02 0.00 0.00 33.50 34.40 3h1k n PRO 248 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3h1k n ASN 249 N -2.23 1.29 -0.25 2.55 3.02 -1.26 -4.32 115.26 114.05 3h1k n ASN 249 Ca 0.00 -2.00 0.06 0.00 -0.03 0.00 0.00 54.58 52.61 3h1k n ASN 249 Cb 0.00 -0.16 0.18 0.00 -0.61 0.00 0.00 39.78 39.18 3h1k n ASN 249 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3h1k h LEU 250 N 1.39 -0.18 0.12 3.41 5.85 0.36 -2.87 115.31 123.39 3h1k h LEU 250 Ca 0.00 0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 3h1k h LEU 250 Cb 0.32 0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.63 3h1k h LEU 250 CO 0.00 -0.12 -0.06 -0.07 -0.34 0.00 0.00 178.44 177.85 3h1k h LEU 251 N 0.17 -0.14 -9.56 2.25 3.38 -1.79 -3.46 115.31 106.16 3h1k h LEU 251 Ca 0.42 -0.39 -0.53 0.00 0.09 0.00 0.00 57.88 57.47 3h1k h LEU 251 Cb 0.75 0.03 0.03 0.00 0.09 0.00 0.00 40.66 41.57 3h1k h LEU 251 CO -0.60 0.48 0.87 -0.83 0.09 0.00 0.00 178.44 178.46 3h1k s GLY 252 N -3.46 1.64 0.66 0.83 0.00 -1.09 -4.90 107.32 101.00 3h1k s GLY 252 Ca -0.11 1.28 -0.17 0.00 0.00 0.00 0.00 44.72 45.72 3h1k s GLY 252 CO 0.43 2.63 1.21 -0.35 0.00 0.00 0.00 173.10 177.02 3h1k s ASP 253 N 1.41 4.73 0.09 1.64 -1.08 -1.26 -4.90 116.67 117.30 3h1k s ASP 253 Ca 0.70 2.37 -0.01 0.00 -0.52 0.00 0.00 52.55 55.09 3h1k s ASP 253 Cb -0.41 -2.59 -0.25 0.00 -1.46 0.00 0.00 42.92 38.20 3h1k s ASP 253 CO 0.31 -1.90 1.19 1.55 0.52 0.00 0.00 175.17 176.84 3h1k h PRO 254 N 0.32 0.19 0.00 4.34 0.13 -1.95 -3.32 132.00 131.72 3h1k h PRO 254 Ca -0.49 -0.32 0.00 0.00 -0.87 0.00 0.00 66.00 64.32 3h1k h PRO 254 Cb 1.30 0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.55 3h1k h PRO 254 CO 0.53 1.15 0.31 0.39 -0.23 0.00 0.00 178.00 180.14 3h1k n GLU 255 N -3.49 0.01 -0.67 0.86 -0.58 -1.26 0.17 120.64 115.68 3h1k n GLU 255 Ca -0.06 0.26 0.06 0.00 -0.42 0.00 0.00 57.16 57.00 3h1k n GLU 255 Cb 0.99 -1.84 0.32 0.00 -0.57 0.00 0.00 31.44 30.33 3h1k n GLU 255 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 3h1k n ASN 256 N -1.33 4.59 -0.42 1.62 5.15 -1.25 -2.66 115.26 120.96 3h1k n ASN 256 Ca -0.00 -2.66 0.04 0.00 -0.60 0.00 0.00 54.58 51.37 3h1k n ASN 256 Cb 0.31 -0.62 0.11 0.00 -0.53 0.00 0.00 39.78 39.06 3h1k n ASN 256 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 3h1k n PHE 257 N 0.58 0.34 -4.02 1.20 3.01 0.44 -4.69 117.46 114.32 3h1k n PHE 257 Ca 0.22 -0.58 -0.31 0.00 1.01 0.00 0.00 57.45 57.79 3h1k n PHE 257 Cb 0.95 -0.08 -0.15 0.00 -0.01 0.00 0.00 39.48 40.19 3h1k n PHE 257 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 3h1k s THR 258 N -1.34 1.91 -0.08 4.37 2.01 -1.20 -5.04 115.64 116.27 3h1k s THR 258 Ca 0.18 -1.49 -0.40 0.00 0.31 0.00 0.00 61.69 60.30 3h1k s THR 258 Cb 0.12 -2.09 -0.19 0.00 0.01 0.00 0.00 72.50 70.35 3h1k s THR 258 CO 0.09 -0.07 1.31 -2.65 -0.69 0.00 0.00 174.62 172.60 3h1k n PRO 259 N 4.52 0.47 -1.44 4.92 -0.02 -1.26 -0.25 135.00 141.94 3h1k n PRO 259 Ca -0.13 0.17 -0.44 0.00 -2.02 0.00 0.00 63.50 61.09 3h1k n PRO 259 Cb 0.43 -1.73 -0.01 0.00 -0.02 0.00 0.00 33.50 32.17 3h1k n PRO 259 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3h1k n ALA 260 N 2.62 -1.88 -3.40 3.55 0.00 -1.06 -4.51 120.51 115.83 3h1k n ALA 260 Ca 0.22 0.25 -0.16 0.00 0.00 0.00 0.00 53.44 53.75 3h1k n ALA 260 Cb 0.10 -1.72 -0.10 0.00 0.00 0.00 0.00 19.45 17.73 3h1k n ALA 260 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3h1k s ASN 261 N -0.91 1.46 0.43 0.00 2.47 -1.26 -4.91 114.94 112.23 3h1k s ASN 261 Ca 0.62 -0.62 0.25 0.00 0.42 0.00 0.00 52.86 53.53 3h1k s ASN 261 Cb -0.70 0.58 1.34 0.00 -1.45 0.00 0.00 41.25 41.02 3h1k s ASN 261 CO 0.59 -0.38 1.73 -0.65 -3.72 0.00 0.00 177.10 174.67 3h1k h PRO 262 N 8.25 0.00 0.15 0.43 0.11 -1.98 -2.44 132.00 136.53 3h1k h PRO 262 Ca -0.14 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.69 3h1k h PRO 262 Cb 1.09 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.21 3h1k h PRO 262 CO 0.32 0.00 -1.29 -0.07 -0.21 0.00 0.00 178.00 176.75 3h1k h LEU 263 N 0.00 0.49 -8.79 2.35 3.38 -2.02 -3.45 115.31 107.27 3h1k h LEU 263 Ca 0.00 -0.53 -0.68 0.00 0.09 0.00 0.00 57.88 56.77 3h1k h LEU 263 Cb 0.25 -0.16 -0.25 0.00 0.09 0.00 0.00 40.66 40.60 3h1k h LEU 263 CO 0.00 1.41 -0.76 -0.69 0.09 0.00 0.00 178.44 178.49 3h1k s VAL 264 N -2.65 3.10 -0.14 1.22 1.01 -0.92 -5.12 120.40 116.91 3h1k s VAL 264 Ca -0.05 -0.68 -0.07 0.00 0.00 0.00 0.00 61.98 61.18 3h1k s VAL 264 Cb 0.07 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 3h1k s VAL 264 CO 0.89 0.56 0.11 -0.89 0.00 0.00 0.00 175.10 175.77 3h1k s THR 265 N -0.26 5.21 0.64 3.92 2.01 -1.26 -4.71 115.64 121.19 3h1k s THR 265 Ca 0.02 0.10 -0.17 0.00 0.31 0.00 0.00 61.69 61.95 3h1k s THR 265 Cb -0.13 -3.29 -0.01 0.00 0.01 0.00 0.00 72.50 69.08 3h1k s THR 265 CO 0.03 0.56 1.21 -2.84 -0.69 0.00 0.00 174.62 172.89 3h1k s PRO 266 N -0.53 2.66 0.17 4.92 0.02 -1.26 -4.91 135.00 136.07 3h1k s PRO 266 Ca 0.12 1.81 -0.25 0.00 0.02 0.00 0.00 61.00 62.69 3h1k s PRO 266 Cb -0.12 -1.89 0.04 0.00 0.02 0.00 0.00 34.50 32.56 3h1k s PRO 266 CO 0.02 -1.44 1.57 -1.35 -0.33 0.00 0.00 177.00 175.47 3h1k h PRO 267 N 0.44 -0.23 -4.65 5.54 0.11 -2.03 -3.40 132.00 127.78 3h1k h PRO 267 Ca -0.49 0.02 -0.49 0.00 0.11 0.00 0.00 66.00 65.14 3h1k h PRO 267 Cb 1.30 0.05 -0.32 0.00 0.11 0.00 0.00 31.00 32.14 3h1k h PRO 267 CO 0.53 -0.15 -0.81 -3.38 -0.21 0.00 0.00 178.00 173.98 3h1k s HIS 268 N -5.87 1.29 -0.35 0.65 -3.43 -1.26 -5.10 115.29 101.21 3h1k s HIS 268 Ca -0.14 -0.41 -0.09 0.00 -0.80 0.00 0.00 55.06 53.62 3h1k s HIS 268 Cb 0.13 -0.93 0.03 0.00 -1.43 0.00 0.00 32.58 30.39 3h1k s HIS 268 CO 0.67 -0.20 0.15 0.42 -2.00 0.00 0.00 174.74 173.78 3h1k s ILE 269 N 0.43 4.17 -0.08 -5.38 1.01 -1.26 -5.05 121.20 115.04 3h1k s ILE 269 Ca -0.09 -0.98 -0.05 0.00 0.00 0.00 0.00 60.65 59.53 3h1k s ILE 269 Cb -0.13 -3.34 0.03 0.00 0.01 0.00 0.00 42.46 39.04 3h1k s ILE 269 CO 0.02 -0.19 0.19 -1.59 0.00 0.00 0.00 174.94 173.37 3h1k s LYS 270 N 1.48 0.18 0.14 2.79 -2.85 -1.26 -5.10 119.74 115.12 3h1k s LYS 270 Ca 0.00 0.35 -0.02 0.00 -1.00 0.00 0.00 55.97 55.30 3h1k s LYS 270 Cb -0.19 -0.02 0.04 0.00 -2.06 0.00 0.00 37.83 35.60 3h1k s LYS 270 CO 0.05 -0.09 0.12 -0.35 0.10 0.00 0.00 175.35 175.18 3h1k n PRO 271 N 3.56 -1.36 -2.83 1.78 -0.04 -1.26 -4.99 135.00 129.86 3h1k n PRO 271 Ca -0.19 -0.19 -0.33 0.00 -0.04 0.00 0.00 63.50 62.75 3h1k n PRO 271 Cb 0.56 -0.19 -0.07 0.00 -0.04 0.00 0.00 33.50 33.76 3h1k n PRO 271 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3h1k s GLU 272 N -3.27 4.21 0.24 0.54 0.41 -1.26 -4.85 118.70 114.71 3h1k s GLU 272 Ca 0.08 1.09 -0.02 0.00 -0.41 0.00 0.00 54.97 55.71 3h1k s GLU 272 Cb -0.01 -2.19 0.50 0.00 -1.78 0.00 0.00 34.13 30.65 3h1k s GLU 272 CO 0.06 -0.03 1.24 -2.67 -0.49 0.00 0.00 175.26 173.38 3h1k n TRP 273 N -0.65 0.41 0.09 1.61 4.27 -1.26 -0.52 117.44 121.39 3h1k n TRP 273 Ca 0.07 0.96 0.01 0.00 -3.89 0.00 0.00 57.50 54.65 3h1k n TRP 273 Cb 0.54 -1.04 0.05 0.00 -1.36 0.00 0.00 31.31 29.50 3h1k n TRP 273 CO 0.00 0.00 0.00 2.48 -2.29 0.00 0.00 177.69 177.88 3h1k n TYR 274 N -5.20 0.00 0.15 -2.67 0.18 -1.26 -0.64 117.16 107.72 3h1k n TYR 274 Ca 0.16 0.00 0.02 0.00 1.88 0.00 0.00 57.90 59.96 3h1k n TYR 274 Cb 0.52 -0.26 -0.02 0.00 -0.38 0.00 0.00 39.34 39.19 3h1k n TYR 274 CO 0.00 0.00 0.00 1.19 -2.08 0.00 0.00 176.86 175.97 3h1k n PHE 275 N -1.26 0.00 -0.03 -3.48 0.99 0.32 -4.76 117.46 109.24 3h1k n PHE 275 Ca 0.01 0.00 -0.12 0.00 -0.00 0.00 0.00 57.45 57.34 3h1k n PHE 275 Cb 0.01 -0.02 -0.06 0.00 -1.00 0.00 0.00 39.48 38.42 3h1k n PHE 275 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.76 176.69 3h1k h LEU 276 N 0.00 -1.40 -0.93 4.37 3.38 -0.75 0.11 115.31 120.09 3h1k h LEU 276 Ca 0.00 0.19 0.26 0.00 0.09 0.00 0.00 57.88 58.42 3h1k h LEU 276 Cb 0.11 0.58 -0.14 0.00 0.09 0.00 0.00 40.66 41.29 3h1k h LEU 276 CO 0.00 -0.42 0.39 2.19 0.09 0.00 0.00 178.44 180.69 3h1k h PHE 277 N -0.46 0.62 -0.16 1.13 -5.15 -1.74 0.16 116.94 111.33 3h1k h PHE 277 Ca 0.08 0.04 -0.08 0.00 -0.20 0.00 0.00 57.97 57.82 3h1k h PHE 277 Cb 0.62 -0.12 -0.00 0.00 0.22 0.00 0.00 35.95 36.67 3h1k h PHE 277 CO -0.53 -0.16 -0.22 0.00 -2.00 0.00 0.00 178.31 175.39 3h1k h ALA 278 N 1.79 0.24 -0.36 12.09 0.00 -1.49 -2.75 119.26 128.78 3h1k h ALA 278 Ca 0.62 -0.37 0.07 0.00 0.00 0.00 0.00 54.91 55.23 3h1k h ALA 278 Cb 1.30 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.97 3h1k h ALA 278 CO -0.61 0.19 -0.09 -0.92 0.00 0.00 0.00 179.25 177.81 3h1k h TYR 279 N 0.05 -0.20 -0.99 0.00 3.20 0.17 0.11 116.97 119.31 3h1k h TYR 279 Ca 0.02 0.03 0.11 0.00 3.14 0.00 0.00 58.73 62.03 3h1k h TYR 279 Cb 0.79 0.14 -0.08 0.00 1.54 0.00 0.00 36.73 39.12 3h1k h TYR 279 CO 0.09 -0.16 0.63 0.00 -1.64 0.00 0.00 178.16 177.08 3h1k h ALA 280 N 1.36 1.53 -0.06 1.82 0.00 -0.79 -0.73 119.26 122.39 3h1k h ALA 280 Ca 0.17 0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.91 3h1k h ALA 280 Cb 0.27 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 3h1k h ALA 280 CO -0.37 0.23 -0.77 0.82 0.00 0.00 0.00 179.25 179.16 3h1k h ILE 281 N 0.99 1.38 0.25 0.00 2.04 -0.87 -2.48 117.51 118.83 3h1k h ILE 281 Ca 0.48 -2.20 -0.01 0.00 1.00 0.00 0.00 64.86 64.14 3h1k h ILE 281 Cb 0.46 2.17 -0.00 0.00 -0.74 0.00 0.00 36.82 38.71 3h1k h ILE 281 CO -0.25 0.66 -0.15 0.25 0.00 0.00 0.00 178.15 178.66 3h1k h LEU 282 N 0.27 -0.38 0.00 1.44 5.85 0.58 -2.82 115.31 120.24 3h1k h LEU 282 Ca -0.04 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.71 3h1k h LEU 282 Cb 1.35 0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.50 3h1k h LEU 282 CO 0.13 -0.25 0.00 0.54 -0.34 0.00 0.00 178.44 178.52 3h1k n ARG 283 N -5.27 0.02 -0.22 1.25 1.74 -0.61 -3.10 116.66 110.47 3h1k n ARG 283 Ca -0.09 0.13 -0.09 0.00 -0.77 0.00 0.00 57.85 57.03 3h1k n ARG 283 Cb 0.19 -1.50 0.03 0.00 -1.02 0.00 0.00 32.46 30.16 3h1k n ARG 283 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3h1k h SER 284 N 0.00 1.06 -3.44 0.55 4.64 -1.17 -3.40 113.55 111.79 3h1k h SER 284 Ca 0.00 -0.30 -0.61 0.00 -0.47 0.00 0.00 61.79 60.41 3h1k h SER 284 Cb 0.35 -0.29 -0.11 0.00 -0.31 0.00 0.00 62.40 62.05 3h1k h SER 284 CO 0.00 1.11 0.30 -0.63 -0.87 0.00 0.00 176.83 176.74 3h1k s ILE 285 N -5.04 4.87 -0.85 0.95 1.01 -1.18 -4.77 121.20 116.18 3h1k s ILE 285 Ca -0.12 1.16 -0.21 0.00 0.00 0.00 0.00 60.65 61.48 3h1k s ILE 285 Cb 0.14 -4.06 0.10 0.00 0.01 0.00 0.00 42.46 38.64 3h1k s ILE 285 CO 0.86 -0.14 1.13 -2.16 0.00 0.00 0.00 174.94 174.63 3h1k s PRO 286 N 2.77 3.43 0.00 2.79 0.04 -1.26 -4.26 135.00 138.50 3h1k s PRO 286 Ca 0.30 -1.32 0.00 0.00 0.04 0.00 0.00 61.00 60.01 3h1k s PRO 286 Cb -0.15 -4.75 0.00 0.00 0.04 0.00 0.00 34.50 29.65 3h1k s PRO 286 CO 0.11 -1.87 0.00 -1.71 0.04 0.00 0.00 177.00 173.57 3h1k n ASN 287 N 7.36 0.00 -0.05 6.66 2.85 -1.26 -4.99 115.26 125.83 3h1k n ASN 287 Ca 0.16 0.00 -0.00 0.00 -0.11 0.00 0.00 54.58 54.63 3h1k n ASN 287 Cb 0.48 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.51 3h1k n ASN 287 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 3h1k n LYS 288 N 0.00 -0.03 0.05 1.20 5.02 -1.26 0.10 118.16 123.23 3h1k n LYS 288 Ca 0.00 0.21 -0.11 0.00 -2.02 0.00 0.00 58.31 56.38 3h1k n LYS 288 Cb 0.00 -0.31 -0.06 0.00 -0.02 0.00 0.00 35.03 34.65 3h1k n LYS 288 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 3h1k h LEU 289 N 0.00 -0.16 0.31 -0.35 5.85 -1.89 -0.38 115.31 118.69 3h1k h LEU 289 Ca 0.04 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 3h1k h LEU 289 Cb 0.08 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.17 3h1k h LEU 289 CO -0.13 -0.08 -0.18 1.23 -0.34 0.00 0.00 178.44 178.94 3h1k h GLY 290 N -0.10 -0.47 0.68 3.75 0.00 0.32 -1.34 103.07 105.90 3h1k h GLY 290 Ca 0.02 0.19 0.15 0.00 0.00 0.00 0.00 47.33 47.70 3h1k h GLY 290 CO -0.06 -0.18 0.50 -1.33 0.00 0.00 0.00 176.54 175.47 3h1k h GLY 291 N -0.46 0.64 0.77 4.60 0.00 -1.22 0.25 103.07 107.66 3h1k h GLY 291 Ca -0.04 -0.16 -0.02 0.00 0.00 0.00 0.00 47.33 47.11 3h1k h GLY 291 CO 0.05 0.05 -0.21 -2.08 0.00 0.00 0.00 176.54 174.34 3h1k h VAL 292 N 0.37 0.51 -0.14 4.60 2.07 -0.66 -0.40 116.25 122.60 3h1k h VAL 292 Ca 0.37 -0.38 0.05 0.00 0.82 0.00 0.00 66.70 67.56 3h1k h VAL 292 Cb 0.89 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 31.27 3h1k h VAL 292 CO -0.11 0.06 -0.32 -0.07 0.02 0.00 0.00 177.57 177.16 3h1k h LEU 293 N -0.84 -0.98 -0.64 2.57 3.38 0.04 0.19 115.31 119.02 3h1k h LEU 293 Ca -0.06 0.15 0.13 0.00 0.09 0.00 0.00 57.88 58.19 3h1k h LEU 293 Cb 0.56 0.42 -0.10 0.00 0.09 0.00 0.00 40.66 41.63 3h1k h LEU 293 CO 0.10 -0.35 0.05 0.00 0.09 0.00 0.00 178.44 178.33 3h1k h ALA 294 N 0.45 0.69 0.51 1.53 0.00 -0.54 0.26 119.26 122.16 3h1k h ALA 294 Ca 0.10 0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 3h1k h ALA 294 Cb 0.54 0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 3h1k h ALA 294 CO -0.36 -0.37 -0.44 1.25 0.00 0.00 0.00 179.25 179.33 3h1k h LEU 295 N 0.16 -1.19 0.00 0.00 5.85 0.25 0.77 115.31 121.16 3h1k h LEU 295 Ca 0.34 0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.15 3h1k h LEU 295 Cb 0.56 0.38 0.00 0.00 0.37 0.00 0.00 40.66 41.97 3h1k h LEU 295 CO -0.51 -0.62 0.00 0.00 -0.34 0.00 0.00 178.44 176.97 3h1k n ALA 296 N -2.73 -0.10 -0.23 1.25 0.00 0.53 -0.94 120.51 118.29 3h1k n ALA 296 Ca -0.12 0.00 0.30 0.00 0.00 0.00 0.00 53.44 53.63 3h1k n ALA 296 Cb 0.43 0.29 0.72 0.00 0.00 0.00 0.00 19.45 20.89 3h1k n ALA 296 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h1k h ALA 297 N -1.55 2.90 -0.63 0.00 0.00 -0.55 0.36 119.26 119.80 3h1k h ALA 297 Ca 0.00 -0.03 0.18 0.00 0.00 0.00 0.00 54.91 55.06 3h1k h ALA 297 Cb 0.00 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3h1k h ALA 297 CO 0.00 -1.19 0.46 0.66 0.00 0.00 0.00 179.25 179.18 3h1k h SER 298 N 0.03 0.00 0.00 0.00 4.64 0.24 0.30 113.55 118.76 3h1k h SER 298 Ca 0.48 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.63 3h1k h SER 298 Cb 1.87 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.93 3h1k h SER 298 CO -0.02 0.00 -1.63 0.52 -0.87 0.00 0.00 176.83 174.83 3h1k n VAL 299 N -4.33 0.63 -0.07 0.95 0.31 0.92 -4.55 118.33 112.19 3h1k n VAL 299 Ca 0.12 -0.29 0.05 0.00 -0.01 0.00 0.00 64.34 64.21 3h1k n VAL 299 Cb 0.71 -0.85 0.39 0.00 -0.91 0.00 0.00 33.84 33.18 3h1k n VAL 299 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3h1k h LEU 300 N 0.00 0.55 -0.91 7.52 3.38 -0.30 -2.79 115.31 122.76 3h1k h LEU 300 Ca -0.25 -0.01 0.30 0.00 0.09 0.00 0.00 57.88 58.01 3h1k h LEU 300 Cb 1.44 -0.13 -0.17 0.00 0.09 0.00 0.00 40.66 41.89 3h1k h LEU 300 CO -0.02 0.39 0.18 0.00 0.09 0.00 0.00 178.44 179.08 3h1k n ILE 301 N -4.47 -0.38 -0.25 1.22 0.13 0.10 -1.27 119.36 114.45 3h1k n ILE 301 Ca 0.06 1.95 0.05 0.00 -1.10 0.00 0.00 62.75 63.71 3h1k n ILE 301 Cb 0.12 -2.95 0.12 0.00 -0.84 0.00 0.00 39.64 36.08 3h1k n ILE 301 CO 0.00 0.00 0.00 0.18 2.80 0.00 0.00 176.55 179.53 3h1k n LEU 302 N -5.24 -0.21 -0.19 9.51 4.77 -1.05 0.85 117.00 125.43 3h1k n LEU 302 Ca 0.26 1.18 0.27 0.00 -0.03 0.00 0.00 56.01 57.69 3h1k n LEU 302 Cb 0.87 -0.37 0.68 0.00 -2.33 0.00 0.00 43.42 42.27 3h1k n LEU 302 CO -0.04 -1.14 1.25 -0.26 -1.33 0.00 0.00 177.39 175.87 3h1k h PHE 303 N 0.00 0.11 -0.07 -1.77 0.05 -1.44 -1.10 116.94 112.72 3h1k h PHE 303 Ca 0.35 0.00 -0.24 0.00 3.82 0.00 0.00 57.97 61.90 3h1k h PHE 303 Cb 0.58 -0.03 0.01 0.00 2.00 0.00 0.00 35.95 38.51 3h1k h PHE 303 CO -0.49 0.02 -0.91 -0.07 -0.18 0.00 0.00 178.31 176.68 3h1k h LEU 304 N 0.08 0.87 -0.21 1.54 3.38 0.25 -3.38 115.31 117.84 3h1k h LEU 304 Ca 0.44 -0.64 0.03 0.00 0.09 0.00 0.00 57.88 57.80 3h1k h LEU 304 Cb 1.62 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 42.07 3h1k h LEU 304 CO -0.04 1.43 -0.09 -0.38 0.09 0.00 0.00 178.44 179.45 3h1k n ILE 305 N -3.88 -0.12 -0.10 1.22 2.08 -0.42 0.47 119.36 118.62 3h1k n ILE 305 Ca -0.09 0.50 -0.05 0.00 0.56 0.00 0.00 62.75 63.67 3h1k n ILE 305 Cb 0.81 -0.65 0.02 0.00 -0.75 0.00 0.00 39.64 39.07 3h1k n ILE 305 CO 0.00 0.00 0.00 -0.65 0.56 0.00 0.00 176.55 176.46 3h1k h PRO 306 N 0.00 0.11 0.00 0.38 0.11 -1.77 0.02 132.00 130.85 3h1k h PRO 306 Ca 0.07 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.17 3h1k h PRO 306 Cb 0.12 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.20 3h1k h PRO 306 CO -0.21 0.07 0.00 1.19 -0.21 0.00 0.00 178.00 178.85 3h1k n PHE 307 N -5.17 0.00 -2.06 0.65 3.72 0.18 -2.85 117.46 111.93 3h1k n PHE 307 Ca 0.02 0.00 -0.19 0.00 -0.05 0.00 0.00 57.45 57.22 3h1k n PHE 307 Cb 0.18 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.76 3h1k n PHE 307 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3h1k n LEU 308 N -0.71 4.42 -4.25 4.37 4.77 -0.01 -4.99 117.00 120.60 3h1k n LEU 308 Ca 0.06 -4.51 -0.33 0.00 -0.03 0.00 0.00 56.01 51.20 3h1k n LEU 308 Cb 0.03 -0.28 -0.15 0.00 -2.33 0.00 0.00 43.42 40.68 3h1k n LEU 308 CO 0.04 1.95 -0.49 -2.28 -1.33 0.00 0.00 177.39 175.28 3h1k s HIS 309 N -3.56 2.76 -0.00 -1.77 2.46 -1.13 -4.44 115.29 109.61 3h1k s HIS 309 Ca 0.48 -1.07 0.00 0.00 0.47 0.00 0.00 55.06 54.94 3h1k s HIS 309 Cb 0.40 -1.88 -0.01 0.00 -0.13 0.00 0.00 32.58 30.97 3h1k s HIS 309 CO 0.02 -0.49 0.01 1.63 -2.47 0.00 0.00 174.74 173.44 3h1k n LYS 310 N 4.04 0.91 -2.00 2.88 4.76 -1.26 -5.05 118.16 122.44 3h1k n LYS 310 Ca -0.19 -0.00 -0.39 0.00 -2.87 0.00 0.00 58.31 54.86 3h1k n LYS 310 Cb 0.52 -0.94 0.00 0.00 -1.84 0.00 0.00 35.03 32.77 3h1k n LYS 310 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 3h1k s SER 311 N -1.91 6.07 0.00 4.39 0.15 -1.26 -4.67 113.70 116.47 3h1k s SER 311 Ca -0.00 2.67 0.25 0.00 0.70 0.00 0.00 55.95 59.57 3h1k s SER 311 Cb 0.00 -2.64 1.21 0.00 -1.71 0.00 0.00 66.02 62.88 3h1k s SER 311 CO 0.01 -1.02 1.83 0.29 1.20 0.00 0.00 173.24 175.56 3h1k n LYS 312 N -0.17 0.26 -4.02 5.44 4.76 -1.26 -4.69 118.16 118.48 3h1k n LYS 312 Ca 0.05 0.06 -0.23 0.00 -2.87 0.00 0.00 58.31 55.32 3h1k n LYS 312 Cb 0.44 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 32.07 3h1k n LYS 312 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 3h1k s GLN 313 N -2.69 2.36 -0.08 1.97 -0.21 -1.26 -5.10 119.66 114.64 3h1k s GLN 313 Ca 0.20 -1.63 -0.08 0.00 0.02 0.00 0.00 55.36 53.87 3h1k s GLN 313 Cb 0.17 -2.16 -0.03 0.00 1.00 0.00 0.00 33.01 31.99 3h1k s GLN 313 CO 0.40 -0.01 -0.16 -2.13 -2.12 0.00 0.00 175.29 171.28 3h1k n ARG 314 N -1.24 0.25 -2.40 2.91 0.63 -1.26 -5.00 116.66 110.54 3h1k n ARG 314 Ca -0.01 0.12 -0.32 0.00 -0.92 0.00 0.00 57.85 56.72 3h1k n ARG 314 Cb 0.62 -0.97 -0.03 0.00 0.45 0.00 0.00 32.46 32.53 3h1k n ARG 314 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3h1k s THR 315 N -1.89 4.42 -1.68 5.15 -4.23 -1.26 -3.93 115.64 112.22 3h1k s THR 315 Ca -0.13 1.20 0.31 0.00 -1.18 0.00 0.00 61.69 61.89 3h1k s THR 315 Cb 0.02 -3.67 0.67 0.00 1.34 0.00 0.00 72.50 70.86 3h1k s THR 315 CO 0.20 -0.62 2.11 0.23 -0.54 0.00 0.00 174.62 175.99 3h1k n MET 316 N -1.52 0.68 -0.31 3.99 2.81 -1.04 -4.13 117.12 117.59 3h1k n MET 316 Ca 0.07 -0.03 0.16 0.00 -1.81 0.00 0.00 57.70 56.09 3h1k n MET 316 Cb 0.54 -1.50 0.33 0.00 -0.71 0.00 0.00 33.22 31.87 3h1k n MET 316 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 3h1k h THR 317 N 0.06 0.22 -0.80 2.03 2.02 -1.83 0.57 112.91 115.19 3h1k h THR 317 Ca 0.00 -0.05 -0.42 0.00 0.77 0.00 0.00 66.41 66.71 3h1k h THR 317 Cb 0.18 0.06 -0.25 0.00 -1.74 0.00 0.00 68.15 66.40 3h1k h THR 317 CO 0.00 0.03 0.43 0.49 0.37 0.00 0.00 175.52 176.83 3h1k n PHE 318 N -5.28 2.47 -3.28 3.16 0.99 -1.26 -4.70 117.46 109.57 3h1k n PHE 318 Ca 0.24 -1.80 -0.24 0.00 -0.00 0.00 0.00 57.45 55.64 3h1k n PHE 318 Cb 0.77 -0.82 -0.08 0.00 -1.00 0.00 0.00 39.48 38.35 3h1k n PHE 318 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 3h1k n ARG 319 N -1.14 0.38 -0.27 -1.08 1.74 0.19 -5.01 116.66 111.48 3h1k n ARG 319 Ca 0.52 -3.09 0.03 0.00 -0.77 0.00 0.00 57.85 54.54 3h1k n ARG 319 Cb 1.46 -1.51 0.10 0.00 -1.02 0.00 0.00 32.46 31.50 3h1k n ARG 319 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3h1k h PRO 320 N 5.03 0.01 0.02 5.56 0.13 -1.84 -1.85 132.00 139.06 3h1k h PRO 320 Ca 0.18 -0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.34 3h1k h PRO 320 Cb 0.91 -0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.99 3h1k h PRO 320 CO 0.38 0.01 -0.39 -0.07 -0.23 0.00 0.00 178.00 177.70 3h1k h LEU 321 N 0.01 -1.18 -0.36 1.56 3.38 -1.94 -2.39 115.31 114.40 3h1k h LEU 321 Ca 0.38 0.14 0.06 0.00 0.09 0.00 0.00 57.88 58.55 3h1k h LEU 321 Cb 0.60 0.46 -0.05 0.00 0.09 0.00 0.00 40.66 41.76 3h1k h LEU 321 CO -0.78 -0.44 0.05 0.28 0.09 0.00 0.00 178.44 177.64 3h1k h SER 322 N -0.56 -0.04 -0.71 -0.43 0.02 -1.70 -2.67 113.55 107.47 3h1k h SER 322 Ca 0.05 0.07 0.07 0.00 -0.84 0.00 0.00 61.79 61.13 3h1k h SER 322 Cb 0.63 0.10 -0.10 0.00 0.14 0.00 0.00 62.40 63.17 3h1k h SER 322 CO -0.29 0.02 -0.56 1.56 -1.14 0.00 0.00 176.83 176.42 3h1k h GLN 323 N 0.16 -0.17 -0.79 3.45 4.20 -0.89 0.45 115.11 121.52 3h1k h GLN 323 Ca 0.17 0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.91 3h1k h GLN 323 Cb 0.21 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.99 3h1k h GLN 323 CO -0.24 -0.11 0.51 1.79 -0.67 0.00 0.00 178.83 180.11 3h1k h THR 324 N -0.18 1.16 -0.89 -0.54 1.35 -1.36 0.13 112.91 112.58 3h1k h THR 324 Ca 0.12 -0.35 0.09 0.00 -0.55 0.00 0.00 66.41 65.71 3h1k h THR 324 Cb 0.48 0.04 -0.06 0.00 -1.73 0.00 0.00 68.15 66.88 3h1k h THR 324 CO -0.76 0.19 0.58 0.25 -0.25 0.00 0.00 175.52 175.53 3h1k h LEU 325 N 1.03 0.82 -0.06 3.87 5.85 -0.68 0.64 115.31 126.79 3h1k h LEU 325 Ca 0.30 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 59.04 3h1k h LEU 325 Cb -0.05 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 40.82 3h1k h LEU 325 CO -0.09 0.49 0.03 0.15 -0.34 0.00 0.00 178.44 178.68 3h1k h PHE 326 N 0.91 0.08 0.00 1.25 3.57 0.23 -1.51 116.94 121.47 3h1k h PHE 326 Ca 0.41 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.84 3h1k h PHE 326 Cb 0.37 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.07 3h1k h PHE 326 CO -0.00 0.15 -0.34 -1.49 -2.23 0.00 0.00 178.31 174.40 3h1k h TRP 327 N -0.01 0.00 -0.48 0.41 4.06 0.40 0.24 115.95 120.57 3h1k h TRP 327 Ca 0.02 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 60.86 3h1k h TRP 327 Cb 0.10 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.24 3h1k h TRP 327 CO -0.04 0.34 -0.15 1.25 -3.56 0.00 0.00 178.44 176.28 3h1k h LEU 328 N 0.00 0.92 0.32 -4.49 5.85 0.47 -1.53 115.31 116.86 3h1k h LEU 328 Ca -0.00 -0.31 -0.02 0.00 0.84 0.00 0.00 57.88 58.39 3h1k h LEU 328 Cb 0.69 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 41.47 3h1k h LEU 328 CO 0.04 1.06 -0.16 0.25 -0.34 0.00 0.00 178.44 179.30 3h1k h LEU 329 N 0.81 -0.37 0.04 2.25 5.85 -0.28 0.19 115.31 123.81 3h1k h LEU 329 Ca 0.12 -0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.75 3h1k h LEU 329 Cb 0.68 0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.76 3h1k h LEU 329 CO 0.05 -0.10 -0.52 0.58 -0.34 0.00 0.00 178.44 178.11 3h1k h VAL 330 N -0.64 0.00 -0.95 1.05 2.07 -0.90 0.30 116.25 117.18 3h1k h VAL 330 Ca -0.04 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.66 3h1k h VAL 330 Cb 0.46 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.14 3h1k h VAL 330 CO 0.07 0.00 0.61 0.00 0.02 0.00 0.00 177.57 178.27 3h1k h ALA 331 N -0.50 1.91 -0.09 1.67 0.00 -1.28 0.70 119.26 121.67 3h1k h ALA 331 Ca 0.00 0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.98 3h1k h ALA 331 Cb 0.72 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 3h1k h ALA 331 CO -0.32 -0.22 0.11 -0.97 0.00 0.00 0.00 179.25 177.85 3h1k h ASN 332 N 0.63 0.00 0.08 0.00 -1.24 0.27 -0.36 115.58 114.96 3h1k h ASN 332 Ca 0.51 0.00 -0.15 0.00 0.71 0.00 0.00 56.30 57.37 3h1k h ASN 332 Cb 0.97 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.02 3h1k h ASN 332 CO -0.27 0.00 -0.73 -0.07 -1.29 0.00 0.00 177.43 175.08 3h1k h LEU 333 N 0.00 0.25 -0.59 0.34 3.38 0.19 -2.90 115.31 115.98 3h1k h LEU 333 Ca 0.04 -0.90 0.10 0.00 0.09 0.00 0.00 57.88 57.22 3h1k h LEU 333 Cb 0.26 -0.08 -0.11 0.00 0.09 0.00 0.00 40.66 40.82 3h1k h LEU 333 CO -0.00 1.33 -0.34 -0.07 0.09 0.00 0.00 178.44 179.45 3h1k h LEU 334 N -0.63 -1.17 0.10 1.67 3.38 -0.40 0.48 115.31 118.74 3h1k h LEU 334 Ca -0.15 0.23 0.02 0.00 0.09 0.00 0.00 57.88 58.07 3h1k h LEU 334 Cb 1.43 0.58 -0.05 0.00 0.09 0.00 0.00 40.66 42.71 3h1k h LEU 334 CO 0.05 -0.31 -0.44 0.40 0.09 0.00 0.00 178.44 178.23 3h1k h ILE 335 N -0.16 0.13 -0.86 1.22 2.04 -1.23 0.21 117.51 118.86 3h1k h ILE 335 Ca 0.23 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.27 3h1k h ILE 335 Cb 0.55 0.13 -0.11 0.00 -0.74 0.00 0.00 36.82 36.65 3h1k h ILE 335 CO -0.68 0.00 0.39 -0.07 0.00 0.00 0.00 178.15 177.79 3h1k h LEU 336 N -0.66 0.38 0.35 1.44 3.38 -0.89 0.66 115.31 119.97 3h1k h LEU 336 Ca 0.02 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 3h1k h LEU 336 Cb 0.69 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 3h1k h LEU 336 CO -0.26 0.09 -0.32 0.74 0.09 0.00 0.00 178.44 178.77 3h1k h THR 337 N 0.48 0.00 -0.52 0.22 2.02 0.11 -1.15 112.91 114.06 3h1k h THR 337 Ca 0.51 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.77 3h1k h THR 337 Cb 0.86 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 67.17 3h1k h THR 337 CO -0.46 0.00 -0.39 -0.25 0.37 0.00 0.00 175.52 174.79 3h1k h TRP 338 N -0.67 -1.13 -0.92 3.16 7.01 0.10 0.55 115.95 124.06 3h1k h TRP 338 Ca -0.04 0.07 0.27 0.00 2.11 0.00 0.00 58.89 61.30 3h1k h TRP 338 Cb 0.57 0.57 -0.04 0.00 -2.10 0.00 0.00 29.16 28.16 3h1k h TRP 338 CO -0.16 -0.41 0.71 0.82 -2.79 0.00 0.00 178.44 176.61 3h1k h ILE 339 N -0.23 0.44 0.00 2.65 1.08 0.44 0.30 117.51 122.19 3h1k h ILE 339 Ca 0.18 0.00 -0.12 0.00 -0.39 0.00 0.00 64.86 64.53 3h1k h ILE 339 Cb 0.56 0.49 -0.02 0.00 -3.07 0.00 0.00 36.82 34.79 3h1k h ILE 339 CO -0.64 0.00 -0.59 1.23 -0.69 0.00 0.00 178.15 177.46 3h1k h GLY 340 N 0.00 0.00 -0.82 5.37 0.00 0.14 -2.97 103.07 104.79 3h1k h GLY 340 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.77 3h1k h GLY 340 CO -0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.40 3h1k n SER 341 N -3.48 1.17 -4.40 0.19 3.41 0.10 -4.81 113.62 105.80 3h1k n SER 341 Ca 0.00 -2.03 -0.25 0.00 -0.26 0.00 0.00 58.87 56.33 3h1k n SER 341 Cb 0.68 -0.18 -0.11 0.00 -0.26 0.00 0.00 64.21 64.33 3h1k n SER 341 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3h1k s GLN 342 N -1.71 1.46 0.56 4.33 -1.52 -1.12 -5.10 119.66 116.56 3h1k s GLN 342 Ca 0.13 -1.51 -0.09 0.00 -1.95 0.00 0.00 55.36 51.93 3h1k s GLN 342 Cb 0.07 -1.69 0.14 0.00 -0.22 0.00 0.00 33.01 31.31 3h1k s GLN 342 CO 0.08 0.36 0.42 -0.35 -0.25 0.00 0.00 175.29 175.55 3h1k n PRO 343 N 0.21 -2.43 -2.49 2.91 -0.04 -1.26 -4.95 135.00 126.94 3h1k n PRO 343 Ca -0.12 -0.69 -0.39 0.00 -0.04 0.00 0.00 63.50 62.26 3h1k n PRO 343 Cb 0.57 -0.73 0.02 0.00 -0.04 0.00 0.00 33.50 33.31 3h1k n PRO 343 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 3h1k n VAL 344 N -3.77 5.03 -4.28 0.52 0.24 -1.26 -4.70 118.33 110.10 3h1k n VAL 344 Ca 0.06 -5.49 -0.19 0.00 -2.04 0.00 0.00 64.34 56.68 3h1k n VAL 344 Cb 0.25 -1.45 -0.11 0.00 -1.47 0.00 0.00 33.84 31.06 3h1k n VAL 344 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 3h1k s GLU 345 N -4.15 1.13 0.60 7.34 2.02 -1.26 -4.88 118.70 119.49 3h1k s GLU 345 Ca 0.44 -1.32 -0.20 0.00 0.02 0.00 0.00 54.97 53.91 3h1k s GLU 345 Cb 0.27 -1.07 -0.03 0.00 0.10 0.00 0.00 34.13 33.40 3h1k s GLU 345 CO -0.21 0.21 1.26 1.58 0.02 0.00 0.00 175.26 178.12 3h1k n HIS 346 N 0.39 1.87 0.06 1.61 -0.00 -1.26 -2.16 115.22 115.72 3h1k n HIS 346 Ca -0.14 0.43 -0.07 0.00 -0.00 0.00 0.00 57.72 57.93 3h1k n HIS 346 Cb 0.57 -2.28 -0.12 0.00 -0.00 0.00 0.00 29.99 28.16 3h1k n HIS 346 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3h1k h PRO 347 N 0.87 0.01 -0.15 1.57 0.13 -1.99 -3.46 132.00 128.97 3h1k h PRO 347 Ca -0.50 -0.01 0.02 0.00 -0.87 0.00 0.00 66.00 64.63 3h1k h PRO 347 Cb 1.33 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.44 3h1k h PRO 347 CO 0.54 0.98 -0.08 1.19 -0.23 0.00 0.00 178.00 180.41 3h1k n PHE 348 N -3.34 -0.04 -0.05 1.56 0.99 -0.92 -0.58 117.46 115.08 3h1k n PHE 348 Ca -0.01 0.19 -0.09 0.00 -0.00 0.00 0.00 57.45 57.54 3h1k n PHE 348 Cb 0.95 -0.53 -0.02 0.00 -1.00 0.00 0.00 39.48 38.88 3h1k n PHE 348 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 3h1k h ILE 349 N 0.00 0.35 -0.57 4.37 2.04 -1.81 1.29 117.51 123.18 3h1k h ILE 349 Ca 0.04 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.86 3h1k h ILE 349 Cb 0.07 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 36.48 3h1k h ILE 349 CO -0.15 0.00 0.21 -0.29 0.00 0.00 0.00 178.15 177.92 3h1k h ILE 350 N -0.28 1.23 -0.76 -0.67 6.09 -1.18 -0.13 117.51 121.82 3h1k h ILE 350 Ca 0.13 -0.74 0.00 0.00 -1.37 0.00 0.00 64.86 62.89 3h1k h ILE 350 Cb 0.48 0.64 -0.04 0.00 0.47 0.00 0.00 36.82 38.38 3h1k h ILE 350 CO -0.39 0.28 0.49 0.40 -3.07 0.00 0.00 178.15 175.86 3h1k h ILE 351 N 0.79 1.20 0.26 2.19 2.04 -0.92 -1.45 117.51 121.63 3h1k h ILE 351 Ca 0.19 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.64 3h1k h ILE 351 Cb 0.23 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.41 3h1k h ILE 351 CO -0.01 0.20 -0.22 1.23 0.00 0.00 0.00 178.15 179.35 3h1k h GLY 352 N 1.04 -0.89 -0.18 5.37 0.00 0.24 -0.90 103.07 107.75 3h1k h GLY 352 Ca 0.28 0.39 0.24 0.00 0.00 0.00 0.00 47.33 48.24 3h1k h GLY 352 CO -0.06 -0.30 0.53 1.46 0.00 0.00 0.00 176.54 178.18 3h1k h GLN 353 N -0.47 0.50 0.88 4.80 4.20 -0.93 -1.92 115.11 122.18 3h1k h GLN 353 Ca -0.03 -0.03 -0.04 0.00 0.06 0.00 0.00 58.65 58.60 3h1k h GLN 353 Cb 0.39 -0.11 0.01 0.00 0.30 0.00 0.00 27.48 28.07 3h1k h GLN 353 CO -0.01 0.33 -0.42 0.52 -0.67 0.00 0.00 178.83 178.58 3h1k h MET 354 N 0.51 -1.14 -0.72 1.46 2.86 -0.99 0.31 114.93 117.23 3h1k h MET 354 Ca 0.62 0.08 0.13 0.00 -2.06 0.00 0.00 59.70 58.47 3h1k h MET 354 Cb 1.20 0.26 -0.13 0.00 0.06 0.00 0.00 31.60 32.98 3h1k h MET 354 CO -0.50 -0.76 -0.32 0.00 1.06 0.00 0.00 176.91 176.39 3h1k h ALA 355 N -1.35 0.11 -0.01 6.32 0.00 -0.43 0.61 119.26 124.50 3h1k h ALA 355 Ca -0.12 0.22 0.02 0.00 0.00 0.00 0.00 54.91 55.02 3h1k h ALA 355 Cb 0.91 0.80 -0.02 0.00 0.00 0.00 0.00 17.79 19.48 3h1k h ALA 355 CO 0.20 -0.61 -0.09 0.77 0.00 0.00 0.00 179.25 179.51 3h1k h SER 356 N -0.10 -0.27 -0.95 0.00 0.02 -1.39 0.14 113.55 111.01 3h1k h SER 356 Ca 0.29 0.04 0.16 0.00 -0.84 0.00 0.00 61.79 61.44 3h1k h SER 356 Cb 0.57 0.12 -0.10 0.00 0.14 0.00 0.00 62.40 63.13 3h1k h SER 356 CO -0.77 -0.13 0.55 0.25 -1.14 0.00 0.00 176.83 175.58 3h1k h LEU 357 N -0.16 0.73 -0.45 5.07 5.85 0.18 -0.19 115.31 126.34 3h1k h LEU 357 Ca 0.04 0.08 -0.17 0.00 0.84 0.00 0.00 57.88 58.67 3h1k h LEU 357 Cb 0.21 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 3h1k h LEU 357 CO -0.10 0.31 -0.76 0.77 -0.34 0.00 0.00 178.44 178.31 3h1k h SER 358 N 0.77 0.20 0.02 1.25 4.64 0.76 -2.60 113.55 118.59 3h1k h SER 358 Ca 0.52 -0.14 0.02 0.00 -0.47 0.00 0.00 61.79 61.71 3h1k h SER 358 Cb 0.71 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 62.71 3h1k h SER 358 CO -0.35 0.89 -0.16 0.22 -0.87 0.00 0.00 176.83 176.56 3h1k h TYR 359 N 0.10 -0.42 -0.16 4.77 3.20 0.11 -0.43 116.97 124.15 3h1k h TYR 359 Ca -0.02 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.82 3h1k h TYR 359 Cb 1.34 0.19 -0.00 0.00 1.54 0.00 0.00 36.73 39.79 3h1k h TYR 359 CO 0.02 -0.24 -0.05 0.74 -1.64 0.00 0.00 178.16 176.99 3h1k h PHE 360 N -0.28 0.36 -0.98 -3.82 -1.00 -1.52 -3.10 116.94 106.60 3h1k h PHE 360 Ca 0.05 -0.08 0.19 0.00 2.81 0.00 0.00 57.97 60.93 3h1k h PHE 360 Cb 0.34 -0.09 -0.11 0.00 3.61 0.00 0.00 35.95 39.70 3h1k h PHE 360 CO -0.21 0.61 0.58 1.15 -1.61 0.00 0.00 178.31 178.83 3h1k h THR 361 N 0.00 0.69 0.74 -1.55 2.02 -1.25 0.25 112.91 113.82 3h1k h THR 361 Ca 0.04 -0.25 -0.04 0.00 0.77 0.00 0.00 66.41 66.93 3h1k h THR 361 Cb 0.50 -0.10 0.01 0.00 -1.74 0.00 0.00 68.15 66.82 3h1k h THR 361 CO 0.02 0.13 -0.35 0.40 0.37 0.00 0.00 175.52 176.09 3h1k h ILE 362 N 0.72 0.00 0.00 3.11 2.04 -1.06 0.27 117.51 122.59 3h1k h ILE 362 Ca 0.57 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 66.25 3h1k h ILE 362 Cb 0.89 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.97 3h1k h ILE 362 CO -0.39 0.00 -0.03 -0.07 0.00 0.00 0.00 178.15 177.66 3h1k h LEU 363 N -1.17 0.00 0.03 1.44 3.38 -1.39 -1.06 115.31 116.56 3h1k h LEU 363 Ca -0.10 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.48 3h1k h LEU 363 Cb 0.76 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.46 3h1k h LEU 363 CO 0.17 0.03 -2.32 0.18 0.09 0.00 0.00 178.44 176.58 3h1k n LEU 364 N -3.39 2.80 -0.02 1.67 4.77 0.84 -4.73 117.00 118.95 3h1k n LEU 364 Ca -0.02 -0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.91 3h1k n LEU 364 Cb 0.14 -0.96 -0.01 0.00 -2.33 0.00 0.00 43.42 40.25 3h1k n LEU 364 CO 0.25 0.88 -0.63 -0.38 -1.33 0.00 0.00 177.39 176.18 3h1k n ILE 365 N -3.41 0.27 0.00 -0.08 5.41 0.88 -4.66 119.36 117.77 3h1k n ILE 365 Ca -0.42 -0.04 0.00 0.00 1.00 0.00 0.00 62.75 63.28 3h1k n ILE 365 Cb 0.99 -1.56 0.00 0.00 -0.71 0.00 0.00 39.64 38.36 3h1k n ILE 365 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 3h1k n LEU 366 N -3.21 0.00 -0.27 1.39 7.99 -0.81 -1.36 117.00 120.72 3h1k n LEU 366 Ca -0.08 0.74 0.03 0.00 -0.01 0.00 0.00 56.01 56.69 3h1k n LEU 366 Cb 0.54 -0.24 0.08 0.00 -0.11 0.00 0.00 43.42 43.69 3h1k n LEU 366 CO 0.01 -0.24 0.48 0.49 -1.51 0.00 0.00 177.39 176.61 3h1k n PHE 367 N -1.34 0.19 -0.03 -1.77 0.99 -0.42 0.65 117.46 115.74 3h1k n PHE 367 Ca 0.00 0.92 -0.08 0.00 -0.00 0.00 0.00 57.45 58.28 3h1k n PHE 367 Cb 0.00 -0.89 0.08 0.00 -1.00 0.00 0.00 39.48 37.68 3h1k n PHE 367 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.76 175.76 3h1k h PRO 368 N 0.00 0.64 0.14 -1.08 0.13 -1.77 -2.42 132.00 127.63 3h1k h PRO 368 Ca 0.33 -0.32 -0.01 0.00 -0.87 0.00 0.00 66.00 65.13 3h1k h PRO 368 Cb 0.51 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.65 3h1k h PRO 368 CO -0.76 0.92 -0.07 1.15 -0.23 0.00 0.00 178.00 179.01 3h1k h THR 369 N 0.53 0.97 -0.24 1.56 2.02 0.15 -2.45 112.91 115.45 3h1k h THR 369 Ca 0.05 -1.16 0.07 0.00 0.77 0.00 0.00 66.41 66.13 3h1k h THR 369 Cb 0.90 1.61 -0.01 0.00 -1.74 0.00 0.00 68.15 68.91 3h1k h THR 369 CO 0.08 0.24 0.24 0.40 0.37 0.00 0.00 175.52 176.86 3h1k h ILE 370 N -0.80 0.50 0.47 3.11 1.08 -0.45 -0.14 117.51 121.28 3h1k h ILE 370 Ca -0.02 0.00 -0.02 0.00 -0.39 0.00 0.00 64.86 64.43 3h1k h ILE 370 Cb 0.54 0.81 0.00 0.00 -3.07 0.00 0.00 36.82 35.10 3h1k h ILE 370 CO 0.03 0.00 -0.23 1.23 -0.69 0.00 0.00 178.15 178.49 3h1k h GLY 371 N 0.00 -0.66 0.27 5.37 0.00 -1.31 0.25 103.07 106.98 3h1k h GLY 371 Ca 0.11 0.25 -0.00 0.00 0.00 0.00 0.00 47.33 47.69 3h1k h GLY 371 CO -0.00 -0.24 -0.47 -0.84 0.00 0.00 0.00 176.54 174.99 3h1k h THR 372 N -0.95 0.00 -1.00 4.70 2.02 -0.66 0.56 112.91 117.58 3h1k h THR 372 Ca -0.07 0.00 0.24 0.00 0.77 0.00 0.00 66.41 67.36 3h1k h THR 372 Cb 0.59 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.88 3h1k h THR 372 CO 0.11 0.00 0.60 0.25 0.37 0.00 0.00 175.52 176.84 3h1k h LEU 373 N -0.79 0.68 0.20 2.58 5.85 -1.15 0.26 115.31 122.95 3h1k h LEU 373 Ca -0.03 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3h1k h LEU 373 Cb 0.73 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 3h1k h LEU 373 CO -0.17 0.12 -0.21 -0.08 -0.34 0.00 0.00 178.44 177.76 3h1k h GLU 374 N 0.59 -0.43 -0.74 1.25 4.81 0.12 -2.79 114.58 117.40 3h1k h GLU 374 Ca 0.64 0.03 0.16 0.00 -0.13 0.00 0.00 59.36 60.06 3h1k h GLU 374 Cb 1.20 0.10 -0.13 0.00 0.63 0.00 0.00 28.75 30.55 3h1k h GLU 374 CO -0.47 -0.28 -0.06 -0.91 -0.73 0.00 0.00 179.01 176.56 3h1k h ASN 375 N -0.44 -0.46 0.29 1.04 2.35 0.16 0.42 115.58 118.94 3h1k h ASN 375 Ca 0.00 0.20 -0.02 0.00 -0.55 0.00 0.00 56.30 55.93 3h1k h ASN 375 Cb 0.42 0.38 -0.00 0.00 0.05 0.00 0.00 38.32 39.17 3h1k h ASN 375 CO -0.06 -0.20 -0.09 0.11 -1.65 0.00 0.00 177.43 175.54 3h1k h LYS 376 N 0.07 0.00 0.00 0.81 1.57 -1.18 -1.38 116.57 116.45 3h1k h LYS 376 Ca 0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 3h1k h LYS 376 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.97 3h1k h LYS 376 CO -0.69 0.09 0.00 0.52 -0.57 0.00 0.00 179.45 178.81 3h1k h MET 377 N 0.00 0.00 0.00 3.15 2.86 -0.72 -0.40 114.93 119.82 3h1k h MET 377 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3h1k h MET 377 Cb 0.26 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.92 3h1k h MET 377 CO 0.01 0.00 -0.34 1.28 1.06 0.00 0.00 176.91 178.92 3h1k n LEU 378 N -3.06 0.58 -0.64 1.22 4.77 -0.55 -4.93 117.00 114.39 3h1k n LEU 378 Ca 0.02 0.32 -0.03 0.00 -0.03 0.00 0.00 56.01 56.29 3h1k n LEU 378 Cb 0.40 -0.28 0.01 0.00 -2.33 0.00 0.00 43.42 41.21 3h1k n LEU 378 CO 0.30 -0.04 0.01 -3.20 -1.33 0.00 0.00 177.39 173.12 3h1k n ASN 379 N -1.94 -2.16 -0.92 -1.43 5.15 -0.16 -5.13 115.26 108.67 3h1k n ASN 379 Ca 0.05 -0.04 0.11 0.00 -0.60 0.00 0.00 54.58 54.10 3h1k n ASN 379 Cb 0.40 -1.04 0.10 0.00 -0.53 0.00 0.00 39.78 38.71 3h1k n ASN 379 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44