#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3eeq h LEU 9 N 0.00 0.81 -0.34 1.04 5.85 -1.99 -3.20 115.31 117.49 3eeq h LEU 9 Ca 0.00 -0.20 -0.18 0.00 0.84 0.00 0.00 57.88 58.34 3eeq h LEU 9 Cb 0.00 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 3eeq h LEU 9 CO 0.00 0.87 -0.84 -0.29 -0.34 0.00 0.00 178.44 177.85 3eeq h ILE 10 N 0.79 1.54 0.00 4.05 2.10 -1.95 -0.49 117.51 123.55 3eeq h ILE 10 Ca 0.15 -2.68 0.00 0.00 1.08 0.00 0.00 64.86 63.41 3eeq h ILE 10 Cb 0.46 2.47 0.00 0.00 -1.09 0.00 0.00 36.82 38.67 3eeq h ILE 10 CO 0.02 0.77 0.00 -0.62 -1.08 0.00 0.00 178.15 177.24 3eeq n GLU 11 N -3.62 0.10 -0.31 2.19 -0.58 -1.21 -2.65 120.64 114.55 3eeq n GLU 11 Ca -0.02 0.40 0.10 0.00 -0.42 0.00 0.00 57.16 57.22 3eeq n GLU 11 Cb 0.79 -1.71 0.27 0.00 -0.57 0.00 0.00 31.44 30.22 3eeq n GLU 11 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3eeq n ASN 12 N -1.89 3.63 -4.03 1.62 3.02 -0.20 -4.63 115.26 112.78 3eeq n ASN 12 Ca 0.02 -2.00 -0.43 0.00 -0.03 0.00 0.00 54.58 52.14 3eeq n ASN 12 Cb 0.15 -0.40 0.00 0.00 -0.61 0.00 0.00 39.78 38.92 3eeq n ASN 12 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3eeq n LEU 13 N 1.30 6.26 0.23 3.41 4.77 -1.09 -4.80 117.00 127.08 3eeq n LEU 13 Ca 0.20 -4.54 0.06 0.00 -0.03 0.00 0.00 56.01 51.71 3eeq n LEU 13 Cb 0.56 -1.54 0.55 0.00 -2.33 0.00 0.00 43.42 40.66 3eeq n LEU 13 CO 0.14 1.16 0.94 -0.50 -1.33 0.00 0.00 177.39 177.79 3eeq h TRP 14 N 6.17 0.00 -0.05 -1.77 6.55 -1.82 0.26 115.95 125.28 3eeq h TRP 14 Ca 0.39 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.23 3eeq h TRP 14 Cb 0.70 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.00 3eeq h TRP 14 CO 1.24 0.15 0.00 0.54 -1.05 0.00 0.00 178.44 179.31 3eeq n ARG 15 N -4.30 1.38 0.00 0.49 1.74 -1.22 -1.76 116.66 112.99 3eeq n ARG 15 Ca -0.03 -0.57 0.00 0.00 -0.77 0.00 0.00 57.85 56.49 3eeq n ARG 15 Cb 0.22 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.24 3eeq n ARG 15 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3eeq n GLY 16 N 1.03 -0.71 3.28 -0.13 0.00 0.90 -3.96 105.19 105.61 3eeq n GLY 16 Ca 0.18 -1.72 -0.32 0.00 0.00 0.00 0.00 46.02 44.16 3eeq n GLY 16 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3eeq s ILE 17 N -1.42 2.46 -0.26 -0.61 1.01 -0.19 -0.61 121.20 121.58 3eeq s ILE 17 Ca 0.00 -0.87 -0.10 0.00 0.00 0.00 0.00 60.65 59.68 3eeq s ILE 17 Cb 0.00 -1.98 -0.04 0.00 0.01 0.00 0.00 42.46 40.44 3eeq s ILE 17 CO 0.00 0.55 0.15 0.00 0.00 0.00 0.00 174.94 175.63 3eeq s ILE 19 N 1.58 5.33 -0.22 0.00 1.01 0.17 -0.61 121.20 128.47 3eeq s ILE 19 Ca 0.07 0.23 0.01 0.00 0.00 0.00 0.00 60.65 60.95 3eeq s ILE 19 Cb -0.15 -3.53 0.05 0.00 0.01 0.00 0.00 42.46 38.84 3eeq s ILE 19 CO 0.08 0.30 -0.07 -0.63 0.00 0.00 0.00 174.94 174.62 3eeq s ILE 20 N 1.31 1.53 0.25 2.92 -1.09 0.47 -0.51 121.20 126.08 3eeq s ILE 20 Ca 0.08 -1.11 0.09 0.00 -2.23 0.00 0.00 60.65 57.48 3eeq s ILE 20 Cb -0.14 -1.73 -0.04 0.00 -1.58 0.00 0.00 42.46 38.96 3eeq s ILE 20 CO 0.07 -0.00 0.01 -0.94 -1.23 0.00 0.00 174.94 172.84 3eeq s SER 21 N 1.41 4.63 -0.04 3.58 1.04 -1.05 -1.74 113.70 121.53 3eeq s SER 21 Ca -0.04 -0.58 0.06 0.00 0.48 0.00 0.00 55.95 55.87 3eeq s SER 21 Cb -0.18 -0.90 -0.09 0.00 0.10 0.00 0.00 66.02 64.95 3eeq s SER 21 CO -0.07 0.02 0.07 0.00 0.98 0.00 0.00 173.24 174.24 3eeq n ALA 22 N -0.75 2.01 -2.61 5.32 0.00 -1.24 -0.21 120.51 123.02 3eeq n ALA 22 Ca -0.07 -0.31 -0.29 0.00 0.00 0.00 0.00 53.44 52.77 3eeq n ALA 22 Cb 0.58 -0.02 -0.08 0.00 0.00 0.00 0.00 19.45 19.92 3eeq n ALA 22 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3eeq s SER 23 N -3.37 4.13 0.06 0.00 1.04 -1.26 -4.78 113.70 109.51 3eeq s SER 23 Ca -0.03 -1.40 -0.37 0.00 0.48 0.00 0.00 55.95 54.63 3eeq s SER 23 Cb 0.03 -0.05 -0.21 0.00 0.10 0.00 0.00 66.02 65.89 3eeq s SER 23 CO 0.27 -0.65 1.56 -0.33 0.98 0.00 0.00 173.24 175.06 3eeq h GLU 24 N 1.49 -1.29 0.00 4.02 4.39 -1.99 0.29 114.58 121.49 3eeq h GLU 24 Ca -0.43 0.09 -0.02 0.00 0.34 0.00 0.00 59.36 59.33 3eeq h GLU 24 Cb 1.27 0.29 -0.00 0.00 -0.10 0.00 0.00 28.75 30.21 3eeq h GLU 24 CO 0.75 -0.86 -0.12 -0.44 -1.16 0.00 0.00 179.01 177.18 3eeq h ASP 25 N -1.35 0.00 0.88 1.42 3.45 -1.97 -0.70 116.42 118.14 3eeq h ASP 25 Ca -0.14 0.00 -0.04 0.00 0.43 0.00 0.00 57.03 57.28 3eeq h ASP 25 Cb 1.03 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 39.81 3eeq h ASP 25 CO 0.23 0.12 -0.43 0.00 -1.57 0.00 0.00 179.24 177.59 3eeq h ALA 26 N 1.88 -1.19 -0.46 3.45 0.00 -1.80 -2.42 119.26 118.72 3eeq h ALA 26 Ca -0.00 -0.26 0.09 0.00 0.00 0.00 0.00 54.91 54.74 3eeq h ALA 26 Cb 0.23 0.47 -0.09 0.00 0.00 0.00 0.00 17.79 18.40 3eeq h ALA 26 CO 0.02 -1.17 -0.09 0.35 0.00 0.00 0.00 179.25 178.36 3eeq h PHE 27 N -1.19 -0.20 -0.92 0.00 -0.00 0.35 0.23 116.94 115.22 3eeq h PHE 27 Ca -0.12 0.04 0.19 0.00 -0.00 0.00 0.00 57.97 58.08 3eeq h PHE 27 Cb 0.91 0.16 -0.11 0.00 -0.00 0.00 0.00 35.95 36.91 3eeq h PHE 27 CO -0.02 -0.18 0.49 1.03 -0.00 0.00 0.00 178.31 179.64 3eeq h SER 28 N 0.02 0.57 -0.45 0.41 0.87 -1.15 0.05 113.55 113.88 3eeq h SER 28 Ca 0.22 0.11 -0.06 0.00 -1.23 0.00 0.00 61.79 60.84 3eeq h SER 28 Cb 0.34 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.31 3eeq h SER 28 CO -0.46 0.17 0.06 0.00 -0.53 0.00 0.00 176.83 176.08 3eeq h ALA 29 N 1.64 0.59 -0.75 6.23 0.00 -0.15 -2.97 119.26 123.86 3eeq h ALA 29 Ca 0.54 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 55.29 3eeq h ALA 29 Cb 0.88 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 3eeq h ALA 29 CO -0.42 0.32 0.42 0.78 0.00 0.00 0.00 179.25 180.35 3eeq h GLY 30 N 0.60 1.12 1.01 0.00 0.00 0.99 -1.91 103.07 104.89 3eeq h GLY 30 Ca 0.13 -0.29 0.01 0.00 0.00 0.00 0.00 47.33 47.19 3eeq h GLY 30 CO 0.01 0.15 0.66 0.83 0.00 0.00 0.00 176.54 178.19 3eeq h GLU 31 N 0.74 1.32 -0.34 4.80 4.39 -1.13 0.11 114.58 124.48 3eeq h GLU 31 Ca 0.35 -0.08 -0.10 0.00 0.34 0.00 0.00 59.36 59.87 3eeq h GLU 31 Cb 0.26 -0.30 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 3eeq h GLU 31 CO -0.21 0.87 -0.19 1.15 -1.16 0.00 0.00 179.01 179.47 3eeq h THR 32 N 1.36 1.26 -0.12 1.13 2.02 -1.24 -1.78 112.91 115.54 3eeq h THR 32 Ca 0.37 -1.23 -0.22 0.00 0.77 0.00 0.00 66.41 66.10 3eeq h THR 32 Cb -0.16 1.21 0.01 0.00 -1.74 0.00 0.00 68.15 67.48 3eeq h THR 32 CO -0.08 0.40 -0.78 0.40 0.37 0.00 0.00 175.52 175.83 3eeq h ILE 33 N 0.56 1.29 -0.39 3.11 2.04 -1.08 -2.87 117.51 120.18 3eeq h ILE 33 Ca 0.09 -2.00 0.07 0.00 1.00 0.00 0.00 64.86 64.02 3eeq h ILE 33 Cb 0.64 2.10 -0.07 0.00 -0.74 0.00 0.00 36.82 38.76 3eeq h ILE 33 CO 0.05 0.63 -0.02 0.50 0.00 0.00 0.00 178.15 179.30 3eeq h LYS 34 N 0.44 0.08 -0.18 2.37 3.64 -0.63 -1.60 116.57 120.69 3eeq h LYS 34 Ca -0.07 -0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.24 3eeq h LYS 34 Cb 1.42 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.21 3eeq h LYS 34 CO 0.16 0.05 -0.19 0.93 -2.27 0.00 0.00 179.45 178.14 3eeq h GLU 35 N 0.08 0.31 -0.33 1.90 4.39 -1.37 -1.68 114.58 117.88 3eeq h GLU 35 Ca 0.19 -0.09 -0.14 0.00 0.34 0.00 0.00 59.36 59.66 3eeq h GLU 35 Cb 0.28 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 3eeq h GLU 35 CO -0.34 0.49 -0.37 0.87 -1.16 0.00 0.00 179.01 178.51 3eeq h LYS 36 N 0.28 0.76 -0.14 2.33 1.79 -1.16 -2.91 116.57 117.52 3eeq h LYS 36 Ca 0.05 -0.38 -0.16 0.00 -2.18 0.00 0.00 60.65 57.98 3eeq h LYS 36 Cb 0.50 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.14 3eeq h LYS 36 CO 0.03 1.00 -0.60 -0.07 -1.08 0.00 0.00 179.45 178.73 3eeq h LEU 37 N 0.63 0.54 -0.73 2.94 3.38 -0.90 -2.75 115.31 118.42 3eeq h LEU 37 Ca 0.06 -0.30 0.12 0.00 0.09 0.00 0.00 57.88 57.84 3eeq h LEU 37 Cb 0.91 -0.15 -0.08 0.00 0.09 0.00 0.00 40.66 41.42 3eeq h LEU 37 CO 0.08 1.01 0.32 0.11 0.09 0.00 0.00 178.44 180.06 3eeq h LYS 38 N 0.35 0.50 -0.33 1.13 1.79 -1.32 -0.39 116.57 118.30 3eeq h LYS 38 Ca -0.00 -0.03 0.10 0.00 -2.18 0.00 0.00 60.65 58.53 3eeq h LYS 38 Cb 1.15 -0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 31.67 3eeq h LYS 38 CO 0.11 0.33 0.37 0.77 -1.08 0.00 0.00 179.45 179.95 3eeq h SER 39 N 0.52 0.00 -0.46 0.86 0.02 -1.28 0.93 113.55 114.14 3eeq h SER 39 Ca 0.38 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.33 3eeq h SER 39 Cb 0.49 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.03 3eeq h SER 39 CO -0.33 0.00 0.00 0.49 -1.14 0.00 0.00 176.83 175.85 3eeq n PHE 40 N -3.71 1.07 -2.47 3.45 3.72 -0.64 -4.93 117.46 113.94 3eeq n PHE 40 Ca 0.05 -0.66 -0.17 0.00 -0.05 0.00 0.00 57.45 56.62 3eeq n PHE 40 Cb 0.53 -0.21 0.00 0.00 -0.94 0.00 0.00 39.48 38.86 3eeq n PHE 40 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 3eeq n GLU 41 N 0.49 -2.06 -3.27 -1.08 4.07 0.32 -4.97 120.64 114.14 3eeq n GLU 41 Ca 0.21 0.80 -0.41 0.00 -0.06 0.00 0.00 57.16 57.70 3eeq n GLU 41 Cb 0.77 -5.26 -0.08 0.00 -0.06 0.00 0.00 31.44 26.81 3eeq n GLU 41 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 3eeq s ILE 42 N -2.90 5.05 0.21 6.31 1.01 -0.25 -5.02 121.20 125.62 3eeq s ILE 42 Ca 0.07 0.37 -0.32 0.00 0.00 0.00 0.00 60.65 60.77 3eeq s ILE 42 Cb -0.03 -3.92 -0.12 0.00 0.01 0.00 0.00 42.46 38.41 3eeq s ILE 42 CO 0.08 -0.15 1.71 -2.84 0.00 0.00 0.00 174.94 173.74 3eeq s PRO 43 N 2.32 4.13 -0.13 2.79 0.02 -1.26 -4.11 135.00 138.76 3eeq s PRO 43 Ca 0.18 2.60 -0.09 0.00 0.02 0.00 0.00 61.00 63.71 3eeq s PRO 43 Cb -0.16 -3.07 0.04 0.00 0.02 0.00 0.00 34.50 31.33 3eeq s PRO 43 CO 0.12 -0.74 0.32 0.54 -0.33 0.00 0.00 177.00 176.92 3eeq s VAL 44 N 1.09 -0.02 -0.02 3.83 0.11 -1.26 -1.03 120.40 123.11 3eeq s VAL 44 Ca 0.74 0.06 0.05 0.00 -2.93 0.00 0.00 61.98 59.89 3eeq s VAL 44 Cb -0.49 -0.47 -0.01 0.00 -1.53 0.00 0.00 36.38 33.88 3eeq s VAL 44 CO 0.33 0.02 -0.15 -0.69 -3.33 0.00 0.00 175.10 171.28 3eeq s VAL 45 N 0.71 1.23 -0.25 2.04 1.01 -0.78 -4.96 120.40 119.41 3eeq s VAL 45 Ca -0.04 -0.65 -0.03 0.00 0.00 0.00 0.00 61.98 61.25 3eeq s VAL 45 Cb -0.06 -1.03 0.01 0.00 0.00 0.00 0.00 36.38 35.30 3eeq s VAL 45 CO -0.05 0.35 -0.02 -2.28 0.00 0.00 0.00 175.10 173.10 3eeq s HIS 46 N -0.27 3.06 0.05 5.22 2.46 -1.26 0.45 115.29 125.00 3eeq s HIS 46 Ca 0.04 -1.27 0.09 0.00 0.47 0.00 0.00 55.06 54.39 3eeq s HIS 46 Cb -0.07 -2.11 -0.03 0.00 -0.13 0.00 0.00 32.58 30.24 3eeq s HIS 46 CO -0.00 -0.65 -0.25 0.71 -2.47 0.00 0.00 174.74 172.07 3eeq s TYR 47 N 1.40 2.36 0.40 3.88 2.02 0.34 -4.97 117.35 122.77 3eeq s TYR 47 Ca 0.02 -0.39 -0.21 0.00 -0.37 0.00 0.00 57.07 56.12 3eeq s TYR 47 Cb -0.16 -1.40 -0.10 0.00 -0.40 0.00 0.00 41.96 39.90 3eeq s TYR 47 CO -0.03 0.15 0.91 1.03 -1.57 0.00 0.00 175.55 176.05 3eeq s ARG 48 N -1.29 4.24 0.25 -0.62 0.52 -1.26 -2.53 118.95 118.25 3eeq s ARG 48 Ca 0.12 1.07 -0.04 0.00 -0.52 0.00 0.00 55.73 56.36 3eeq s ARG 48 Cb -0.10 -2.31 0.47 0.00 0.52 0.00 0.00 34.95 33.53 3eeq s ARG 48 CO 0.03 0.05 1.71 -0.92 0.02 0.00 0.00 175.30 176.18 3eeq h TYR 49 N 2.15 0.41 -0.66 -0.53 3.20 -0.89 0.26 116.97 120.91 3eeq h TYR 49 Ca -0.49 0.04 0.07 0.00 3.14 0.00 0.00 58.73 61.50 3eeq h TYR 49 Cb 1.18 -0.07 -0.06 0.00 1.54 0.00 0.00 36.73 39.32 3eeq h TYR 49 CO 0.62 -0.01 0.34 0.87 -1.64 0.00 0.00 178.16 178.34 3eeq h LYS 50 N 0.36 0.59 0.00 1.82 6.56 -1.91 -2.55 116.57 121.43 3eeq h LYS 50 Ca 0.42 -0.04 -0.05 0.00 -1.06 0.00 0.00 60.65 59.92 3eeq h LYS 50 Cb 0.68 -0.13 -0.01 0.00 -0.57 0.00 0.00 32.23 32.20 3eeq h LYS 50 CO -0.45 0.39 -0.25 -0.44 -2.06 0.00 0.00 179.45 176.64 3eeq h ASP 51 N 0.61 0.00 -3.06 0.86 3.32 -1.47 -3.46 116.42 113.21 3eeq h ASP 51 Ca 0.31 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.81 3eeq h ASP 51 Cb 0.26 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.80 3eeq h ASP 51 CO -0.22 0.25 0.71 0.00 -1.72 0.00 0.00 179.24 178.26 3eeq s ALA 52 N -3.44 3.50 -1.08 3.45 0.00 0.74 -4.93 121.76 120.00 3eeq s ALA 52 Ca 0.02 0.69 -0.07 0.00 0.00 0.00 0.00 51.96 52.60 3eeq s ALA 52 Cb 0.09 -3.52 0.28 0.00 0.00 0.00 0.00 23.12 19.97 3eeq s ALA 52 CO 0.66 -0.76 1.18 -1.91 0.00 0.00 0.00 175.76 174.93 3eeq n GLU 53 N 5.12 3.69 -0.08 0.00 2.13 -1.26 -4.87 120.64 125.36 3eeq n GLU 53 Ca 0.11 -4.49 0.13 0.00 0.66 0.00 0.00 57.16 53.57 3eeq n GLU 53 Cb 0.46 -2.52 0.52 0.00 0.27 0.00 0.00 31.44 30.17 3eeq n GLU 53 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 3eeq h ILE 54 N 3.61 0.86 -0.48 6.31 2.04 -1.93 0.45 117.51 128.36 3eeq h ILE 54 Ca 0.18 -0.12 0.10 0.00 1.00 0.00 0.00 64.86 66.02 3eeq h ILE 54 Cb 0.80 0.47 -0.10 0.00 -0.74 0.00 0.00 36.82 37.24 3eeq h ILE 54 CO 1.08 0.07 -0.25 -0.33 0.00 0.00 0.00 178.15 178.72 3eeq h GLU 55 N 0.36 -0.14 0.00 2.37 3.07 -1.99 0.97 114.58 119.22 3eeq h GLU 55 Ca 0.29 0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 59.14 3eeq h GLU 55 Cb 0.64 0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.58 3eeq h GLU 55 CO -0.08 -0.09 -0.11 1.79 -1.40 0.00 0.00 179.01 179.12 3eeq h THR 56 N -0.14 1.50 -0.99 1.13 1.35 -0.58 -3.15 112.91 112.03 3eeq h THR 56 Ca 0.22 -2.17 0.37 0.00 -0.55 0.00 0.00 66.41 64.28 3eeq h THR 56 Cb 0.49 2.88 -0.17 0.00 -1.73 0.00 0.00 68.15 69.62 3eeq h THR 56 CO -0.57 0.51 0.44 0.40 -0.25 0.00 0.00 175.52 176.05 3eeq h ILE 57 N -1.00 0.07 -0.01 6.82 2.04 -1.26 0.15 117.51 124.33 3eeq h ILE 57 Ca -0.03 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.78 3eeq h ILE 57 Cb 0.91 -0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.98 3eeq h ILE 57 CO -0.02 0.01 -0.12 -0.25 0.00 0.00 0.00 178.15 177.77 3eeq h TRP 58 N 0.06 0.01 0.00 1.37 2.91 -0.76 -0.93 115.95 118.63 3eeq h TRP 58 Ca 0.77 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.79 3eeq h TRP 58 Cb 1.93 -0.00 0.00 0.00 -0.51 0.00 0.00 29.16 30.57 3eeq h TRP 58 CO -0.11 0.14 -0.49 1.63 -1.03 0.00 0.00 178.44 178.58 3eeq n LYS 59 N -4.38 0.17 -0.02 2.65 4.76 0.51 -4.50 118.16 117.35 3eeq n LYS 59 Ca -0.02 0.06 0.07 0.00 -2.87 0.00 0.00 58.31 55.54 3eeq n LYS 59 Cb 0.20 -1.62 -0.14 0.00 -1.84 0.00 0.00 35.03 31.63 3eeq n LYS 59 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3eeq s TYR 61 N -3.14 2.51 -0.06 0.00 2.02 -1.06 -4.84 117.35 112.78 3eeq s TYR 61 Ca -0.07 -0.27 0.12 0.00 -0.37 0.00 0.00 57.07 56.49 3eeq s TYR 61 Cb 0.11 -1.11 -0.06 0.00 -0.40 0.00 0.00 41.96 40.50 3eeq s TYR 61 CO 0.74 0.65 1.29 -0.44 -1.57 0.00 0.00 175.55 176.23 3eeq h ASP 62 N 2.14 0.00 -5.09 2.29 3.32 -0.99 -3.43 116.42 114.66 3eeq h ASP 62 Ca -0.43 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.54 3eeq h ASP 62 Cb 1.25 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.65 3eeq h ASP 62 CO 0.59 0.69 -0.28 0.00 -1.72 0.00 0.00 179.24 178.53 3eeq s ALA 63 N -2.86 -0.53 -0.06 3.45 0.00 -1.07 -2.36 121.76 118.32 3eeq s ALA 63 Ca 0.02 -0.24 0.02 0.00 0.00 0.00 0.00 51.96 51.76 3eeq s ALA 63 Cb 0.08 0.42 0.01 0.00 0.00 0.00 0.00 23.12 23.64 3eeq s ALA 63 CO 0.78 -0.47 -0.12 0.42 0.00 0.00 0.00 175.76 176.38 3eeq s ILE 64 N -3.14 1.08 -0.34 0.00 1.01 -0.42 -0.69 121.20 118.70 3eeq s ILE 64 Ca -0.01 -0.45 -0.05 0.00 0.00 0.00 0.00 60.65 60.15 3eeq s ILE 64 Cb 0.01 -1.00 0.05 0.00 0.01 0.00 0.00 42.46 41.54 3eeq s ILE 64 CO -0.07 0.34 0.09 -0.69 0.00 0.00 0.00 174.94 174.61 3eeq s VAL 65 N 0.68 3.48 -0.25 2.92 1.01 0.23 -1.88 120.40 126.58 3eeq s VAL 65 Ca -0.14 -1.33 -0.27 0.00 0.00 0.00 0.00 61.98 60.23 3eeq s VAL 65 Cb -0.16 -3.04 0.01 0.00 0.00 0.00 0.00 36.38 33.19 3eeq s VAL 65 CO 0.03 -0.23 0.96 -0.36 0.00 0.00 0.00 175.10 175.50 3eeq s PHE 66 N 1.32 3.29 -0.46 5.22 0.08 -0.74 -0.40 117.98 126.30 3eeq s PHE 66 Ca -0.02 1.27 -0.13 0.00 0.12 0.00 0.00 56.93 58.17 3eeq s PHE 66 Cb -0.20 -3.26 0.08 0.00 -0.57 0.00 0.00 43.02 39.07 3eeq s PHE 66 CO 0.01 -0.50 0.35 0.08 -0.10 0.00 0.00 175.22 175.05 3eeq s VAL 67 N 3.13 4.86 -0.68 -0.44 1.01 -0.71 -0.65 120.40 126.92 3eeq s VAL 67 Ca 0.40 -1.21 0.00 0.00 0.00 0.00 0.00 61.98 61.17 3eeq s VAL 67 Cb -0.15 -3.94 0.00 0.00 0.00 0.00 0.00 36.38 32.30 3eeq s VAL 67 CO 0.08 -0.57 0.00 1.15 0.00 0.00 0.00 175.10 175.77 3eeq n MET 68 N 5.10 -1.94 -2.60 2.72 0.00 -0.92 -3.72 117.12 115.76 3eeq n MET 68 Ca -0.12 0.00 -0.35 0.00 0.00 0.00 0.00 57.70 57.23 3eeq n MET 68 Cb 0.43 0.00 -0.04 0.00 0.00 0.00 0.00 33.22 33.61 3eeq n MET 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3eeq s ALA 69 N -1.40 3.02 0.34 3.17 0.00 -1.26 -4.19 121.76 121.44 3eeq s ALA 69 Ca 0.00 0.62 0.14 0.00 0.00 0.00 0.00 51.96 52.71 3eeq s ALA 69 Cb 0.00 -3.24 1.03 0.00 0.00 0.00 0.00 23.12 20.91 3eeq s ALA 69 CO 0.00 -0.17 1.69 1.25 0.00 0.00 0.00 175.76 178.54 3eeq h LEU 70 N 2.19 0.56 -0.40 0.00 5.85 -1.97 -1.72 115.31 119.82 3eeq h LEU 70 Ca -0.49 0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.38 3eeq h LEU 70 Cb 1.21 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.31 3eeq h LEU 70 CO 0.61 -0.04 0.21 -0.08 -0.34 0.00 0.00 178.44 178.80 3eeq h GLU 71 N 0.41 0.58 -0.21 1.25 4.81 -2.00 -1.62 114.58 117.80 3eeq h GLU 71 Ca 0.70 -0.08 0.01 0.00 -0.13 0.00 0.00 59.36 59.86 3eeq h GLU 71 Cb 1.53 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.79 3eeq h GLU 71 CO -0.53 0.49 0.12 0.78 -0.73 0.00 0.00 179.01 179.14 3eeq h GLY 72 N 0.52 0.29 0.69 1.92 0.00 -1.70 -2.48 103.07 102.31 3eeq h GLY 72 Ca 0.14 -0.09 0.04 0.00 0.00 0.00 0.00 47.33 47.42 3eeq h GLY 72 CO -0.02 0.09 0.18 0.00 0.00 0.00 0.00 176.54 176.79 3eeq h ALA 73 N 1.09 0.52 -0.17 3.60 0.00 -1.18 -2.07 119.26 121.05 3eeq h ALA 73 Ca 0.08 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 3eeq h ALA 73 Cb -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3eeq h ALA 73 CO -0.04 -0.20 -0.34 1.79 0.00 0.00 0.00 179.25 180.47 3eeq h THR 74 N 0.37 1.28 0.51 0.00 1.35 -1.30 0.63 112.91 115.75 3eeq h THR 74 Ca 0.19 -1.39 -0.02 0.00 -0.55 0.00 0.00 66.41 64.64 3eeq h THR 74 Cb 0.15 1.53 0.00 0.00 -1.73 0.00 0.00 68.15 68.10 3eeq h THR 74 CO -0.17 0.42 -0.24 -0.09 -0.25 0.00 0.00 175.52 175.19 3eeq h ARG 75 N 0.29 -0.66 -0.02 4.72 2.43 -0.95 0.11 114.38 120.32 3eeq h ARG 75 Ca 0.04 0.04 0.03 0.00 -0.81 0.00 0.00 59.98 59.28 3eeq h ARG 75 Cb 0.74 0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 30.40 3eeq h ARG 75 CO 0.06 -0.43 -0.20 0.82 -1.51 0.00 0.00 179.97 178.70 3eeq h ILE 76 N -0.69 0.52 -0.86 1.20 2.04 -1.10 -2.35 117.51 116.27 3eeq h ILE 76 Ca -0.07 0.00 0.09 0.00 1.00 0.00 0.00 64.86 65.88 3eeq h ILE 76 Cb 0.52 0.52 -0.06 0.00 -0.74 0.00 0.00 36.82 37.06 3eeq h ILE 76 CO 0.11 0.00 0.56 0.58 0.00 0.00 0.00 178.15 179.40 3eeq h VAL 77 N -0.31 0.98 -0.25 1.67 2.07 0.52 -1.77 116.25 119.16 3eeq h VAL 77 Ca 0.06 -0.29 0.01 0.00 0.82 0.00 0.00 66.70 67.30 3eeq h VAL 77 Cb 0.40 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 3eeq h VAL 77 CO -0.20 0.16 0.15 0.00 0.02 0.00 0.00 177.57 177.70 3eeq h LYS 79 N 0.32 0.55 -0.00 0.00 1.57 -1.01 -3.30 116.57 114.70 3eeq h LYS 79 Ca 0.09 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3eeq h LYS 79 Cb -0.02 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.17 3eeq h LYS 79 CO -0.03 0.36 -0.29 0.66 -0.57 0.00 0.00 179.45 179.58 3eeq n TYR 80 N -4.73 0.00 -1.89 -1.35 4.01 -0.96 -4.94 117.16 107.31 3eeq n TYR 80 Ca 0.25 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.76 3eeq n TYR 80 Cb 0.73 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.68 3eeq n TYR 80 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3eeq s ALA 81 N -1.52 1.28 -0.04 -0.72 0.00 -0.31 -5.10 121.76 115.36 3eeq s ALA 81 Ca 0.05 -1.80 -0.04 0.00 0.00 0.00 0.00 51.96 50.17 3eeq s ALA 81 Cb 0.06 -4.67 -0.01 0.00 0.00 0.00 0.00 23.12 18.50 3eeq s ALA 81 CO 0.28 -5.80 -0.07 1.63 0.00 0.00 0.00 175.76 171.79 3eeq n LYS 82 N 8.33 0.12 -3.26 0.00 5.02 -1.26 -5.08 118.16 122.02 3eeq n LYS 82 Ca 0.43 0.10 -0.19 0.00 -2.02 0.00 0.00 58.31 56.63 3eeq n LYS 82 Cb 0.46 -0.76 -0.02 0.00 -0.02 0.00 0.00 35.03 34.69 3eeq n LYS 82 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 3eeq n GLU 86 N -2.93 -2.45 -4.35 1.97 2.13 -1.26 -5.17 120.64 108.58 3eeq n GLU 86 Ca -0.03 0.21 -0.21 0.00 0.66 0.00 0.00 57.16 57.80 3eeq n GLU 86 Cb 0.11 -4.80 -0.13 0.00 0.27 0.00 0.00 31.44 26.89 3eeq n GLU 86 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3eeq s ASP 87 N -2.52 1.87 0.46 4.31 1.01 -1.26 -5.06 116.67 115.48 3eeq s ASP 87 Ca 0.33 -0.52 -0.22 0.00 0.71 0.00 0.00 52.55 52.85 3eeq s ASP 87 Cb -0.18 -0.11 -0.08 0.00 1.01 0.00 0.00 42.92 43.55 3eeq s ASP 87 CO 0.40 0.03 1.08 -2.16 0.21 0.00 0.00 175.17 174.73 3eeq s PRO 88 N -1.34 3.87 0.29 8.23 0.04 -1.26 -5.01 135.00 139.81 3eeq s PRO 88 Ca 0.02 1.52 -0.30 0.00 0.04 0.00 0.00 61.00 62.28 3eeq s PRO 88 Cb -0.09 -2.29 -0.12 0.00 0.04 0.00 0.00 34.50 32.04 3eeq s PRO 88 CO 0.02 -0.40 1.58 0.00 0.04 0.00 0.00 177.00 178.24 3eeq n ALA 89 N -0.61 2.40 -2.47 8.56 0.00 -0.99 -4.67 120.51 122.72 3eeq n ALA 89 Ca 0.08 0.38 -0.26 0.00 0.00 0.00 0.00 53.44 53.64 3eeq n ALA 89 Cb 0.51 -2.45 -0.15 0.00 0.00 0.00 0.00 19.45 17.36 3eeq n ALA 89 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3eeq s ILE 90 N 0.01 1.49 0.01 0.00 -1.09 -0.84 -1.30 121.20 119.49 3eeq s ILE 90 Ca 0.65 -0.84 -0.01 0.00 -2.23 0.00 0.00 60.65 58.22 3eeq s ILE 90 Cb -0.51 -1.25 -0.01 0.00 -1.58 0.00 0.00 42.46 39.11 3eeq s ILE 90 CO 0.48 0.40 0.00 -0.69 -1.23 0.00 0.00 174.94 173.90 3eeq s VAL 91 N -0.48 0.09 -0.14 2.92 1.01 -0.79 -1.03 120.40 121.98 3eeq s VAL 91 Ca 0.07 -0.74 0.01 0.00 0.00 0.00 0.00 61.98 61.32 3eeq s VAL 91 Cb -0.07 -0.25 0.00 0.00 0.00 0.00 0.00 36.38 36.05 3eeq s VAL 91 CO -0.00 -0.41 -0.18 0.00 0.00 0.00 0.00 175.10 174.51 3eeq s ILE 93 N 0.73 1.90 0.60 0.00 1.01 0.18 -0.70 121.20 124.91 3eeq s ILE 93 Ca -0.08 -0.96 -0.15 0.00 0.00 0.00 0.00 60.65 59.47 3eeq s ILE 93 Cb -0.16 -1.63 -0.03 0.00 0.01 0.00 0.00 42.46 40.65 3eeq s ILE 93 CO 0.01 0.53 1.04 1.51 0.00 0.00 0.00 174.94 178.03 3eeq s ASP 94 N 0.11 5.87 0.00 3.58 -4.77 -1.23 -2.16 116.67 118.07 3eeq s ASP 94 Ca -0.10 1.71 0.08 0.00 -3.30 0.00 0.00 52.55 50.94 3eeq s ASP 94 Cb -0.15 -2.52 0.46 0.00 -1.09 0.00 0.00 42.92 39.62 3eeq s ASP 94 CO 0.05 -1.10 0.97 -0.90 0.70 0.00 0.00 175.17 174.89 3eeq n ASP 95 N -2.22 0.00 -0.60 2.11 3.85 -1.26 0.92 116.55 119.35 3eeq n ASP 95 Ca 0.08 -0.16 0.08 0.00 -0.71 0.00 0.00 54.79 54.08 3eeq n ASP 95 Cb 0.53 -0.06 0.06 0.00 -1.35 0.00 0.00 41.12 40.30 3eeq n ASP 95 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 3eeq n LYS 96 N -1.06 1.32 -3.55 0.11 5.02 -1.26 -4.70 118.16 114.03 3eeq n LYS 96 Ca 0.05 -1.36 -0.24 0.00 -2.02 0.00 0.00 58.31 54.74 3eeq n LYS 96 Cb 0.04 -1.30 0.07 0.00 -0.02 0.00 0.00 35.03 33.82 3eeq n LYS 96 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3eeq n ILE 97 N 0.76 -2.88 0.08 -0.18 5.41 0.26 -4.87 119.36 117.94 3eeq n ILE 97 Ca 0.09 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.72 3eeq n ILE 97 Cb 0.39 -3.92 -0.13 0.00 -0.71 0.00 0.00 39.64 35.27 3eeq n ILE 97 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 3eeq h ASN 98 N -2.57 0.22 -4.73 4.38 4.21 -1.93 -3.43 115.58 111.72 3eeq h ASN 98 Ca -0.57 -0.24 -0.27 0.00 1.21 0.00 0.00 56.30 56.44 3eeq h ASN 98 Cb 1.37 -0.07 -0.22 0.00 -1.12 0.00 0.00 38.32 38.28 3eeq h ASN 98 CO 0.56 1.19 -0.73 -0.31 -1.29 0.00 0.00 177.43 176.85 3eeq s TYR 99 N -2.68 0.62 -0.21 1.19 2.02 -1.26 -2.44 117.35 114.60 3eeq s TYR 99 Ca -0.02 -0.48 0.02 0.00 -0.37 0.00 0.00 57.07 56.22 3eeq s TYR 99 Cb 0.08 -0.37 0.03 0.00 -0.40 0.00 0.00 41.96 41.30 3eeq s TYR 99 CO 0.85 -0.09 -0.17 0.08 -1.57 0.00 0.00 175.55 174.66 3eeq s VAL 100 N -1.31 2.08 -0.27 0.71 1.01 -0.50 -3.52 120.40 118.60 3eeq s VAL 100 Ca -0.10 -1.17 0.03 0.00 0.00 0.00 0.00 61.98 60.75 3eeq s VAL 100 Cb -0.09 -1.99 0.07 0.00 0.00 0.00 0.00 36.38 34.36 3eeq s VAL 100 CO 0.00 0.34 -0.08 -0.63 0.00 0.00 0.00 175.10 174.74 3eeq s ILE 101 N 1.23 2.12 0.32 2.22 1.01 0.12 -0.95 121.20 127.27 3eeq s ILE 101 Ca 0.00 -1.72 -0.29 0.00 0.00 0.00 0.00 60.65 58.64 3eeq s ILE 101 Cb -0.15 -2.30 -0.11 0.00 0.01 0.00 0.00 42.46 39.90 3eeq s ILE 101 CO -0.10 -0.14 1.55 -2.16 0.00 0.00 0.00 174.94 174.08 3eeq s PRO 102 N 1.10 4.13 -0.01 2.79 0.04 -1.26 -0.42 135.00 141.36 3eeq s PRO 102 Ca -0.05 2.56 0.06 0.00 0.04 0.00 0.00 61.00 63.60 3eeq s PRO 102 Cb -0.20 -3.01 -0.09 0.00 0.04 0.00 0.00 34.50 31.25 3eeq s PRO 102 CO -0.06 -0.58 0.12 1.28 0.04 0.00 0.00 177.00 177.80 3eeq n LEU 103 N 1.59 0.00 -3.59 -3.56 4.77 -0.20 -4.88 117.00 111.13 3eeq n LEU 103 Ca 0.06 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.89 3eeq n LEU 103 Cb 0.38 0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.41 3eeq n LEU 103 CO 0.63 0.01 0.48 -0.22 -1.33 0.00 0.00 177.39 176.96 3eeq s LEU 104 N -3.43 -0.67 0.00 2.23 2.96 -1.15 -4.92 118.68 113.70 3eeq s LEU 104 Ca -0.02 1.11 0.00 0.00 -0.22 0.00 0.00 54.13 55.00 3eeq s LEU 104 Cb 0.04 2.39 0.00 0.00 0.50 0.00 0.00 46.19 49.12 3eeq s LEU 104 CO 0.23 -0.35 0.00 0.61 -1.32 0.00 0.00 176.35 175.52 3eeq n GLY 105 N 1.99 0.75 0.43 7.98 0.00 -1.26 -1.98 105.19 113.10 3eeq n GLY 105 Ca -0.15 -0.21 0.27 0.00 0.00 0.00 0.00 46.02 45.93 3eeq n GLY 105 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3eeq h GLY 106 N 0.00 1.07 0.00 -0.02 0.00 -1.93 0.14 103.07 102.33 3eeq h GLY 106 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.17 3eeq h GLY 106 CO 0.00 -0.17 0.00 1.42 0.00 0.00 0.00 176.54 177.79 3eeq n HIS 107 N -4.58 0.00 0.75 5.60 8.25 -1.26 -4.08 115.22 119.90 3eeq n HIS 107 Ca 0.28 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.74 3eeq n HIS 107 Cb 1.03 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.14 3eeq n HIS 107 CO 0.00 0.00 0.00 -2.67 0.64 0.00 0.00 176.34 174.31 3eeq n TRP 108 N -0.47 0.00 0.00 4.41 2.14 0.40 -3.50 117.44 120.42 3eeq n TRP 108 Ca 0.00 -0.29 0.00 0.00 2.07 0.00 0.00 57.50 59.28 3eeq n TRP 108 Cb 0.00 -0.18 0.00 0.00 -0.81 0.00 0.00 31.31 30.32 3eeq n TRP 108 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 3eeq n GLY 109 N 0.50 1.17 0.26 -1.67 0.00 -0.80 -4.99 105.19 99.67 3eeq n GLY 109 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 3eeq n GLY 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3eeq h ALA 110 N 0.00 1.93 -0.19 4.61 0.00 -1.50 -1.36 119.26 122.75 3eeq h ALA 110 Ca 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3eeq h ALA 110 Cb 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3eeq h ALA 110 CO 0.00 0.02 -0.00 -0.91 0.00 0.00 0.00 179.25 178.36 3eeq h ASN 111 N 0.00 0.33 -0.19 0.00 2.35 -1.80 -1.60 115.58 114.67 3eeq h ASN 111 Ca -0.00 -0.31 -0.09 0.00 -0.55 0.00 0.00 56.30 55.35 3eeq h ASN 111 Cb 0.03 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 3eeq h ASN 111 CO 0.00 0.56 -0.16 0.44 -1.65 0.00 0.00 177.43 176.62 3eeq h ASP 112 N 0.09 0.59 -0.33 5.81 3.32 -1.81 -1.64 116.42 122.45 3eeq h ASP 112 Ca 0.05 -0.17 0.02 0.00 0.02 0.00 0.00 57.03 56.95 3eeq h ASP 112 Cb 0.39 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 3eeq h ASP 112 CO 0.01 0.76 0.18 0.40 -1.72 0.00 0.00 179.24 178.88 3eeq h ILE 113 N 0.54 1.02 -0.72 0.35 2.04 -1.16 0.98 117.51 120.55 3eeq h ILE 113 Ca 0.09 -0.13 -0.06 0.00 1.00 0.00 0.00 64.86 65.76 3eeq h ILE 113 Cb 0.58 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 3eeq h ILE 113 CO 0.04 0.07 0.22 0.00 0.00 0.00 0.00 178.15 178.48 3eeq h ALA 114 N 1.15 1.03 -0.34 1.87 0.00 -1.11 1.20 119.26 123.06 3eeq h ALA 114 Ca 0.13 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 3eeq h ALA 114 Cb 0.02 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3eeq h ALA 114 CO -0.07 0.65 0.02 0.00 0.00 0.00 0.00 179.25 179.84 3eeq h ARG 115 N 1.07 0.60 0.00 0.00 3.08 -0.95 0.12 114.38 118.30 3eeq h ARG 115 Ca 0.23 -0.18 -0.23 0.00 0.07 0.00 0.00 59.98 59.87 3eeq h ARG 115 Cb 0.30 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.30 3eeq h ARG 115 CO -0.01 0.71 -0.94 0.93 -1.07 0.00 0.00 179.97 179.59 3eeq h GLU 116 N 0.41 0.41 -0.52 0.04 5.08 -0.34 -2.13 114.58 117.53 3eeq h GLU 116 Ca 0.10 -0.44 -0.04 0.00 -1.00 0.00 0.00 59.36 57.98 3eeq h GLU 116 Cb 0.43 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 3eeq h GLU 116 CO 0.01 1.11 0.16 1.25 -1.00 0.00 0.00 179.01 180.54 3eeq h LEU 117 N 0.23 0.71 -0.09 1.33 5.85 0.15 -2.55 115.31 120.94 3eeq h LEU 117 Ca -0.08 -0.11 -0.20 0.00 0.84 0.00 0.00 57.88 58.34 3eeq h LEU 117 Cb 1.58 -0.18 0.01 0.00 0.37 0.00 0.00 40.66 42.44 3eeq h LEU 117 CO 0.16 0.67 -0.72 0.77 -0.34 0.00 0.00 178.44 178.99 3eeq h SER 118 N 0.75 0.79 -0.02 1.25 4.64 -0.51 -1.87 113.55 118.57 3eeq h SER 118 Ca 0.17 -0.67 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 3eeq h SER 118 Cb 0.23 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 3eeq h SER 118 CO -0.01 1.34 -0.05 0.58 -0.87 0.00 0.00 176.83 177.82 3eeq h VAL 119 N 0.30 0.00 -1.00 0.95 2.07 -1.42 0.31 116.25 117.46 3eeq h VAL 119 Ca -0.07 0.00 0.40 0.00 0.82 0.00 0.00 66.70 67.85 3eeq h VAL 119 Cb 1.37 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.97 3eeq h VAL 119 CO 0.15 0.00 0.52 0.40 0.02 0.00 0.00 177.57 178.66 3eeq h ILE 120 N -0.05 0.05 -0.62 4.57 2.04 -1.46 -0.11 117.51 121.93 3eeq h ILE 120 Ca 0.00 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.84 3eeq h ILE 120 Cb 0.06 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.13 3eeq h ILE 120 CO -0.05 0.01 0.00 0.18 0.00 0.00 0.00 178.15 178.29 3eeq n LEU 121 N -5.23 3.69 -3.76 1.44 4.77 -0.71 -4.97 117.00 112.24 3eeq n LEU 121 Ca 0.36 -1.96 -0.24 0.00 -0.03 0.00 0.00 56.01 54.15 3eeq n LEU 121 Cb 1.21 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.89 3eeq n LEU 121 CO 0.02 0.91 -0.20 -3.20 -1.33 0.00 0.00 177.39 173.59 3eeq n ASN 122 N 1.39 -5.02 -2.62 -1.43 4.05 0.27 -4.98 115.26 106.92 3eeq n ASN 122 Ca 0.21 -0.92 -0.13 0.00 0.45 0.00 0.00 54.58 54.19 3eeq n ASN 122 Cb 0.58 -1.91 -0.04 0.00 1.23 0.00 0.00 39.78 39.63 3eeq n ASN 122 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 177.26 173.97 3eeq n SER 123 N -2.56 0.35 -4.16 1.20 2.88 0.84 -4.96 113.62 107.22 3eeq n SER 123 Ca -0.29 -2.30 -0.33 0.00 -1.33 0.00 0.00 58.87 54.62 3eeq n SER 123 Cb 0.68 0.80 -0.16 0.00 -0.75 0.00 0.00 64.21 64.78 3eeq n SER 123 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 3eeq s THR 124 N -2.63 2.07 0.06 2.46 2.01 -1.02 -4.54 115.64 114.05 3eeq s THR 124 Ca 0.18 -0.97 -0.30 0.00 0.31 0.00 0.00 61.69 60.91 3eeq s THR 124 Cb 0.01 -1.84 -0.05 0.00 0.01 0.00 0.00 72.50 70.64 3eeq s THR 124 CO 0.13 0.55 1.01 -2.16 -0.69 0.00 0.00 174.62 173.46 3eeq s PRO 125 N 0.96 4.59 -0.79 4.92 0.04 -1.26 -1.41 135.00 142.05 3eeq s PRO 125 Ca -0.03 1.50 -0.12 0.00 0.04 0.00 0.00 61.00 62.39 3eeq s PRO 125 Cb -0.15 -3.40 0.21 0.00 0.04 0.00 0.00 34.50 31.20 3eeq s PRO 125 CO -0.05 0.02 0.71 0.42 0.04 0.00 0.00 177.00 178.14 3eeq s ILE 126 N 0.55 5.28 -0.16 0.56 -1.09 -0.13 -4.91 121.20 121.32 3eeq s ILE 126 Ca 0.51 -2.54 -0.18 0.00 -2.23 0.00 0.00 60.65 56.21 3eeq s ILE 126 Cb -0.24 -4.29 -0.04 0.00 -1.58 0.00 0.00 42.46 36.32 3eeq s ILE 126 CO 0.29 -1.00 0.47 -0.63 -1.23 0.00 0.00 174.94 172.84 3eeq s ILE 127 N 0.15 5.17 0.00 2.92 -1.09 -1.26 -4.36 121.20 122.73 3eeq s ILE 127 Ca 0.17 0.90 0.00 0.00 -2.23 0.00 0.00 60.65 59.50 3eeq s ILE 127 Cb -0.12 -3.80 0.00 0.00 -1.58 0.00 0.00 42.46 36.95 3eeq s ILE 127 CO -0.08 0.27 0.09 0.35 -1.23 0.00 0.00 174.94 174.34 3eeq n THR 128 N 4.02 0.00 0.00 2.92 -2.24 -1.26 -5.18 114.28 112.54 3eeq n THR 128 Ca -0.07 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 3eeq n THR 128 Cb 0.51 1.11 0.00 0.00 -2.10 0.00 0.00 70.33 69.85 3eeq n THR 128 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 3eeq n LYS 136 N -0.44 0.00 -3.24 -0.78 0.00 -1.23 -5.21 118.16 107.25 3eeq n LYS 136 Ca 0.00 0.00 -0.18 0.00 -0.00 0.00 0.00 58.31 58.13 3eeq n LYS 136 Cb 0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 35.03 35.05 3eeq n LYS 136 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 3eeq s LEU 137 N 0.00 3.61 0.20 -5.58 1.43 -1.26 -4.17 118.68 112.91 3eeq s LEU 137 Ca 0.00 -0.49 0.10 0.00 -1.03 0.00 0.00 54.13 52.71 3eeq s LEU 137 Cb 0.00 -2.48 -0.04 0.00 0.03 0.00 0.00 46.19 43.70 3eeq s LEU 137 CO 0.00 -0.68 -0.21 -0.94 0.23 0.00 0.00 176.35 174.75 3eeq s SER 138 N -4.26 3.17 0.20 2.29 1.04 -1.26 -4.63 113.70 110.25 3eeq s SER 138 Ca 0.51 -0.89 -0.09 0.00 0.48 0.00 0.00 55.95 55.96 3eeq s SER 138 Cb -0.08 -0.22 0.12 0.00 0.10 0.00 0.00 66.02 65.94 3eeq s SER 138 CO 0.31 0.05 1.74 -0.29 0.98 0.00 0.00 173.24 176.03 3eeq h ILE 139 N 3.07 1.25 -0.43 -1.02 6.09 -1.91 -1.64 117.51 122.93 3eeq h ILE 139 Ca -0.44 -0.84 0.09 0.00 -1.37 0.00 0.00 64.86 62.30 3eeq h ILE 139 Cb 1.22 0.46 -0.09 0.00 0.47 0.00 0.00 36.82 38.88 3eeq h ILE 139 CO 0.51 0.33 -0.19 -0.33 -3.07 0.00 0.00 178.15 175.41 3eeq h GLU 140 N 1.03 -0.10 -0.83 2.19 3.07 -1.97 0.18 114.58 118.15 3eeq h GLU 140 Ca 0.23 0.01 0.06 0.00 -0.50 0.00 0.00 59.36 59.16 3eeq h GLU 140 Cb 0.26 0.02 -0.05 0.00 -0.84 0.00 0.00 28.75 28.14 3eeq h GLU 140 CO -0.01 -0.07 0.54 0.00 -1.40 0.00 0.00 179.01 178.08 3eeq h ARG 141 N -0.10 0.90 0.00 2.33 3.08 -1.79 -1.35 114.38 117.44 3eeq h ARG 141 Ca 0.21 -0.05 -0.16 0.00 0.07 0.00 0.00 59.98 60.04 3eeq h ARG 141 Cb 0.42 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 3eeq h ARG 141 CO -0.49 0.59 -0.77 0.82 -1.07 0.00 0.00 179.97 179.05 3eeq h ILE 142 N 0.92 1.41 0.28 2.04 2.04 -0.14 -1.18 117.51 122.88 3eeq h ILE 142 Ca 0.36 -2.76 -0.01 0.00 1.00 0.00 0.00 64.86 63.44 3eeq h ILE 142 Cb 0.22 2.55 0.00 0.00 -0.74 0.00 0.00 36.82 38.84 3eeq h ILE 142 CO -0.13 0.75 -0.13 0.00 0.00 0.00 0.00 178.15 178.64 3eeq h ALA 143 N 1.23 -0.37 -0.70 1.87 0.00 -0.36 -1.50 119.26 119.42 3eeq h ALA 143 Ca -0.01 -0.19 0.15 0.00 0.00 0.00 0.00 54.91 54.86 3eeq h ALA 143 Cb 1.49 0.15 -0.13 0.00 0.00 0.00 0.00 17.79 19.29 3eeq h ALA 143 CO 0.10 -0.52 -0.07 -0.91 0.00 0.00 0.00 179.25 177.85 3eeq h ASN 144 N -0.76 -0.47 -0.71 0.00 2.35 -1.24 0.52 115.58 115.28 3eeq h ASN 144 Ca -0.04 0.19 0.09 0.00 -0.55 0.00 0.00 56.30 55.99 3eeq h ASN 144 Cb 0.50 0.37 -0.05 0.00 0.05 0.00 0.00 38.32 39.19 3eeq h ASN 144 CO 0.06 -0.19 0.47 0.40 -1.65 0.00 0.00 177.43 176.52 3eeq h ILE 145 N 0.06 0.96 -0.01 2.81 1.08 -1.13 -2.11 117.51 119.16 3eeq h ILE 145 Ca 0.36 -0.22 0.00 0.00 -0.39 0.00 0.00 64.86 64.61 3eeq h ILE 145 Cb 0.59 0.26 0.00 0.00 -3.07 0.00 0.00 36.82 34.60 3eeq h ILE 145 CO -0.66 0.12 -0.55 0.18 -0.69 0.00 0.00 178.15 176.55 3eeq n LEU 146 N -4.49 1.22 -2.98 1.44 4.77 0.54 -4.98 117.00 112.52 3eeq n LEU 146 Ca 0.11 -0.42 -0.10 0.00 -0.03 0.00 0.00 56.01 55.58 3eeq n LEU 146 Cb 0.30 -0.08 0.01 0.00 -2.33 0.00 0.00 43.42 41.32 3eeq n LEU 146 CO 0.33 0.25 0.07 -0.38 -1.33 0.00 0.00 177.39 176.33 3eeq n ILE 147 N -0.82-10.04 -3.54 -0.08 5.41 0.15 -4.79 119.36 105.64 3eeq n ILE 147 Ca 0.08 0.57 -0.08 0.00 1.00 0.00 0.00 62.75 64.32 3eeq n ILE 147 Cb 0.38 -6.76 -0.03 0.00 -0.71 0.00 0.00 39.64 32.52 3eeq n ILE 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3eeq s ALA 148 N -2.59 -1.90 -0.03 -1.39 0.00 -1.17 -1.97 121.76 112.72 3eeq s ALA 148 Ca 0.21 1.28 0.02 0.00 0.00 0.00 0.00 51.96 53.47 3eeq s ALA 148 Cb -0.05 -0.02 -0.03 0.00 0.00 0.00 0.00 23.12 23.02 3eeq s ALA 148 CO 0.78 -0.56 -0.09 0.15 0.00 0.00 0.00 175.76 176.05 3eeq s LYS 149 N -2.39 2.60 -0.18 0.00 1.02 0.14 -4.43 119.74 116.49 3eeq s LYS 149 Ca 0.04 -0.65 -0.26 0.00 0.02 0.00 0.00 55.97 55.11 3eeq s LYS 149 Cb -0.01 -2.50 -0.01 0.00 -0.52 0.00 0.00 37.83 34.79 3eeq s LYS 149 CO -0.05 0.63 0.87 0.42 -0.92 0.00 0.00 175.35 176.30 3eeq s ILE 150 N -0.87 4.84 -0.04 2.17 1.01 -1.26 -1.32 121.20 125.73 3eeq s ILE 150 Ca 0.14 1.70 0.22 0.00 0.00 0.00 0.00 60.65 62.71 3eeq s ILE 150 Cb -0.11 -4.17 -0.34 0.00 0.01 0.00 0.00 42.46 37.85 3eeq s ILE 150 CO 0.04 -0.02 0.48 2.30 0.00 0.00 0.00 174.94 177.74 3eeq n ILE 151 N 4.89 0.00 -3.48 2.92 -5.35 -1.07 -4.68 119.36 112.59 3eeq n ILE 151 Ca 0.06 -0.49 -0.27 0.00 -0.27 0.00 0.00 62.75 61.78 3eeq n ILE 151 Cb 0.48 0.01 -0.09 0.00 -1.74 0.00 0.00 39.64 38.31 3eeq n ILE 151 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 3eeq n ASN 152 N -2.25 2.44 0.00 7.28 6.94 -1.26 -4.95 115.26 123.46 3eeq n ASN 152 Ca -0.04 -3.13 0.09 0.00 -0.02 0.00 0.00 54.58 51.48 3eeq n ASN 152 Cb 0.57 -0.67 0.50 0.00 -2.36 0.00 0.00 39.78 37.82 3eeq n ASN 152 CO 0.00 0.00 0.00 -0.81 -1.03 0.00 0.00 177.26 175.42 3eeq n PRO 153 N 1.42 0.51 0.23 -0.53 -0.04 -1.26 -1.83 135.00 133.49 3eeq n PRO 153 Ca 0.26 0.02 0.15 0.00 -0.04 0.00 0.00 63.50 63.88 3eeq n PRO 153 Cb 0.43 -1.50 0.51 0.00 -0.04 0.00 0.00 33.50 32.89 3eeq n PRO 153 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 3eeq h GLU 154 N 0.00 0.00 -0.52 0.54 9.09 -1.99 -3.03 114.58 118.67 3eeq h GLU 154 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3eeq h GLU 154 Cb 0.02 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.12 3eeq h GLU 154 CO 0.00 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.15 3eeq n ASN 155 N -2.92 5.21 -0.03 3.06 3.02 -0.76 -4.47 115.26 118.37 3eeq n ASN 155 Ca 0.02 -2.87 -0.14 0.00 -0.03 0.00 0.00 54.58 51.56 3eeq n ASN 155 Cb 0.36 -0.64 -0.10 0.00 -0.61 0.00 0.00 39.78 38.80 3eeq n ASN 155 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 3eeq h ILE 156 N 3.54 1.45 0.58 2.41 2.04 -1.73 -3.11 117.51 122.69 3eeq h ILE 156 Ca 0.00 -1.62 -0.03 0.00 1.00 0.00 0.00 64.86 64.22 3eeq h ILE 156 Cb 1.79 2.38 0.01 0.00 -0.74 0.00 0.00 36.82 40.25 3eeq h ILE 156 CO 0.40 0.45 -0.28 0.58 0.00 0.00 0.00 178.15 179.30 3eeq h VAL 157 N -0.33 0.42 -0.26 1.67 2.07 -1.80 -1.56 116.25 116.46 3eeq h VAL 157 Ca -0.01 -0.08 -0.04 0.00 0.82 0.00 0.00 66.70 67.39 3eeq h VAL 157 Cb 0.83 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 3eeq h VAL 157 CO 0.04 0.01 -0.03 0.07 0.02 0.00 0.00 177.57 177.68 3eeq h LYS 158 N -0.82 0.40 -0.06 1.57 2.10 -1.86 -1.58 116.57 116.31 3eeq h LYS 158 Ca -0.08 -0.08 -0.18 0.00 -2.00 0.00 0.00 60.65 58.31 3eeq h LYS 158 Cb 0.61 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 31.87 3eeq h LYS 158 CO 0.13 0.46 -0.72 0.97 -2.00 0.00 0.00 179.45 178.28 3eeq h ILE 159 N 0.39 1.40 -0.53 0.07 6.09 -1.47 -1.69 117.51 121.77 3eeq h ILE 159 Ca 0.08 -2.18 -0.06 0.00 -1.37 0.00 0.00 64.86 61.34 3eeq h ILE 159 Cb 0.31 2.15 -0.02 0.00 0.47 0.00 0.00 36.82 39.73 3eeq h ILE 159 CO 0.01 0.65 0.12 0.78 -3.07 0.00 0.00 178.15 176.64 3eeq h ASN 160 N 0.22 0.82 -0.04 2.19 2.35 -1.11 -0.92 115.58 119.09 3eeq h ASN 160 Ca -0.03 -0.24 -0.08 0.00 -0.55 0.00 0.00 56.30 55.40 3eeq h ASN 160 Cb 1.29 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 39.43 3eeq h ASN 160 CO 0.12 0.85 -0.20 0.00 -1.65 0.00 0.00 177.43 176.54 3eeq h ALA 161 N 1.00 1.21 -0.55 -0.83 0.00 -1.10 0.02 119.26 119.01 3eeq h ALA 161 Ca 0.17 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3eeq h ALA 161 Cb 0.36 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 3eeq h ALA 161 CO 0.00 0.51 0.35 0.00 0.00 0.00 0.00 179.25 180.12 3eeq h ALA 162 N 1.40 0.70 -0.59 0.00 0.00 -1.21 0.21 119.26 119.76 3eeq h ALA 162 Ca 0.06 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 3eeq h ALA 162 Cb 0.58 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 3eeq h ALA 162 CO 0.04 0.15 0.12 -0.07 0.00 0.00 0.00 179.25 179.49 3eeq h LEU 163 N 0.74 0.88 -0.25 0.00 3.38 0.01 -1.03 115.31 119.04 3eeq h LEU 163 Ca 0.20 -0.18 -0.21 0.00 0.09 0.00 0.00 57.88 57.78 3eeq h LEU 163 Cb -0.06 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.46 3eeq h LEU 163 CO -0.04 0.87 -0.74 0.25 0.09 0.00 0.00 178.44 178.87 3eeq h LEU 164 N 0.89 0.82 0.00 1.67 7.12 -0.83 0.39 115.31 125.37 3eeq h LEU 164 Ca 0.19 -0.53 0.00 0.00 0.13 0.00 0.00 57.88 57.67 3eeq h LEU 164 Cb 0.35 -0.24 0.00 0.00 -0.53 0.00 0.00 40.66 40.24 3eeq h LEU 164 CO 0.00 1.31 0.00 0.54 -0.13 0.00 0.00 178.44 180.16 3eeq n ARG 165 N -3.92 0.46 -2.90 1.25 1.74 0.72 -4.87 116.66 109.14 3eeq n ARG 165 Ca -0.06 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.84 3eeq n ARG 165 Cb 0.72 -1.27 -0.00 0.00 -1.02 0.00 0.00 32.46 30.89 3eeq n ARG 165 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 3eeq n ASP 166 N -0.77 -4.01 -4.80 0.55 5.68 0.13 -4.94 116.55 108.38 3eeq n ASP 166 Ca 0.06 -0.10 -0.31 0.00 -0.50 0.00 0.00 54.79 53.94 3eeq n ASP 166 Cb 0.03 -3.35 0.07 0.00 -1.14 0.00 0.00 41.12 36.72 3eeq n ASP 166 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 3eeq s GLU 167 N -5.52 2.58 0.07 0.11 2.02 -0.54 -4.94 118.70 112.47 3eeq s GLU 167 Ca 0.20 0.91 -0.30 0.00 0.02 0.00 0.00 54.97 55.80 3eeq s GLU 167 Cb -0.11 -1.95 -0.05 0.00 0.10 0.00 0.00 34.13 32.12 3eeq s GLU 167 CO 0.25 -1.34 1.00 -1.54 0.02 0.00 0.00 175.26 173.65 3eeq s SER 168 N -3.75 7.40 -0.05 -0.19 1.04 -1.26 -4.79 113.70 112.10 3eeq s SER 168 Ca 0.59 1.78 0.05 0.00 0.48 0.00 0.00 55.95 58.86 3eeq s SER 168 Cb -0.15 -2.58 -0.01 0.00 0.10 0.00 0.00 66.02 63.38 3eeq s SER 168 CO 0.55 -0.18 -0.21 -0.63 0.98 0.00 0.00 173.24 173.75 3eeq s ILE 169 N 0.45 1.72 0.31 -1.02 1.01 -1.24 -4.31 121.20 118.12 3eeq s ILE 169 Ca 0.50 -0.88 -0.17 0.00 0.00 0.00 0.00 60.65 60.10 3eeq s ILE 169 Cb -0.23 -1.46 -0.09 0.00 0.01 0.00 0.00 42.46 40.68 3eeq s ILE 169 CO 0.29 0.49 0.76 0.00 0.00 0.00 0.00 174.94 176.48 3eeq s ILE 171 N -1.88 1.55 -0.12 0.00 1.01 -0.30 -0.52 121.20 120.94 3eeq s ILE 171 Ca 0.52 -0.79 0.01 0.00 0.00 0.00 0.00 60.65 60.39 3eeq s ILE 171 Cb -0.12 -1.56 -0.01 0.00 0.01 0.00 0.00 42.46 40.78 3eeq s ILE 171 CO 0.18 0.30 -0.17 -0.62 0.00 0.00 0.00 174.94 174.63 3eeq s ASP 172 N 1.46 3.72 0.00 3.58 2.15 0.11 -4.50 116.67 123.21 3eeq s ASP 172 Ca 0.02 -0.40 0.00 0.00 0.43 0.00 0.00 52.55 52.60 3eeq s ASP 172 Cb -0.15 -1.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.94 3eeq s ASP 172 CO -0.09 0.17 0.00 0.61 -0.17 0.00 0.00 175.17 175.68 3eeq n GLY 173 N 3.50 0.65 0.00 2.66 0.00 -1.26 0.42 105.19 111.16 3eeq n GLY 173 Ca -0.18 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.49 3eeq n GLY 173 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3eeq n ILE 174 N -0.97 0.00 -4.61 -0.61 2.08 -1.26 -4.62 119.36 109.37 3eeq n ILE 174 Ca 0.00 0.00 -0.32 0.00 0.56 0.00 0.00 62.75 62.99 3eeq n ILE 174 Cb 0.32 0.00 -0.11 0.00 -0.75 0.00 0.00 39.64 39.09 3eeq n ILE 174 CO 0.00 0.00 0.00 0.20 0.56 0.00 0.00 176.55 177.31 3eeq s ASN 177 N -1.00 4.36 -0.04 4.38 0.02 -1.26 -5.21 114.94 116.20 3eeq s ASN 177 Ca 0.00 -0.18 0.02 0.00 -1.02 0.00 0.00 52.86 51.68 3eeq s ASN 177 Cb 0.00 -0.96 0.01 0.00 0.02 0.00 0.00 41.25 40.31 3eeq s ASN 177 CO 0.00 0.30 -0.10 0.54 0.02 0.00 0.00 177.10 177.87 3eeq s VAL 178 N -0.90 0.90 -0.64 1.60 0.11 -1.26 -5.06 120.40 115.14 3eeq s VAL 178 Ca 0.15 -0.38 -0.26 0.00 -2.93 0.00 0.00 61.98 58.56 3eeq s VAL 178 Cb -0.11 -0.82 -0.11 0.00 -1.53 0.00 0.00 36.38 33.82 3eeq s VAL 178 CO 0.05 0.29 2.42 -0.46 -3.33 0.00 0.00 175.10 174.07 3eeq n ASN 179 N 3.56 1.99 -4.09 3.54 6.94 -1.26 -4.89 115.26 121.05 3eeq n ASN 179 Ca -0.21 -0.94 -0.28 0.00 -0.02 0.00 0.00 54.58 53.13 3eeq n ASN 179 Cb 0.53 -1.59 -0.17 0.00 -2.36 0.00 0.00 39.78 36.19 3eeq n ASN 179 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 3eeq s PHE 180 N 13.19 1.95 0.03 -2.53 0.08 -1.26 -5.12 117.98 124.32 3eeq s PHE 180 Ca 0.97 -0.83 0.00 0.00 0.12 0.00 0.00 56.93 57.19 3eeq s PHE 180 Cb -0.19 -1.38 0.00 0.00 -0.57 0.00 0.00 43.02 40.89 3eeq s PHE 180 CO 0.19 -0.39 0.00 -2.30 -0.10 0.00 0.00 175.22 172.62 3eeq n PRO 181 N 3.89 0.71 -0.03 0.24 -0.02 -1.26 -4.78 135.00 133.75 3eeq n PRO 181 Ca -0.20 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.21 3eeq n PRO 181 Cb 0.52 -0.07 -0.13 0.00 -0.02 0.00 0.00 33.50 33.80 3eeq n PRO 181 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 3eeq n GLU 182 N 0.20 0.64 0.39 -0.52 0.00 -1.26 -4.09 120.64 116.01 3eeq n GLU 182 Ca 0.00 0.21 -0.19 0.00 0.00 0.00 0.00 57.16 57.18 3eeq n GLU 182 Cb 0.00 -1.74 -0.09 0.00 0.00 0.00 0.00 31.44 29.61 3eeq n GLU 182 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.13 174.18 3eeq h ASN 183 N 0.00 -1.13 -1.10 -1.84 -1.07 -1.90 -3.41 115.58 105.13 3eeq h ASN 183 Ca -0.31 0.07 -0.73 0.00 0.07 0.00 0.00 56.30 55.40 3eeq h ASN 183 Cb 1.96 0.33 -0.01 0.00 -2.07 0.00 0.00 38.32 38.54 3eeq h ASN 183 CO 0.06 -0.69 1.14 -0.38 0.07 0.00 0.00 177.43 177.63 3eeq n ILE 184 N -5.58 0.20 -3.98 6.14 -0.00 -1.25 -3.63 119.36 111.25 3eeq n ILE 184 Ca -0.14 -0.11 -0.35 0.00 -0.00 0.00 0.00 62.75 62.15 3eeq n ILE 184 Cb 0.46 -1.21 -0.12 0.00 -0.00 0.00 0.00 39.64 38.78 3eeq n ILE 184 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 176.55 174.96 3eeq s LYS 185 N 4.86 3.69 -0.66 0.38 -2.85 -0.28 -4.89 119.74 119.99 3eeq s LYS 185 Ca 1.06 -0.48 0.04 0.00 -1.00 0.00 0.00 55.97 55.59 3eeq s LYS 185 Cb -1.10 -3.17 0.34 0.00 -2.06 0.00 0.00 37.83 31.85 3eeq s LYS 185 CO 0.61 0.01 1.16 1.33 0.10 0.00 0.00 175.35 178.56 3eeq n VAL 186 N 4.29 3.62 0.00 1.79 0.24 -1.26 -1.16 118.33 125.86 3eeq n VAL 186 Ca -0.17 -5.57 0.00 0.00 -2.04 0.00 0.00 64.34 56.56 3eeq n VAL 186 Cb 0.52 -1.41 0.00 0.00 -1.47 0.00 0.00 33.84 31.47 3eeq n VAL 186 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3eeq h SER 192 N 0.00 0.00 -3.76 0.00 0.02 -1.94 -3.45 113.55 104.42 3eeq h SER 192 Ca 0.00 -0.01 -0.68 0.00 -0.84 0.00 0.00 61.79 60.26 3eeq h SER 192 Cb 0.00 0.00 -0.32 0.00 0.14 0.00 0.00 62.40 62.22 3eeq h SER 192 CO 0.00 0.01 -0.88 -0.31 -1.14 0.00 0.00 176.83 174.50 3eeq s TYR 193 N -3.26 2.45 -0.08 3.45 2.02 -1.26 -1.18 117.35 119.50 3eeq s TYR 193 Ca 0.04 -0.84 0.04 0.00 -0.37 0.00 0.00 57.07 55.94 3eeq s TYR 193 Cb 0.07 -1.62 0.00 0.00 -0.40 0.00 0.00 41.96 40.02 3eeq s TYR 193 CO 0.71 -0.29 -0.19 0.42 -1.57 0.00 0.00 175.55 174.63 3eeq s ILE 194 N 0.04 1.67 -0.28 2.71 -1.09 0.60 -0.29 121.20 124.57 3eeq s ILE 194 Ca -0.09 -0.81 -0.05 0.00 -2.23 0.00 0.00 60.65 57.47 3eeq s ILE 194 Cb -0.15 -1.46 0.01 0.00 -1.58 0.00 0.00 42.46 39.27 3eeq s ILE 194 CO 0.06 0.47 0.04 -0.63 -1.23 0.00 0.00 174.94 173.65 3eeq s ILE 195 N 0.38 3.70 -0.07 2.92 1.01 0.32 -0.75 121.20 128.71 3eeq s ILE 195 Ca -0.15 -0.72 0.03 0.00 0.00 0.00 0.00 60.65 59.81 3eeq s ILE 195 Cb -0.16 -2.88 -0.02 0.00 0.01 0.00 0.00 42.46 39.41 3eeq s ILE 195 CO 0.06 0.15 -0.14 -0.55 0.00 0.00 0.00 174.94 174.46 3eeq s SER 196 N 1.47 4.02 0.00 3.58 0.15 0.81 0.10 113.70 123.83 3eeq s SER 196 Ca 0.03 -0.23 0.03 0.00 0.70 0.00 0.00 55.95 56.47 3eeq s SER 196 Cb -0.17 -1.07 0.08 0.00 -1.71 0.00 0.00 66.02 63.15 3eeq s SER 196 CO 0.01 0.29 1.03 0.18 1.20 0.00 0.00 173.24 175.95 3eeq n LEU 197 N 2.66 2.17 0.00 3.45 4.77 0.17 0.84 117.00 131.07 3eeq n LEU 197 Ca -0.17 -1.90 0.00 0.00 -0.03 0.00 0.00 56.01 53.90 3eeq n LEU 197 Cb 0.52 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 3eeq n LEU 197 CO 0.27 0.54 0.00 0.54 -1.33 0.00 0.00 177.39 177.41 3eeq n ARG 198 N -0.17 3.47 0.00 3.23 5.12 -1.24 -4.87 116.66 122.21 3eeq n ARG 198 Ca 0.03 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.95 3eeq n ARG 198 Cb 0.28 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.58 3eeq n ARG 198 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 3eeq n ASP 200 N 0.00 0.00 -3.57 0.55 5.75 -1.26 -4.98 116.55 113.03 3eeq n ASP 200 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 54.79 54.76 3eeq n ASP 200 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 3eeq n ASP 200 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 3eeq s LYS 201 N -0.89 1.08 0.06 0.11 -2.85 -1.26 -5.19 119.74 110.80 3eeq s LYS 201 Ca 0.00 -0.65 -0.05 0.00 -1.00 0.00 0.00 55.97 54.28 3eeq s LYS 201 Cb 0.00 0.33 -0.02 0.00 -2.06 0.00 0.00 37.83 36.08 3eeq s LYS 201 CO 0.00 -0.50 0.07 -1.21 0.10 0.00 0.00 175.35 173.81 3eeq s GLU 202 N -2.62 0.70 -0.07 1.78 8.01 -1.26 -5.15 118.70 120.08 3eeq s GLU 202 Ca 0.17 -1.05 -0.03 0.00 0.01 0.00 0.00 54.97 54.08 3eeq s GLU 202 Cb -0.01 0.26 0.04 0.00 -4.31 0.00 0.00 34.13 30.12 3eeq s GLU 202 CO 0.02 -0.18 0.08 0.71 0.01 0.00 0.00 175.26 175.91 3eeq s TYR 203 N -3.71 0.06 -0.20 1.61 2.02 -1.26 -5.13 117.35 110.74 3eeq s TYR 203 Ca 0.04 0.17 -0.16 0.00 -0.37 0.00 0.00 57.07 56.76 3eeq s TYR 203 Cb 0.05 -0.50 -0.04 0.00 -0.40 0.00 0.00 41.96 41.07 3eeq s TYR 203 CO -0.10 -0.27 0.39 0.15 -1.57 0.00 0.00 175.55 174.15 3eeq s LYS 204 N 2.18 4.17 -0.78 -0.62 1.02 -1.26 -4.04 119.74 120.41 3eeq s LYS 204 Ca 0.04 0.17 0.00 0.00 0.02 0.00 0.00 55.97 56.21 3eeq s LYS 204 Cb -0.13 -3.54 0.00 0.00 -0.52 0.00 0.00 37.83 33.64 3eeq s LYS 204 CO -0.05 -0.03 0.00 -0.25 -0.92 0.00 0.00 175.35 174.10 3eeq n ASP 205 N 4.46 -4.19 -4.57 2.83 8.00 -1.26 -5.01 116.55 116.82 3eeq n ASP 205 Ca -0.09 0.18 -0.28 0.00 0.71 0.00 0.00 54.79 55.31 3eeq n ASP 205 Cb 0.51 -2.33 -0.10 0.00 -0.02 0.00 0.00 41.12 39.18 3eeq n ASP 205 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3eeq s LYS 206 N -2.37 2.06 -0.23 -1.24 -0.14 -1.26 -4.98 119.74 111.59 3eeq s LYS 206 Ca 0.00 -1.16 -0.16 0.00 -1.36 0.00 0.00 55.97 53.28 3eeq s LYS 206 Cb 0.00 -2.21 -0.04 0.00 -1.68 0.00 0.00 37.83 33.90 3eeq s LYS 206 CO 0.00 0.47 0.42 0.42 -0.76 0.00 0.00 175.35 175.90 3eeq s ILE 207 N -1.46 5.16 -0.09 2.17 1.01 -0.32 -4.96 121.20 122.71 3eeq s ILE 207 Ca 0.23 0.73 0.02 0.00 0.00 0.00 0.00 60.65 61.62 3eeq s ILE 207 Cb -0.10 -3.75 0.01 0.00 0.01 0.00 0.00 42.46 38.64 3eeq s ILE 207 CO 0.14 0.19 -0.14 -0.69 0.00 0.00 0.00 174.94 174.44 3eeq s VAL 208 N 1.69 1.37 -0.13 2.92 1.01 -1.26 -0.29 120.40 125.71 3eeq s VAL 208 Ca 0.19 -0.59 -0.01 0.00 0.00 0.00 0.00 61.98 61.57 3eeq s VAL 208 Cb -0.15 -1.25 -0.02 0.00 0.00 0.00 0.00 36.38 34.96 3eeq s VAL 208 CO 0.09 0.41 -0.11 -0.69 0.00 0.00 0.00 175.10 174.80 3eeq s VAL 209 N 0.82 3.25 -0.16 2.92 1.01 0.07 -4.87 120.40 123.43 3eeq s VAL 209 Ca -0.11 -0.59 -0.10 0.00 0.00 0.00 0.00 61.98 61.18 3eeq s VAL 209 Cb -0.16 -2.37 -0.05 0.00 0.00 0.00 0.00 36.38 33.80 3eeq s VAL 209 CO 0.02 0.52 0.17 0.26 0.00 0.00 0.00 175.10 176.07 3eeq s TRP 210 N 0.30 3.50 -0.06 5.22 0.52 -1.26 -0.13 118.94 127.03 3eeq s TRP 210 Ca -0.09 0.47 0.05 0.00 0.02 0.00 0.00 56.10 56.56 3eeq s TRP 210 Cb -0.15 -2.12 -0.01 0.00 -1.15 0.00 0.00 33.47 30.04 3eeq s TRP 210 CO 0.05 0.45 -0.23 -0.51 0.02 0.00 0.00 176.95 176.73 3eeq s LEU 211 N -0.17 2.03 -0.35 2.99 1.43 0.25 -2.59 118.68 122.26 3eeq s LEU 211 Ca 0.12 -0.47 -0.10 0.00 -1.03 0.00 0.00 54.13 52.65 3eeq s LEU 211 Cb -0.12 -1.26 0.02 0.00 0.03 0.00 0.00 46.19 44.85 3eeq s LEU 211 CO 0.02 0.21 0.18 -0.75 0.23 0.00 0.00 176.35 176.24 3eeq s LYS 212 N -0.07 2.97 0.21 1.70 2.47 -0.43 -4.18 119.74 122.41 3eeq s LYS 212 Ca -0.05 -0.97 -0.31 0.00 -1.56 0.00 0.00 55.97 53.08 3eeq s LYS 212 Cb -0.13 -3.67 -0.11 0.00 -1.46 0.00 0.00 37.83 32.46 3eeq s LYS 212 CO 0.04 -0.61 1.60 -2.14 0.16 0.00 0.00 175.35 174.40 3eeq s PRO 213 N 1.56 4.18 0.36 4.03 0.02 -1.26 0.28 135.00 144.17 3eeq s PRO 213 Ca 0.03 2.46 -0.09 0.00 0.02 0.00 0.00 61.00 63.41 3eeq s PRO 213 Cb -0.18 -3.11 -0.06 0.00 0.02 0.00 0.00 34.50 31.16 3eeq s PRO 213 CO 0.06 -0.63 0.70 -0.51 -0.33 0.00 0.00 177.00 176.29 3eeq s LEU 214 N 0.74 3.93 0.69 -5.54 1.43 -0.83 -4.90 118.68 114.20 3eeq s LEU 214 Ca 0.69 1.02 -0.05 0.00 -1.03 0.00 0.00 54.13 54.77 3eeq s LEU 214 Cb -0.46 -3.88 0.07 0.00 0.03 0.00 0.00 46.19 41.96 3eeq s LEU 214 CO 0.35 -0.31 0.98 -0.54 0.23 0.00 0.00 176.35 177.06 3eeq s LYS 215 N -3.63 2.09 0.10 1.70 1.02 -1.26 -4.85 119.74 114.91 3eeq s LYS 215 Ca 0.49 -0.49 0.08 0.00 0.02 0.00 0.00 55.97 56.07 3eeq s LYS 215 Cb -0.10 -2.24 -0.04 0.00 -0.52 0.00 0.00 37.83 34.93 3eeq s LYS 215 CO 0.29 -1.24 -0.15 0.96 -0.92 0.00 0.00 175.35 174.29 3eeq s ILE 216 N -3.17 3.02 -0.33 2.17 -4.36 0.19 -1.27 121.20 117.45 3eeq s ILE 216 Ca 0.61 -1.35 -0.15 0.00 -0.26 0.00 0.00 60.65 59.50 3eeq s ILE 216 Cb -0.09 -2.37 -0.02 0.00 1.25 0.00 0.00 42.46 41.23 3eeq s ILE 216 CO 0.44 0.15 0.37 -0.55 0.24 0.00 0.00 174.94 175.59 3eeq s SER 217 N -2.02 6.20 -0.23 4.36 0.15 0.06 -0.82 113.70 121.40 3eeq s SER 217 Ca 0.18 -0.10 -0.14 0.00 0.70 0.00 0.00 55.95 56.59 3eeq s SER 217 Cb -0.11 -2.20 -0.04 0.00 -1.71 0.00 0.00 66.02 61.96 3eeq s SER 217 CO 0.10 -0.31 0.30 -0.63 1.20 0.00 0.00 173.24 173.90 3eeq s ILE 218 N 2.06 5.25 -0.10 6.45 1.01 -0.25 -1.48 121.20 134.15 3eeq s ILE 218 Ca 0.13 0.47 -0.01 0.00 0.00 0.00 0.00 60.65 61.24 3eeq s ILE 218 Cb -0.16 -3.63 -0.03 0.00 0.01 0.00 0.00 42.46 38.64 3eeq s ILE 218 CO 0.11 0.26 -0.04 -0.83 0.00 0.00 0.00 174.94 174.45 3eeq s GLY 219 N 1.23 1.75 -0.13 6.18 0.00 -0.81 -0.27 107.32 115.27 3eeq s GLY 219 Ca 0.14 -0.84 0.02 0.00 0.00 0.00 0.00 44.72 44.03 3eeq s GLY 219 CO 0.07 -0.47 -0.18 -0.42 0.00 0.00 0.00 173.10 172.11 3eeq s ILE 220 N -0.51 1.74 -0.26 0.90 -1.09 -0.01 -2.26 121.20 119.71 3eeq s ILE 220 Ca 0.08 -0.78 -0.15 0.00 -2.23 0.00 0.00 60.65 57.58 3eeq s ILE 220 Cb -0.12 -1.57 -0.04 0.00 -1.58 0.00 0.00 42.46 39.15 3eeq s ILE 220 CO 0.02 0.49 0.35 -0.83 -1.23 0.00 0.00 174.94 173.74 3eeq s GLY 221 N 1.00 1.92 0.02 6.18 0.00 -0.31 -4.37 107.32 111.76 3eeq s GLY 221 Ca -0.05 -0.79 0.01 0.00 0.00 0.00 0.00 44.72 43.88 3eeq s GLY 221 CO -0.03 0.90 -0.04 -0.45 0.00 0.00 0.00 173.10 173.48 3eeq s SER 222 N 1.52 0.36 0.91 1.64 0.15 -1.26 -0.99 113.70 116.03 3eeq s SER 222 Ca 0.15 -0.40 -0.11 0.00 0.70 0.00 0.00 55.95 56.28 3eeq s SER 222 Cb -0.15 0.06 0.14 0.00 -1.71 0.00 0.00 66.02 64.35 3eeq s SER 222 CO 0.09 -0.21 1.09 -1.59 1.20 0.00 0.00 173.24 173.83 3eeq s LYS 223 N -1.16 1.11 0.21 5.44 0.00 -0.55 -4.93 119.74 119.87 3eeq s LYS 223 Ca -0.11 0.98 -0.09 0.00 0.00 0.00 0.00 55.97 56.75 3eeq s LYS 223 Cb -0.08 -1.78 0.21 0.00 0.00 0.00 0.00 37.83 36.18 3eeq s LYS 223 CO -0.00 -2.38 1.86 0.87 0.00 0.00 0.00 175.35 175.69 3eeq h LYS 224 N -1.66 0.89 -4.53 1.78 1.79 -2.01 -2.93 116.57 109.90 3eeq h LYS 224 Ca -0.49 -0.05 -0.69 0.00 -2.18 0.00 0.00 60.65 57.24 3eeq h LYS 224 Cb 1.28 -0.20 -0.04 0.00 -1.58 0.00 0.00 32.23 31.69 3eeq h LYS 224 CO 0.52 0.59 2.80 -0.40 -1.08 0.00 0.00 179.45 181.88 3eeq n ASP 225 N -4.63 4.02 -4.57 0.86 5.75 -1.26 -4.94 116.55 111.78 3eeq n ASP 225 Ca 0.08 -2.85 -0.54 0.00 -0.01 0.00 0.00 54.79 51.48 3eeq n ASP 225 Cb 0.09 -1.65 -0.06 0.00 -1.03 0.00 0.00 41.12 38.47 3eeq n ASP 225 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 3eeq n VAL 226 N 5.55 0.00 -3.02 2.12 0.31 -1.11 -4.85 118.33 117.34 3eeq n VAL 226 Ca 0.51 -0.00 -0.44 0.00 -0.01 0.00 0.00 64.34 64.39 3eeq n VAL 226 Cb 0.41 -0.62 -0.03 0.00 -0.91 0.00 0.00 33.84 32.69 3eeq n VAL 226 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 3eeq s LYS 227 N 0.36 3.41 0.28 5.55 0.00 -1.26 -4.96 119.74 123.11 3eeq s LYS 227 Ca 0.86 -1.64 0.01 0.00 0.00 0.00 0.00 55.97 55.20 3eeq s LYS 227 Cb -1.03 -4.60 0.59 0.00 0.00 0.00 0.00 37.83 32.79 3eeq s LYS 227 CO 0.49 -1.65 1.78 0.52 0.00 0.00 0.00 175.35 176.49 3eeq h MET 228 N 8.85 0.71 -0.22 1.78 2.86 -2.00 -3.06 114.93 123.85 3eeq h MET 228 Ca -0.01 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 3eeq h MET 228 Cb 1.05 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.54 3eeq h MET 228 CO 1.06 0.47 0.00 1.49 1.06 0.00 0.00 176.91 180.99 3eeq h GLU 229 N 0.73 0.39 0.00 1.72 4.57 -2.01 -1.50 114.58 118.49 3eeq h GLU 229 Ca 0.50 -0.13 -0.06 0.00 -1.18 0.00 0.00 59.36 58.49 3eeq h GLU 229 Cb 0.68 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.23 3eeq h GLU 229 CO -0.35 0.58 -0.30 1.05 -1.18 0.00 0.00 179.01 178.82 3eeq h GLU 230 N 0.16 0.00 -0.59 1.92 4.11 -1.98 -1.42 114.58 116.77 3eeq h GLU 230 Ca 0.06 0.00 -0.10 0.00 0.07 0.00 0.00 59.36 59.39 3eeq h GLU 230 Cb 0.40 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 3eeq h GLU 230 CO 0.01 0.30 -0.03 0.82 0.07 0.00 0.00 179.01 180.18 3eeq h ILE 231 N 0.00 1.27 -0.51 -1.06 2.04 -1.36 -3.02 117.51 114.86 3eeq h ILE 231 Ca -0.00 -1.19 0.09 0.00 1.00 0.00 0.00 64.86 64.76 3eeq h ILE 231 Cb 0.62 0.85 -0.07 0.00 -0.74 0.00 0.00 36.82 37.48 3eeq h ILE 231 CO 0.04 0.43 0.11 -0.09 0.00 0.00 0.00 178.15 178.64 3eeq h ARG 232 N 0.95 0.24 0.23 2.37 2.43 -0.24 -3.02 114.38 117.35 3eeq h ARG 232 Ca 0.16 -0.01 -0.33 0.00 -0.81 0.00 0.00 59.98 58.99 3eeq h ARG 232 Cb 0.59 -0.05 0.03 0.00 -0.42 0.00 0.00 29.97 30.12 3eeq h ARG 232 CO 0.04 0.16 -1.49 -0.44 -1.51 0.00 0.00 179.97 176.73 3eeq h ASP 233 N 0.25 0.77 -0.97 -3.80 3.32 -1.62 -2.90 116.42 111.47 3eeq h ASP 233 Ca 0.26 -0.85 0.31 0.00 0.02 0.00 0.00 57.03 56.77 3eeq h ASP 233 Cb 0.35 -0.25 -0.17 0.00 0.22 0.00 0.00 39.33 39.48 3eeq h ASP 233 CO -0.33 1.67 0.26 1.23 -1.72 0.00 0.00 179.24 180.35 3eeq h GLY 234 N 0.43 1.63 0.99 2.75 0.00 -1.57 0.83 103.07 108.13 3eeq h GLY 234 Ca -0.25 -0.01 -0.07 0.00 0.00 0.00 0.00 47.33 47.00 3eeq h GLY 234 CO 0.26 -0.56 0.02 -2.22 0.00 0.00 0.00 176.54 174.04 3eeq h ILE 235 N 0.08 1.26 -0.28 2.60 2.04 -1.37 -0.15 117.51 121.69 3eeq h ILE 235 Ca 0.67 -1.03 0.00 0.00 1.00 0.00 0.00 64.86 65.51 3eeq h ILE 235 Cb 1.52 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.58 3eeq h ILE 235 CO -0.79 0.36 0.18 1.88 0.00 0.00 0.00 178.15 179.78 3eeq h TYR 236 N 0.67 0.34 0.00 1.37 -1.99 -1.10 -0.45 116.97 115.81 3eeq h TYR 236 Ca 0.13 0.01 -0.06 0.00 2.00 0.00 0.00 58.73 60.81 3eeq h TYR 236 Cb 0.48 -0.12 -0.01 0.00 2.00 0.00 0.00 36.73 39.08 3eeq h TYR 236 CO 0.04 0.22 -0.30 0.87 -0.00 0.00 0.00 178.16 178.98 3eeq h LYS 237 N 0.37 0.00 -0.37 4.88 1.57 0.73 -0.19 116.57 123.57 3eeq h LYS 237 Ca 0.10 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.75 3eeq h LYS 237 Cb -0.04 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 3eeq h LYS 237 CO -0.03 0.30 -0.30 0.28 -0.57 0.00 0.00 179.45 179.14 3eeq h VAL 238 N 0.00 1.28 -0.80 0.50 2.07 -0.77 -2.55 116.25 115.98 3eeq h VAL 238 Ca -0.00 -1.46 -0.05 0.00 0.82 0.00 0.00 66.70 66.01 3eeq h VAL 238 Cb 0.54 1.39 -0.04 0.00 -1.52 0.00 0.00 31.29 31.66 3eeq h VAL 238 CO 0.04 0.48 0.32 -0.07 0.02 0.00 0.00 177.57 178.36 3eeq h LEU 239 N 0.66 1.11 0.54 2.57 3.38 0.60 -1.84 115.31 122.33 3eeq h LEU 239 Ca 0.07 -0.17 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 3eeq h LEU 239 Cb 0.87 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 3eeq h LEU 239 CO 0.08 0.98 -0.48 -0.33 0.09 0.00 0.00 178.44 178.78 3eeq h GLU 240 N 1.17 -0.97 -1.07 1.13 5.08 -1.23 -0.12 114.58 118.57 3eeq h GLU 240 Ca 0.27 0.07 0.29 0.00 -1.00 0.00 0.00 59.36 58.98 3eeq h GLU 240 Cb 0.22 0.22 -0.08 0.00 0.50 0.00 0.00 28.75 29.62 3eeq h GLU 240 CO -0.02 -0.65 0.72 -0.09 -1.00 0.00 0.00 179.01 177.97 3eeq h ARG 241 N -1.01 0.24 -0.04 2.33 9.65 -1.22 0.90 114.38 125.23 3eeq h ARG 241 Ca -0.07 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.80 3eeq h ARG 241 Cb 0.87 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.39 3eeq h ARG 241 CO -0.03 0.16 0.00 1.28 2.80 0.00 0.00 179.97 184.18 3eeq n LEU 242 N -4.47 2.35 -3.47 3.80 4.77 -0.71 -4.95 117.00 114.33 3eeq n LEU 242 Ca 0.25 -0.80 -0.21 0.00 -0.03 0.00 0.00 56.01 55.22 3eeq n LEU 242 Cb 0.99 -0.01 0.06 0.00 -2.33 0.00 0.00 43.42 42.13 3eeq n LEU 242 CO 0.31 0.40 -0.01 0.59 -1.33 0.00 0.00 177.39 177.35 3eeq n ASN 243 N 0.84 -4.79 -4.11 -1.43 3.02 0.31 -5.02 115.26 104.08 3eeq n ASN 243 Ca 0.16 -0.80 -0.12 0.00 -0.03 0.00 0.00 54.58 53.79 3eeq n ASN 243 Cb 0.49 -4.50 -0.11 0.00 -0.61 0.00 0.00 39.78 35.05 3eeq n ASN 243 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3eeq s LEU 244 N -6.02 2.38 0.50 3.41 1.43 -0.13 -5.03 118.68 115.22 3eeq s LEU 244 Ca 0.33 -0.77 0.07 0.00 -1.03 0.00 0.00 54.13 52.73 3eeq s LEU 244 Cb -0.07 -0.11 0.02 0.00 0.03 0.00 0.00 46.19 46.06 3eeq s LEU 244 CO 0.78 -0.34 0.44 -1.59 0.23 0.00 0.00 176.35 175.88 3eeq s LYS 245 N -2.67 2.37 0.20 1.70 0.00 -1.26 -4.33 119.74 115.74 3eeq s LYS 245 Ca 0.00 -1.78 -0.11 0.00 0.00 0.00 0.00 55.97 54.09 3eeq s LYS 245 Cb -0.02 -2.28 0.26 0.00 0.00 0.00 0.00 37.83 35.78 3eeq s LYS 245 CO -0.02 -0.48 1.72 0.00 0.00 0.00 0.00 175.35 176.57 3eeq h ARG 246 N 0.80 0.29 -0.06 1.78 3.08 -1.98 0.26 114.38 118.54 3eeq h ARG 246 Ca -0.38 -0.02 0.02 0.00 0.07 0.00 0.00 59.98 59.67 3eeq h ARG 246 Cb 1.29 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 31.27 3eeq h ARG 246 CO 0.55 0.19 0.94 -0.85 -1.07 0.00 0.00 179.97 179.73 3eeq n GLU 247 N -5.08 0.03 0.10 0.04 -0.00 -1.26 0.31 120.64 114.78 3eeq n GLU 247 Ca 0.08 0.88 0.12 0.00 -0.00 0.00 0.00 57.16 58.24 3eeq n GLU 247 Cb 0.28 -2.38 0.15 0.00 -0.00 0.00 0.00 31.44 29.50 3eeq n GLU 247 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3eeq h ARG 248 N 0.00 0.00 -6.11 3.44 2.47 -1.32 -3.44 114.38 109.42 3eeq h ARG 248 Ca 0.03 0.00 -0.52 0.00 -1.26 0.00 0.00 59.98 58.23 3eeq h ARG 248 Cb 1.91 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 30.19 3eeq h ARG 248 CO -0.00 0.00 1.28 0.42 0.56 0.00 0.00 179.97 182.23 3eeq s ILE 249 N -3.22 3.47 0.13 2.04 1.01 0.94 0.57 121.20 126.13 3eeq s ILE 249 Ca 0.05 0.32 0.23 0.00 0.00 0.00 0.00 60.65 61.26 3eeq s ILE 249 Cb 0.11 -4.07 0.22 0.00 0.01 0.00 0.00 42.46 38.73 3eeq s ILE 249 CO 0.72 -0.98 1.82 1.23 0.00 0.00 0.00 174.94 177.72 3eeq h GLY 250 N 15.31 0.00 -5.27 6.18 0.00 -1.27 -3.46 103.07 114.57 3eeq h GLY 250 Ca -0.27 0.00 0.21 0.00 0.00 0.00 0.00 47.33 47.27 3eeq h GLY 250 CO 1.20 0.00 0.89 -1.50 0.00 0.00 0.00 176.54 177.13 3eeq s ILE 251 N -3.64 0.00 0.03 2.60 2.07 -1.10 -4.39 121.20 116.78 3eeq s ILE 251 Ca 0.01 0.00 0.08 0.00 -1.41 0.00 0.00 60.65 59.33 3eeq s ILE 251 Cb 0.10 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.67 3eeq s ILE 251 CO 0.64 0.00 -0.24 -0.63 -1.91 0.00 0.00 174.94 172.80 3eeq s ILE 252 N -0.62 1.92 -0.07 2.00 1.01 -0.71 -1.09 121.20 123.64 3eeq s ILE 252 Ca 0.08 -1.26 -0.07 0.00 0.00 0.00 0.00 60.65 59.40 3eeq s ILE 252 Cb -0.02 -1.64 0.02 0.00 0.01 0.00 0.00 42.46 40.82 3eeq s ILE 252 CO -0.10 0.33 0.19 0.00 0.00 0.00 0.00 174.94 175.36 3eeq s ALA 253 N -0.76 -0.47 0.26 9.38 0.00 0.62 -0.05 121.76 130.74 3eeq s ALA 253 Ca 0.10 0.51 -0.18 0.00 0.00 0.00 0.00 51.96 52.39 3eeq s ALA 253 Cb -0.09 -0.30 0.01 0.00 0.00 0.00 0.00 23.12 22.74 3eeq s ALA 253 CO 0.01 -0.10 0.62 0.45 0.00 0.00 0.00 175.76 176.75 3eeq s SER 254 N 0.04 -0.21 0.00 0.00 0.15 -0.92 -0.83 113.70 111.92 3eeq s SER 254 Ca -0.01 -0.69 0.28 0.00 0.70 0.00 0.00 55.95 56.24 3eeq s SER 254 Cb -0.02 0.67 1.15 0.00 -1.71 0.00 0.00 66.02 66.11 3eeq s SER 254 CO 0.00 -1.25 1.80 2.30 1.20 0.00 0.00 173.24 177.29 3eeq n ILE 255 N -0.42 0.00 -3.76 6.45 -5.35 -1.26 -0.33 119.36 114.69 3eeq n ILE 255 Ca -0.04 -0.17 -0.36 0.00 -0.27 0.00 0.00 62.75 61.91 3eeq n ILE 255 Cb 0.60 0.26 -0.12 0.00 -1.74 0.00 0.00 39.64 38.64 3eeq n ILE 255 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 3eeq s ARG 256 N -2.15 3.70 0.45 6.28 1.81 -1.26 -4.81 118.95 122.97 3eeq s ARG 256 Ca 0.36 -0.46 0.22 0.00 -1.72 0.00 0.00 55.73 54.13 3eeq s ARG 256 Cb 0.21 -3.35 1.05 0.00 -0.45 0.00 0.00 34.95 32.41 3eeq s ARG 256 CO 0.39 -0.16 1.91 1.49 -0.68 0.00 0.00 175.30 178.25 3eeq h GLU 257 N 8.16 0.00 0.00 3.54 4.57 -1.98 -2.46 114.58 126.41 3eeq h GLU 257 Ca -0.38 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 57.80 3eeq h GLU 257 Cb 1.18 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.77 3eeq h GLU 257 CO 0.58 0.24 -0.02 1.05 -1.18 0.00 0.00 179.01 179.68 3eeq h GLU 258 N 0.00 0.00 0.00 1.92 9.09 -1.98 -1.30 114.58 122.31 3eeq h GLU 258 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3eeq h GLU 258 Cb 0.58 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.68 3eeq h GLU 258 CO 0.03 0.02 0.00 0.28 0.05 0.00 0.00 179.01 179.39 3eeq h VAL 259 N 0.00 0.00 0.00 -1.06 2.07 -1.87 -2.11 116.25 113.28 3eeq h VAL 259 Ca -0.00 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 3eeq h VAL 259 Cb 0.35 0.78 -0.00 0.00 -1.52 0.00 0.00 31.29 30.90 3eeq h VAL 259 CO 0.00 0.00 -0.11 0.50 0.02 0.00 0.00 177.57 177.99 3eeq h LYS 260 N 0.00 0.00 -0.08 1.57 3.64 -1.44 -1.50 116.57 118.76 3eeq h LYS 260 Ca 0.00 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.30 3eeq h LYS 260 Cb 0.16 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 3eeq h LYS 260 CO 0.00 0.11 -0.31 0.87 -2.27 0.00 0.00 179.45 177.84 3eeq h LYS 261 N 0.00 0.15 0.01 1.90 1.57 -1.60 -0.56 116.57 118.04 3eeq h LYS 261 Ca -0.00 -0.05 -0.21 0.00 -1.87 0.00 0.00 60.65 58.51 3eeq h LYS 261 Cb 0.21 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 3eeq h LYS 261 CO 0.01 0.46 -0.91 0.82 -0.57 0.00 0.00 179.45 179.26 3eeq h ILE 262 N 0.13 1.46 -0.58 1.86 2.04 -1.47 -2.85 117.51 118.11 3eeq h ILE 262 Ca 0.02 -2.58 -0.11 0.00 1.00 0.00 0.00 64.86 63.19 3eeq h ILE 262 Cb 0.63 2.47 -0.02 0.00 -0.74 0.00 0.00 36.82 39.16 3eeq h ILE 262 CO 0.05 0.76 -0.06 0.00 0.00 0.00 0.00 178.15 178.89 3eeq h ALA 263 N 0.88 0.80 -0.51 1.87 0.00 -0.46 -2.85 119.26 118.98 3eeq h ALA 263 Ca -0.06 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.53 3eeq h ALA 263 Cb 1.55 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 19.10 3eeq h ALA 263 CO 0.15 0.67 0.33 -0.44 0.00 0.00 0.00 179.25 179.95 3eeq h ASP 264 N 0.95 0.55 -0.88 0.00 3.32 -1.15 0.77 116.42 119.97 3eeq h ASP 264 Ca 0.16 -0.01 0.21 0.00 0.02 0.00 0.00 57.03 57.41 3eeq h ASP 264 Cb 0.62 -0.13 -0.06 0.00 0.22 0.00 0.00 39.33 39.99 3eeq h ASP 264 CO 0.04 0.39 0.59 -0.33 -1.72 0.00 0.00 179.24 178.21 3eeq h GLU 265 N 0.66 0.33 -0.01 3.56 5.08 -1.27 2.70 114.58 125.63 3eeq h GLU 265 Ca 0.20 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 3eeq h GLU 265 Cb -0.03 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.14 3eeq h GLU 265 CO -0.07 0.22 -0.15 1.19 -1.00 0.00 0.00 179.01 179.20 3eeq n PHE 266 N -4.48 0.00 -3.80 4.33 3.72 -0.92 -4.94 117.46 111.38 3eeq n PHE 266 Ca 0.19 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.35 3eeq n PHE 266 Cb 0.72 -0.14 0.01 0.00 -0.94 0.00 0.00 39.48 39.13 3eeq n PHE 266 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3eeq n ASN 267 N -0.75 -1.28 -4.33 4.37 5.15 0.90 -4.99 115.26 114.34 3eeq n ASN 267 Ca 0.14 -0.92 -0.19 0.00 -0.60 0.00 0.00 54.58 53.02 3eeq n ASN 267 Cb 0.31 -3.59 -0.10 0.00 -0.53 0.00 0.00 39.78 35.86 3eeq n ASN 267 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3eeq s VAL 268 N -3.77 1.72 0.34 3.44 -7.23 0.06 -4.99 120.40 109.97 3eeq s VAL 268 Ca 0.05 -2.11 -0.27 0.00 -1.81 0.00 0.00 61.98 57.84 3eeq s VAL 268 Cb -0.02 -1.96 -0.13 0.00 0.56 0.00 0.00 36.38 34.84 3eeq s VAL 268 CO 0.85 -0.52 1.16 -2.11 -0.31 0.00 0.00 175.10 174.16 3eeq n ARG 269 N -0.16 1.76 -4.04 4.82 0.00 -1.26 -4.21 116.66 113.57 3eeq n ARG 269 Ca -0.10 0.62 -0.31 0.00 -0.00 0.00 0.00 57.85 58.07 3eeq n ARG 269 Cb 0.59 -2.13 -0.06 0.00 -0.00 0.00 0.00 32.46 30.86 3eeq n ARG 269 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.63 177.75 3eeq s PHE 270 N -1.11 3.21 -0.17 2.89 5.36 -1.26 -1.75 117.98 125.16 3eeq s PHE 270 Ca 0.58 0.09 -0.02 0.00 -0.96 0.00 0.00 56.93 56.62 3eeq s PHE 270 Cb -0.61 -1.63 0.05 0.00 -0.34 0.00 0.00 43.02 40.49 3eeq s PHE 270 CO 0.61 0.53 0.00 0.50 -1.46 0.00 0.00 175.22 175.40 3eeq s ARG 271 N -2.37 0.88 -0.18 10.12 6.06 0.92 -4.92 118.95 129.47 3eeq s ARG 271 Ca 0.29 -0.40 -0.26 0.00 -2.50 0.00 0.00 55.73 52.86 3eeq s ARG 271 Cb -0.12 -1.95 -0.01 0.00 0.06 0.00 0.00 34.95 32.93 3eeq s ARG 271 CO 0.22 -0.54 0.87 -1.17 -2.50 0.00 0.00 175.30 172.18 3eeq s LEU 272 N 1.79 4.16 -0.12 -0.88 2.96 -1.26 -2.17 118.68 123.16 3eeq s LEU 272 Ca -0.00 1.21 -0.04 0.00 -0.22 0.00 0.00 54.13 55.09 3eeq s LEU 272 Cb -0.16 -3.29 -0.03 0.00 0.50 0.00 0.00 46.19 43.20 3eeq s LEU 272 CO -0.07 -0.45 0.02 -0.69 -1.32 0.00 0.00 176.35 173.84 3eeq s VAL 273 N 2.36 4.47 0.37 1.68 1.01 0.55 -4.97 120.40 125.87 3eeq s VAL 273 Ca 0.39 -0.17 0.07 0.00 0.00 0.00 0.00 61.98 62.27 3eeq s VAL 273 Cb -0.16 -2.93 -0.01 0.00 0.00 0.00 0.00 36.38 33.28 3eeq s VAL 273 CO 0.11 0.56 0.44 0.54 0.00 0.00 0.00 175.10 176.76 3eeq s ASN 274 N -0.48 5.61 0.60 3.32 4.22 -1.26 -4.11 114.94 122.84 3eeq s ASN 274 Ca 0.09 -0.39 0.37 0.00 -2.14 0.00 0.00 52.86 50.79 3eeq s ASN 274 Cb -0.12 -0.94 1.90 0.00 1.28 0.00 0.00 41.25 43.38 3eeq s ASN 274 CO 0.02 -0.53 2.20 1.05 -2.04 0.00 0.00 177.10 177.80 3eeq h GLU 275 N 0.93 0.00 -0.06 3.55 -0.00 -1.98 -1.46 114.58 115.55 3eeq h GLU 275 Ca -0.43 0.00 -0.04 0.00 -0.00 0.00 0.00 59.36 58.88 3eeq h GLU 275 Cb 1.26 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.01 3eeq h GLU 275 CO 0.53 0.03 -0.13 0.93 -0.00 0.00 0.00 179.01 180.36 3eeq h GLU 276 N 0.00 0.19 -0.92 1.06 3.07 -1.98 -0.55 114.58 115.45 3eeq h GLU 276 Ca -0.00 -0.13 0.07 0.00 -0.50 0.00 0.00 59.36 58.80 3eeq h GLU 276 Cb 0.21 0.02 -0.07 0.00 -0.84 0.00 0.00 28.75 28.07 3eeq h GLU 276 CO 0.00 0.73 0.58 0.93 -1.40 0.00 0.00 179.01 179.85 3eeq h GLU 277 N -0.31 1.01 -0.33 2.33 5.08 -1.81 0.59 114.58 121.14 3eeq h GLU 277 Ca -0.00 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 3eeq h GLU 277 Cb 0.73 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 3eeq h GLU 277 CO 0.03 0.67 0.14 0.82 -1.00 0.00 0.00 179.01 179.66 3eeq h ILE 278 N 1.04 1.18 0.00 3.13 1.08 -1.18 -2.89 117.51 119.86 3eeq h ILE 278 Ca 0.41 -0.54 -0.09 0.00 -0.39 0.00 0.00 64.86 64.25 3eeq h ILE 278 Cb 0.20 0.93 -0.01 0.00 -3.07 0.00 0.00 36.82 34.87 3eeq h ILE 278 CO -0.18 0.19 -0.42 0.78 -0.69 0.00 0.00 178.15 177.83 3eeq h ASN 279 N 0.38 0.00 1.28 1.72 -0.26 0.04 -2.67 115.58 116.08 3eeq h ASN 279 Ca 0.11 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.85 3eeq h ASN 279 Cb 0.17 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.43 3eeq h ASN 279 CO -0.01 0.42 0.00 0.59 -1.06 0.00 0.00 177.43 177.37 3eeq n ASN 280 N -3.97 0.78 -4.76 5.81 3.02 0.09 -4.89 115.26 111.35 3eeq n ASN 280 Ca -0.02 0.60 -0.39 0.00 -0.03 0.00 0.00 54.58 54.74 3eeq n ASN 280 Cb 0.45 -0.80 -0.05 0.00 -0.61 0.00 0.00 39.78 38.77 3eeq n ASN 280 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3eeq s PHE 281 N -3.16 3.73 0.01 3.10 5.36 -1.01 -5.06 117.98 120.95 3eeq s PHE 281 Ca 0.09 1.35 0.00 0.00 -0.96 0.00 0.00 56.93 57.42 3eeq s PHE 281 Cb 0.12 -2.71 -0.01 0.00 -0.34 0.00 0.00 43.02 40.08 3eeq s PHE 281 CO 0.54 0.34 -0.01 -1.64 -1.46 0.00 0.00 175.22 172.99 3eeq s MET 282 N -0.26 0.12 -0.29 10.12 -1.94 -1.26 -5.04 119.30 120.75 3eeq s MET 282 Ca 0.34 -0.21 -0.15 0.00 -1.71 0.00 0.00 55.69 53.96 3eeq s MET 282 Cb -0.20 0.01 0.14 0.00 2.01 0.00 0.00 34.83 36.80 3eeq s MET 282 CO 0.20 -0.01 0.93 1.21 -0.01 0.00 0.00 175.02 177.35 3eeq s ASN 283 N -0.48 -0.60 0.50 3.03 3.84 -1.26 -5.06 114.94 114.91 3eeq s ASN 283 Ca -0.05 0.92 0.27 0.00 0.21 0.00 0.00 52.86 54.21 3eeq s ASN 283 Cb -0.03 1.40 1.30 0.00 -0.55 0.00 0.00 41.25 43.37 3eeq s ASN 283 CO -0.00 -0.14 2.00 1.55 -2.79 0.00 0.00 177.10 177.71 3eeq h PRO 284 N 6.63 0.00 -0.01 0.43 0.13 -2.01 -2.57 132.00 134.60 3eeq h PRO 284 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 3eeq h PRO 284 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3eeq h PRO 284 CO 0.16 0.15 0.00 0.00 -0.23 0.00 0.00 178.00 178.08 3eeq s LEU 286 N -1.69 4.35 0.25 0.00 1.43 -0.97 -4.96 118.68 117.09 3eeq s LEU 286 Ca 0.33 2.93 -0.31 0.00 -1.03 0.00 0.00 54.13 56.05 3eeq s LEU 286 Cb 0.16 -3.66 -0.12 0.00 0.03 0.00 0.00 46.19 42.59 3eeq s LEU 286 CO 0.26 -0.77 1.64 0.41 0.23 0.00 0.00 176.35 178.13 3eeq n THR 287 N 0.66 0.52 -2.11 5.49 -1.04 -1.26 -4.95 114.28 111.59 3eeq n THR 287 Ca 0.01 -0.13 -0.35 0.00 -2.04 0.00 0.00 64.05 61.54 3eeq n THR 287 Cb 0.40 -1.93 0.02 0.00 -1.82 0.00 0.00 70.33 67.00 3eeq n THR 287 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 3eeq s PRO 288 N 0.30 3.15 0.40 -2.82 0.04 -1.26 -4.96 135.00 129.84 3eeq s PRO 288 Ca 0.70 1.67 -0.21 0.00 0.04 0.00 0.00 61.00 63.20 3eeq s PRO 288 Cb -0.52 -1.97 -0.16 0.00 0.04 0.00 0.00 34.50 31.90 3eeq s PRO 288 CO 0.41 -1.03 0.09 -2.30 0.04 0.00 0.00 177.00 174.21 3eeq n PRO 289 N -1.53 0.00 0.00 0.56 -0.02 -1.26 -5.06 135.00 127.69 3eeq n PRO 289 Ca 0.12 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 3eeq n PRO 289 Cb 0.51 -0.99 0.00 0.00 -0.02 0.00 0.00 33.50 32.99 3eeq n PRO 289 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3eeq n LYS 299 N 1.33 0.00 -1.60 -0.52 3.00 -1.26 -5.22 118.16 113.88 3eeq n LYS 299 Ca 0.11 0.00 -0.10 0.00 -0.00 0.00 0.00 58.31 58.32 3eeq n LYS 299 Cb 0.40 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.39 3eeq n LYS 299 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3eeq n GLY 300 N -0.33 0.77 0.23 3.14 0.00 -1.26 -4.92 105.19 102.83 3eeq n GLY 300 Ca 0.00 -0.52 -0.09 0.00 0.00 0.00 0.00 46.02 45.41 3eeq n GLY 300 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3eeq h VAL 301 N 0.00 1.24 0.56 1.61 2.07 -1.98 -2.32 116.25 117.42 3eeq h VAL 301 Ca -0.23 -0.84 -0.03 0.00 0.82 0.00 0.00 66.70 66.43 3eeq h VAL 301 Cb 0.85 0.88 0.01 0.00 -1.52 0.00 0.00 31.29 31.50 3eeq h VAL 301 CO 0.31 0.30 -0.27 0.00 0.02 0.00 0.00 177.57 177.93 3eeq h ALA 302 N 0.98 -0.75 0.17 1.67 0.00 -1.86 0.36 119.26 119.84 3eeq h ALA 302 Ca 0.15 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3eeq h ALA 302 Cb 0.33 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3eeq h ALA 302 CO 0.00 -0.91 -0.08 0.93 0.00 0.00 0.00 179.25 179.19 3eeq h GLU 303 N -0.76 -0.22 -0.41 0.00 5.08 -1.86 -1.71 114.58 114.70 3eeq h GLU 303 Ca -0.08 0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.32 3eeq h GLU 303 Cb 0.58 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 3eeq h GLU 303 CO 0.13 -0.10 0.22 0.82 -1.00 0.00 0.00 179.01 179.07 3eeq h ILE 304 N -0.29 1.00 -0.46 3.13 2.04 -1.40 -0.78 117.51 120.76 3eeq h ILE 304 Ca -0.02 -0.15 0.06 0.00 1.00 0.00 0.00 64.86 65.74 3eeq h ILE 304 Cb 0.22 0.52 -0.05 0.00 -0.74 0.00 0.00 36.82 36.78 3eeq h ILE 304 CO 0.04 0.08 0.16 0.28 0.00 0.00 0.00 178.15 178.71 3eeq h SER 305 N 0.44 0.16 -0.58 1.72 0.02 -0.27 0.19 113.55 115.23 3eeq h SER 305 Ca 0.17 0.05 -0.05 0.00 -0.84 0.00 0.00 61.79 61.12 3eeq h SER 305 Cb 0.05 0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 3eeq h SER 305 CO -0.10 0.12 0.16 0.00 -1.14 0.00 0.00 176.83 175.87 3eeq h ALA 306 N 1.30 0.76 0.09 3.77 0.00 -1.02 0.90 119.26 125.06 3eeq h ALA 306 Ca 0.22 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3eeq h ALA 306 Cb 0.22 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3eeq h ALA 306 CO -0.22 0.44 -0.04 -0.07 0.00 0.00 0.00 179.25 179.36 3eeq h LEU 307 N 0.82 -0.10 -0.12 0.00 3.38 -0.83 0.10 115.31 118.55 3eeq h LEU 307 Ca 0.18 -0.24 0.04 0.00 0.09 0.00 0.00 57.88 57.96 3eeq h LEU 307 Cb 0.31 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 41.04 3eeq h LEU 307 CO -0.00 0.18 -0.18 0.40 0.09 0.00 0.00 178.44 178.93 3eeq h ILE 308 N -0.40 0.53 0.00 1.22 2.04 -0.45 0.58 117.51 121.04 3eeq h ILE 308 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.85 3eeq h ILE 308 Cb 0.33 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 3eeq h ILE 308 CO 0.02 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.17 3eeq h ALA 309 N 0.79 1.00 -0.03 1.87 0.00 -0.81 -2.82 119.26 119.26 3eeq h ALA 309 Ca 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.82 3eeq h ALA 309 Cb 0.37 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3eeq h ALA 309 CO -0.26 0.00 -0.80 0.78 0.00 0.00 0.00 179.25 178.97 3eeq h GLY 310 N 1.59 0.33 0.00 0.00 0.00 0.12 -3.46 103.07 101.64 3eeq h GLY 310 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 47.33 46.82 3eeq h GLY 310 CO 0.00 0.45 0.00 0.61 0.00 0.00 0.00 176.54 177.60 3eeq n GLY 311 N 0.69 0.99 3.73 4.60 0.00 -0.86 0.26 105.19 114.60 3eeq n GLY 311 Ca -0.04 -2.25 -0.42 0.00 0.00 0.00 0.00 46.02 43.31 3eeq n GLY 311 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3eeq n ARG 312 N -0.65 2.70 -0.96 1.61 1.74 -1.26 -1.68 116.66 118.16 3eeq n ARG 312 Ca 0.00 0.97 0.00 0.00 -0.77 0.00 0.00 57.85 58.05 3eeq n ARG 312 Cb 0.00 -2.78 0.00 0.00 -1.02 0.00 0.00 32.46 28.66 3eeq n ARG 312 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3eeq n ASN 313 N 3.19 -2.89 -4.54 0.55 3.02 -1.26 -4.87 115.26 108.46 3eeq n ASN 313 Ca 0.13 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.26 3eeq n ASN 313 Cb 0.35 -1.19 0.00 0.00 -0.61 0.00 0.00 39.78 38.33 3eeq n ASN 313 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 3eeq n SER 314 N -0.21 0.42 -4.36 6.41 2.88 -0.68 -5.00 113.62 113.08 3eeq n SER 314 Ca 0.00 1.03 -0.30 0.00 -1.33 0.00 0.00 58.87 58.27 3eeq n SER 314 Cb 0.11 -1.24 -0.14 0.00 -0.75 0.00 0.00 64.21 62.19 3eeq n SER 314 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 3eeq s LYS 315 N -1.73 1.72 0.23 -1.46 0.00 -1.26 -4.91 119.74 112.32 3eeq s LYS 315 Ca 0.62 -1.17 -0.30 0.00 0.00 0.00 0.00 55.97 55.13 3eeq s LYS 315 Cb -0.62 -1.97 -0.10 0.00 0.00 0.00 0.00 37.83 35.14 3eeq s LYS 315 CO 0.58 0.50 1.40 -1.17 0.00 0.00 0.00 175.35 176.66 3eeq s LEU 316 N -1.46 4.40 0.03 2.77 2.96 -1.26 -0.40 118.68 125.71 3eeq s LEU 316 Ca 0.13 2.58 -0.03 0.00 -0.22 0.00 0.00 54.13 56.58 3eeq s LEU 316 Cb -0.10 -3.62 -0.01 0.00 0.50 0.00 0.00 46.19 42.96 3eeq s LEU 316 CO 0.03 -0.65 -0.07 -0.38 -1.32 0.00 0.00 176.35 173.97 3eeq n ILE 317 N 2.45 1.14 -3.64 6.68 5.41 0.41 -4.90 119.36 126.93 3eeq n ILE 317 Ca 0.07 0.30 -0.40 0.00 1.00 0.00 0.00 62.75 63.72 3eeq n ILE 317 Cb 0.41 -1.71 -0.11 0.00 -0.71 0.00 0.00 39.64 37.52 3eeq n ILE 317 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 3eeq s LEU 318 N -7.04 4.47 0.62 1.39 2.96 -0.68 -3.43 118.68 116.97 3eeq s LEU 318 Ca -0.06 -0.86 -0.19 0.00 -0.22 0.00 0.00 54.13 52.80 3eeq s LEU 318 Cb 0.01 -2.00 -0.02 0.00 0.50 0.00 0.00 46.19 44.68 3eeq s LEU 318 CO 0.08 -0.32 1.31 -0.60 -1.32 0.00 0.00 176.35 175.50 3eeq s ARG 319 N 1.55 2.70 0.09 1.98 3.52 -0.72 -1.08 118.95 126.99 3eeq s ARG 319 Ca 0.02 2.10 -0.36 0.00 -0.13 0.00 0.00 55.73 57.36 3eeq s ARG 319 Cb -0.18 -1.94 -0.18 0.00 -1.56 0.00 0.00 34.95 31.09 3eeq s ARG 319 CO 0.06 -1.49 1.14 1.17 -0.81 0.00 0.00 175.30 175.37 3eeq n LYS 320 N -1.69 0.68 -4.34 5.12 4.81 -1.26 -4.77 118.16 116.71 3eeq n LYS 320 Ca 0.15 0.24 -0.20 0.00 -0.87 0.00 0.00 58.31 57.63 3eeq n LYS 320 Cb 0.47 -1.75 -0.15 0.00 0.02 0.00 0.00 35.03 33.61 3eeq n LYS 320 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 3eeq s ILE 321 N 0.04 0.72 0.77 3.15 1.01 -0.37 -4.70 121.20 121.81 3eeq s ILE 321 Ca 0.82 -0.31 -0.11 0.00 0.00 0.00 0.00 60.65 61.05 3eeq s ILE 321 Cb -1.03 -0.65 0.06 0.00 0.01 0.00 0.00 42.46 40.85 3eeq s ILE 321 CO 0.52 0.23 1.10 0.00 0.00 0.00 0.00 174.94 176.80 3eeq s ALA 322 N 0.27 2.19 0.00 9.38 0.00 -1.26 -1.55 121.76 130.79 3eeq s ALA 322 Ca -0.04 0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.27 3eeq s ALA 322 Cb -0.09 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.73 3eeq s ALA 322 CO 0.00 -1.83 0.00 -0.89 0.00 0.00 0.00 175.76 173.05 3eeq n ILE 323 N -3.45 0.00 -3.84 0.00 5.41 0.82 -4.85 119.36 113.44 3eeq n ILE 323 Ca 0.10 0.00 0.01 0.00 1.00 0.00 0.00 62.75 63.85 3eeq n ILE 323 Cb 0.53 0.04 0.00 0.00 -0.71 0.00 0.00 39.64 39.50 3eeq n ILE 323 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3eeq n SER 324 N -1.50 -0.31 -0.19 4.38 3.41 -1.15 -4.95 113.62 113.31 3eeq n SER 324 Ca 0.00 -1.08 0.15 0.00 -0.26 0.00 0.00 58.87 57.67 3eeq n SER 324 Cb 0.14 0.49 0.69 0.00 -0.26 0.00 0.00 64.21 65.26 3eeq n SER 324 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 3eeq n ARG 325 N -0.22 1.08 0.00 4.33 0.00 -1.26 -3.21 116.66 117.38 3eeq n ARG 325 Ca 0.01 -0.38 0.09 0.00 -0.00 0.00 0.00 57.85 57.57 3eeq n ARG 325 Cb 0.14 -1.49 -0.04 0.00 -0.00 0.00 0.00 32.46 31.07 3eeq n ARG 325 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 3eeq n ASN 326 N -0.63 1.47 -3.75 2.89 0.23 -1.26 -4.95 115.26 109.27 3eeq n ASN 326 Ca 0.19 -1.23 -0.13 0.00 -0.53 0.00 0.00 54.58 52.87 3eeq n ASN 326 Cb 0.25 0.68 -0.11 0.00 -2.08 0.00 0.00 39.78 38.53 3eeq n ASN 326 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 3eeq s SER 327 N -2.43 -0.38 0.10 0.53 0.15 -1.20 -1.48 113.70 108.99 3eeq s SER 327 Ca 0.13 0.73 -0.08 0.00 0.70 0.00 0.00 55.95 57.43 3eeq s SER 327 Cb 0.15 0.73 -0.01 0.00 -1.71 0.00 0.00 66.02 65.19 3eeq s SER 327 CO 0.60 -0.13 0.18 0.42 1.20 0.00 0.00 173.24 175.51 3eeq s THR 328 N 0.24 0.14 0.01 6.45 -4.23 -0.16 -0.13 115.64 117.95 3eeq s THR 328 Ca -0.00 -1.31 -0.12 0.00 -1.18 0.00 0.00 61.69 59.07 3eeq s THR 328 Cb -0.03 -1.48 0.01 0.00 1.34 0.00 0.00 72.50 72.35 3eeq s THR 328 CO 0.00 -0.62 0.25 -0.51 -0.54 0.00 0.00 174.62 173.21 3eeq s ILE 329 N -3.89 0.08 0.13 2.99 2.07 -0.59 -1.16 121.20 120.82 3eeq s ILE 329 Ca 0.08 -0.62 -0.15 0.00 -1.41 0.00 0.00 60.65 58.55 3eeq s ILE 329 Cb 0.05 -0.67 0.03 0.00 0.13 0.00 0.00 42.46 41.99 3eeq s ILE 329 CO -0.08 -0.34 0.38 0.00 -1.91 0.00 0.00 174.94 172.98 3eeq s ALA 330 N -1.74 -0.76 -0.00 1.50 0.00 -0.96 -1.24 121.76 118.56 3eeq s ALA 330 Ca -0.11 -0.22 0.02 0.00 0.00 0.00 0.00 51.96 51.65 3eeq s ALA 330 Cb -0.04 0.70 -0.00 0.00 0.00 0.00 0.00 23.12 23.77 3eeq s ALA 330 CO 0.01 -0.65 -0.06 0.08 0.00 0.00 0.00 175.76 175.14 3eeq s VAL 331 N -3.83 0.49 0.25 0.00 1.01 -0.24 -1.93 120.40 116.14 3eeq s VAL 331 Ca 0.05 -0.27 0.03 0.00 0.00 0.00 0.00 61.98 61.79 3eeq s VAL 331 Cb 0.02 -0.41 -0.05 0.00 0.00 0.00 0.00 36.38 35.93 3eeq s VAL 331 CO -0.10 0.13 0.04 0.00 0.00 0.00 0.00 175.10 175.18 3eeq s ALA 332 N -0.15 1.80 0.33 5.51 0.00 -0.55 -0.44 121.76 128.26 3eeq s ALA 332 Ca 0.02 -1.82 -0.28 0.00 0.00 0.00 0.00 51.96 49.88 3eeq s ALA 332 Cb -0.02 0.72 -0.09 0.00 0.00 0.00 0.00 23.12 23.72 3eeq s ALA 332 CO -0.00 -0.34 1.16 0.95 0.00 0.00 0.00 175.76 177.53 3eeq s THR 333 N -3.55 3.23 -0.54 0.00 -4.23 0.46 -0.76 115.64 110.25 3eeq s THR 333 Ca 0.32 1.17 -0.20 0.00 -1.18 0.00 0.00 61.69 61.80 3eeq s THR 333 Cb 0.07 -3.72 0.06 0.00 1.34 0.00 0.00 72.50 70.26 3eeq s THR 333 CO 0.11 0.23 0.72 -0.47 -0.54 0.00 0.00 174.62 174.66 3eeq s TYR 334 N -1.25 2.96 -0.45 3.99 5.04 -0.40 -4.46 117.35 122.79 3eeq s TYR 334 Ca 0.49 -0.50 0.12 0.00 -2.44 0.00 0.00 57.07 54.75 3eeq s TYR 334 Cb -0.33 -3.76 0.70 0.00 0.35 0.00 0.00 41.96 38.92 3eeq s TYR 334 CO 0.42 -1.18 1.56 0.39 -1.34 0.00 0.00 175.55 175.41 3eeq n GLU 335 N 6.55 4.24 -0.73 4.97 4.71 0.14 -4.34 120.64 136.18 3eeq n GLU 335 Ca -0.05 -2.67 0.00 0.00 -0.01 0.00 0.00 57.16 54.42 3eeq n GLU 335 Cb 0.45 -2.12 0.00 0.00 -1.01 0.00 0.00 31.44 28.76 3eeq n GLU 335 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3eeq n GLY 336 N 0.59 1.26 0.46 0.62 0.00 -1.24 -4.88 105.19 102.01 3eeq n GLY 336 Ca 0.24 -2.02 0.14 0.00 0.00 0.00 0.00 46.02 44.37 3eeq n GLY 336 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74