#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wbd s VAL 10 N 0.00 2.20 -0.11 2.53 0.11 -1.26 -5.06 120.40 118.81 2wbd s VAL 10 Ca 0.00 0.09 -0.09 0.00 -2.93 0.00 0.00 61.98 59.05 2wbd s VAL 10 Cb 0.00 -2.51 0.03 0.00 -1.53 0.00 0.00 36.38 32.37 2wbd s VAL 10 CO 0.00 -0.06 0.28 0.21 -3.33 0.00 0.00 175.10 172.19 2wbd s ASN 11 N -2.22 -0.29 0.29 3.54 3.84 -1.26 -5.07 114.94 113.76 2wbd s ASN 11 Ca 0.72 0.56 0.09 0.00 0.21 0.00 0.00 52.86 54.44 2wbd s ASN 11 Cb -0.28 0.54 -0.04 0.00 -0.55 0.00 0.00 41.25 40.92 2wbd s ASN 11 CO 0.50 -0.11 0.07 0.42 -2.79 0.00 0.00 177.10 175.18 2wbd s THR 12 N 0.43 3.40 0.20 -5.21 -4.23 -1.26 -0.65 115.64 108.32 2wbd s THR 12 Ca -0.02 -1.79 -0.12 0.00 -1.18 0.00 0.00 61.69 58.58 2wbd s THR 12 Cb -0.04 -2.95 0.12 0.00 1.34 0.00 0.00 72.50 70.97 2wbd s THR 12 CO -0.02 -0.31 1.86 0.25 -0.54 0.00 0.00 174.62 175.86 2wbd h LEU 13 N 1.73 0.72 -0.31 4.79 5.85 -1.71 -0.40 115.31 125.98 2wbd h LEU 13 Ca -0.44 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.26 2wbd h LEU 13 Cb 1.25 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.09 2wbd h LEU 13 CO 0.61 0.52 0.18 0.74 -0.34 0.00 0.00 178.44 180.15 2wbd h THR 14 N 0.86 1.12 -0.54 1.05 2.02 -1.96 -0.43 112.91 115.03 2wbd h THR 14 Ca 0.25 -0.31 -0.10 0.00 0.77 0.00 0.00 66.41 67.01 2wbd h THR 14 Cb -0.06 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 2wbd h THR 14 CO -0.07 0.12 -0.07 -0.09 0.37 0.00 0.00 175.52 175.79 2wbd h ARG 15 N 0.39 0.99 0.03 6.66 2.43 -1.89 -1.77 114.38 121.21 2wbd h ARG 15 Ca 0.11 -0.34 -0.00 0.00 -0.81 0.00 0.00 59.98 58.94 2wbd h ARG 15 Cb 0.04 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.52 2wbd h ARG 15 CO -0.02 1.01 -0.01 0.35 -1.51 0.00 0.00 179.97 179.79 2wbd h PHE 16 N 0.89 -0.03 -0.32 2.20 3.04 -1.01 -0.25 116.94 121.45 2wbd h PHE 16 Ca 0.15 -0.00 0.03 0.00 3.98 0.00 0.00 57.97 62.13 2wbd h PHE 16 Cb 0.61 0.01 -0.03 0.00 2.56 0.00 0.00 35.95 39.10 2wbd h PHE 16 CO 0.04 0.16 0.12 0.28 -2.02 0.00 0.00 178.31 176.89 2wbd h VAL 17 N -0.22 0.92 -0.62 1.41 2.07 -0.97 -1.10 116.25 117.74 2wbd h VAL 17 Ca -0.00 -0.09 -0.03 0.00 0.82 0.00 0.00 66.70 67.39 2wbd h VAL 17 Cb 0.21 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.58 2wbd h VAL 17 CO 0.01 0.05 0.25 0.24 0.02 0.00 0.00 177.57 178.13 2wbd h MET 18 N 0.27 0.90 -0.37 1.57 2.86 -1.28 -1.05 114.93 117.83 2wbd h MET 18 Ca 0.14 -0.14 -0.12 0.00 -2.06 0.00 0.00 59.70 57.53 2wbd h MET 18 Cb 0.10 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 2wbd h MET 18 CO -0.14 0.74 -0.24 1.49 1.06 0.00 0.00 176.91 179.81 2wbd h GLU 19 N 0.89 0.74 -0.11 1.72 4.81 -0.35 -1.94 114.58 120.34 2wbd h GLU 19 Ca 0.21 -0.30 -0.15 0.00 -0.13 0.00 0.00 59.36 58.99 2wbd h GLU 19 Cb 0.17 -0.03 0.01 0.00 0.63 0.00 0.00 28.75 29.52 2wbd h GLU 19 CO -0.02 0.91 -0.51 0.93 -0.73 0.00 0.00 179.01 179.59 2wbd h GLU 20 N 0.64 0.54 -0.29 1.92 4.39 -1.01 -2.73 114.58 118.04 2wbd h GLU 20 Ca 0.09 -0.43 -0.01 0.00 0.34 0.00 0.00 59.36 59.34 2wbd h GLU 20 Cb 0.75 0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.47 2wbd h GLU 20 CO 0.06 1.06 0.13 0.78 -1.16 0.00 0.00 179.01 179.88 2wbd h GLY 21 N 0.16 0.43 0.89 -3.84 0.00 -1.13 -2.40 103.07 97.17 2wbd h GLY 21 Ca -0.03 -0.18 -0.15 0.00 0.00 0.00 0.00 47.33 46.97 2wbd h GLY 21 CO 0.11 0.18 -0.52 3.21 0.00 0.00 0.00 176.54 179.51 2wbd h ARG 22 N 0.40 0.53 -0.80 4.80 3.08 -1.34 -0.31 114.38 120.75 2wbd h ARG 22 Ca 0.10 -0.43 0.09 0.00 0.07 0.00 0.00 59.98 59.81 2wbd h ARG 22 Cb 0.06 0.09 -0.05 0.00 0.08 0.00 0.00 29.97 30.15 2wbd h ARG 22 CO -0.01 1.06 0.52 0.87 -1.07 0.00 0.00 179.97 181.34 2wbd h LYS 23 N 0.13 0.76 -0.01 0.04 1.57 -1.37 -2.66 116.57 115.03 2wbd h LYS 23 Ca -0.04 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2wbd h LYS 23 Cb 1.16 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.30 2wbd h LYS 23 CO 0.11 0.50 -0.24 0.00 -0.57 0.00 0.00 179.45 179.25 2wbd n ALA 24 N -2.44 3.05 -3.66 3.86 0.00 -0.91 -4.97 120.51 115.44 2wbd n ALA 24 Ca 0.13 -0.46 -0.23 0.00 0.00 0.00 0.00 53.44 52.87 2wbd n ALA 24 Cb 0.29 -1.07 0.06 0.00 0.00 0.00 0.00 19.45 18.73 2wbd n ALA 24 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2wbd n ARG 25 N -0.32 -6.41 -2.36 0.00 1.74 -0.15 -4.98 116.66 104.17 2wbd n ARG 25 Ca 0.13 0.73 -0.25 0.00 -0.77 0.00 0.00 57.85 57.69 2wbd n ARG 25 Cb 0.38 -5.63 0.10 0.00 -1.02 0.00 0.00 32.46 26.29 2wbd n ARG 25 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2wbd s GLY 26 N -3.79 1.75 0.30 -0.13 0.00 -1.03 -5.00 107.32 99.42 2wbd s GLY 26 Ca 0.34 -1.36 0.08 0.00 0.00 0.00 0.00 44.72 43.78 2wbd s GLY 26 CO 0.77 -0.83 1.71 -0.91 0.00 0.00 0.00 173.10 173.84 2wbd h THR 27 N -0.69 1.31 0.00 0.90 1.35 -1.93 -3.47 112.91 110.38 2wbd h THR 27 Ca -0.41 -1.54 0.00 0.00 -0.55 0.00 0.00 66.41 63.92 2wbd h THR 27 Cb 1.28 1.72 0.00 0.00 -1.73 0.00 0.00 68.15 69.42 2wbd h THR 27 CO 0.47 0.45 0.00 0.61 -0.25 0.00 0.00 175.52 176.80 2wbd n GLY 28 N -0.18 1.46 0.24 5.82 0.00 -1.26 -5.04 105.19 106.22 2wbd n GLY 28 Ca -0.02 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 2wbd n GLY 28 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2wbd h GLU 29 N 0.00 0.79 -0.51 1.61 4.81 -1.97 -1.77 114.58 117.54 2wbd h GLU 29 Ca 0.00 -0.07 -0.07 0.00 -0.13 0.00 0.00 59.36 59.09 2wbd h GLU 29 Cb 0.00 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.19 2wbd h GLU 29 CO 0.00 0.57 0.03 1.25 -0.73 0.00 0.00 179.01 180.13 2wbd h LEU 30 N 0.78 0.80 -0.36 1.64 5.85 -1.96 -1.62 115.31 120.44 2wbd h LEU 30 Ca 0.21 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 2wbd h LEU 30 Cb -0.01 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.79 2wbd h LEU 30 CO -0.04 0.85 0.14 0.74 -0.34 0.00 0.00 178.44 179.79 2wbd h THR 31 N 0.79 1.19 -0.54 1.05 2.02 -1.86 0.24 112.91 115.80 2wbd h THR 31 Ca 0.16 -0.59 -0.00 0.00 0.77 0.00 0.00 66.41 66.74 2wbd h THR 31 Cb 0.43 0.91 -0.03 0.00 -1.74 0.00 0.00 68.15 67.73 2wbd h THR 31 CO 0.02 0.21 0.32 1.56 0.37 0.00 0.00 175.52 178.00 2wbd h GLN 32 N 0.43 0.74 -0.87 6.66 4.20 -1.07 0.14 115.11 125.33 2wbd h GLN 32 Ca 0.12 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 2wbd h GLN 32 Cb 0.19 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 27.78 2wbd h GLN 32 CO -0.01 0.54 0.48 1.25 -0.67 0.00 0.00 178.83 180.42 2wbd h LEU 33 N 0.73 1.09 -0.19 1.46 6.46 -1.10 -1.00 115.31 122.75 2wbd h LEU 33 Ca 0.19 -0.10 -0.22 0.00 -0.12 0.00 0.00 57.88 57.64 2wbd h LEU 33 Cb -0.00 -0.28 -0.00 0.00 -0.73 0.00 0.00 40.66 39.65 2wbd h LEU 33 CO -0.04 0.87 -0.94 -0.07 -0.62 0.00 0.00 178.44 177.65 2wbd h LEU 34 N 1.22 0.40 -0.86 2.25 3.38 -0.01 -0.88 115.31 120.81 2wbd h LEU 34 Ca 0.31 -0.33 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 2wbd h LEU 34 Cb 0.02 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 2wbd h LEU 34 CO -0.05 1.14 -0.43 -1.13 0.09 0.00 0.00 178.44 178.06 2wbd h ASN 35 N 0.16 0.32 -0.41 -0.43 -1.24 -0.64 -1.95 115.58 111.40 2wbd h ASN 35 Ca -0.07 -0.14 -0.13 0.00 0.71 0.00 0.00 56.30 56.67 2wbd h ASN 35 Cb 1.58 -0.09 -0.01 0.00 0.73 0.00 0.00 38.32 40.53 2wbd h ASN 35 CO 0.15 0.71 -0.26 0.28 -1.29 0.00 0.00 177.43 177.03 2wbd h SER 36 N 0.25 0.96 0.16 1.15 0.02 -0.94 -2.22 113.55 112.93 2wbd h SER 36 Ca 0.02 -0.38 -0.18 0.00 -0.84 0.00 0.00 61.79 60.41 2wbd h SER 36 Cb 0.86 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 63.13 2wbd h SER 36 CO 0.07 1.16 -0.70 0.25 -1.14 0.00 0.00 176.83 176.47 2wbd h LEU 37 N 0.79 0.56 -0.86 5.07 5.85 -1.03 -2.27 115.31 123.42 2wbd h LEU 37 Ca 0.10 -0.36 -0.11 0.00 0.84 0.00 0.00 57.88 58.35 2wbd h LEU 37 Cb 0.83 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 2wbd h LEU 37 CO 0.07 1.10 -0.41 0.00 -0.34 0.00 0.00 178.44 178.86 2wbd h THR 39 N 0.28 1.28 -0.92 0.00 2.02 -1.12 -2.83 112.91 111.61 2wbd h THR 39 Ca 0.03 -1.33 -0.01 0.00 0.77 0.00 0.00 66.41 65.86 2wbd h THR 39 Cb 0.84 1.25 -0.04 0.00 -1.74 0.00 0.00 68.15 68.46 2wbd h THR 39 CO 0.07 0.45 0.53 0.00 0.37 0.00 0.00 175.52 176.94 2wbd h ALA 40 N 0.82 1.18 -0.52 6.16 0.00 -1.26 -2.86 119.26 122.78 2wbd h ALA 40 Ca 0.09 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.79 2wbd h ALA 40 Cb 0.75 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 2wbd h ALA 40 CO 0.06 0.66 -0.04 0.28 0.00 0.00 0.00 179.25 180.20 2wbd h VAL 41 N 1.28 1.26 -0.59 0.00 2.07 -1.29 0.64 116.25 119.62 2wbd h VAL 41 Ca 0.33 -1.13 -0.02 0.00 0.82 0.00 0.00 66.70 66.69 2wbd h VAL 41 Cb -0.01 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 2wbd h VAL 41 CO -0.06 0.40 0.28 0.11 0.02 0.00 0.00 177.57 178.32 2wbd h LYS 42 N 0.83 0.85 -0.23 1.57 1.57 -1.45 0.11 116.57 119.82 2wbd h LYS 42 Ca 0.15 -0.13 -0.10 0.00 -1.87 0.00 0.00 60.65 58.70 2wbd h LYS 42 Cb 0.55 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 2wbd h LYS 42 CO 0.03 0.69 -0.27 0.00 -0.57 0.00 0.00 179.45 179.33 2wbd h ALA 43 N 1.12 1.11 -0.45 3.86 0.00 -1.14 -1.12 119.26 122.63 2wbd h ALA 43 Ca 0.20 -0.35 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 2wbd h ALA 43 Cb 0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2wbd h ALA 43 CO -0.03 0.56 0.08 0.82 0.00 0.00 0.00 179.25 180.68 2wbd h ILE 44 N 0.39 1.24 -0.86 0.00 2.04 -0.57 -2.76 117.51 117.00 2wbd h ILE 44 Ca 0.06 -0.89 -0.02 0.00 1.00 0.00 0.00 64.86 65.01 2wbd h ILE 44 Cb 0.68 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 37.67 2wbd h ILE 44 CO 0.05 0.31 0.47 -1.28 0.00 0.00 0.00 178.15 177.70 2wbd h SER 45 N 0.61 1.08 -0.49 1.72 0.87 0.01 0.14 113.55 117.49 2wbd h SER 45 Ca 0.14 -0.10 0.01 0.00 -1.23 0.00 0.00 61.79 60.61 2wbd h SER 45 Cb 0.38 -0.27 -0.03 0.00 -0.44 0.00 0.00 62.40 62.03 2wbd h SER 45 CO 0.01 0.87 0.31 -1.28 -0.53 0.00 0.00 176.83 176.21 2wbd h SER 46 N 1.20 0.53 0.17 6.23 0.87 -1.23 -1.60 113.55 119.73 2wbd h SER 46 Ca 0.30 -0.01 -0.13 0.00 -1.23 0.00 0.00 61.79 60.72 2wbd h SER 46 Cb 0.03 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.86 2wbd h SER 46 CO -0.05 0.38 -0.49 0.00 -0.53 0.00 0.00 176.83 176.15 2wbd h ALA 47 N 1.19 0.91 -0.39 6.23 0.00 -1.00 -1.98 119.26 124.23 2wbd h ALA 47 Ca 0.19 -0.47 -0.10 0.00 0.00 0.00 0.00 54.91 54.52 2wbd h ALA 47 Cb -0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2wbd h ALA 47 CO -0.05 0.66 -0.15 0.28 0.00 0.00 0.00 179.25 179.98 2wbd h VAL 48 N 0.29 1.28 0.00 0.00 2.07 -0.57 -2.10 116.25 117.22 2wbd h VAL 48 Ca 0.01 -1.27 0.00 0.00 0.82 0.00 0.00 66.70 66.27 2wbd h VAL 48 Cb 0.96 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 32.02 2wbd h VAL 48 CO 0.08 0.42 0.00 0.54 0.02 0.00 0.00 177.57 178.63 2wbd n ARG 49 N -4.30 0.65 -3.44 1.57 3.00 -0.62 -4.88 116.66 108.66 2wbd n ARG 49 Ca -0.02 0.00 -0.25 0.00 -0.01 0.00 0.00 57.85 57.57 2wbd n ARG 49 Cb 0.40 -1.02 0.03 0.00 0.00 0.00 0.00 32.46 31.86 2wbd n ARG 49 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2wbd n LYS 50 N -0.52 -4.97 -1.67 5.56 4.76 -0.79 -4.95 118.16 115.59 2wbd n LYS 50 Ca 0.01 0.68 -0.46 0.00 -2.87 0.00 0.00 58.31 55.67 2wbd n LYS 50 Cb 0.00 -5.53 -0.04 0.00 -1.84 0.00 0.00 35.03 27.62 2wbd n LYS 50 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2wbd n ALA 51 N -4.02 1.36 -1.27 7.82 0.00 -0.76 -1.84 120.51 121.80 2wbd n ALA 51 Ca -0.03 0.41 -0.09 0.00 0.00 0.00 0.00 53.44 53.73 2wbd n ALA 51 Cb 0.56 -2.39 -0.04 0.00 0.00 0.00 0.00 19.45 17.58 2wbd n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wbd n GLY 52 N 3.62 1.08 0.30 0.00 0.00 -1.26 -4.87 105.19 104.06 2wbd n GLY 52 Ca 0.18 -0.51 0.19 0.00 0.00 0.00 0.00 46.02 45.88 2wbd n GLY 52 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2wbd h ILE 53 N 0.00 0.16 -0.46 -0.61 2.10 -1.76 -1.66 117.51 115.28 2wbd h ILE 53 Ca -0.19 -0.28 0.00 0.00 1.08 0.00 0.00 64.86 65.48 2wbd h ILE 53 Cb 0.65 1.23 -0.02 0.00 -1.09 0.00 0.00 36.82 37.59 2wbd h ILE 53 CO 0.28 0.03 0.30 0.00 -1.08 0.00 0.00 178.15 177.68 2wbd h ALA 54 N 1.97 1.67 -0.09 0.18 0.00 -1.90 -1.96 119.26 119.14 2wbd h ALA 54 Ca -0.00 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 2wbd h ALA 54 Cb 0.23 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2wbd h ALA 54 CO 0.00 0.30 -0.41 0.45 0.00 0.00 0.00 179.25 179.60 2wbd h HIS 55 N 0.62 0.22 0.00 0.00 3.86 -1.70 -2.30 115.15 115.85 2wbd h HIS 55 Ca 0.17 -0.06 -0.03 0.00 -1.16 0.00 0.00 60.37 59.29 2wbd h HIS 55 Cb -0.07 -0.05 -0.00 0.00 1.06 0.00 0.00 27.41 28.34 2wbd h HIS 55 CO -0.00 0.57 -0.15 -0.07 0.86 0.00 0.00 177.93 179.14 2wbd h LEU 56 N 0.16 0.00 -3.72 2.43 3.38 -1.46 -3.16 115.31 112.94 2wbd h LEU 56 Ca 0.01 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.70 2wbd h LEU 56 Cb 0.79 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.37 2wbd h LEU 56 CO 0.06 0.15 0.31 -1.22 0.09 0.00 0.00 178.44 177.83 2wbd n TYR 57 N -3.64 2.32 -1.72 1.13 4.02 -1.02 -4.93 117.16 113.32 2wbd n TYR 57 Ca -0.01 -1.43 -0.06 0.00 -0.01 0.00 0.00 57.90 56.39 2wbd n TYR 57 Cb 0.28 -0.71 -0.01 0.00 -0.02 0.00 0.00 39.34 38.88 2wbd n TYR 57 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2wbd n GLY 58 N -0.62 0.41 0.32 2.72 0.00 -1.19 -4.97 105.19 101.86 2wbd n GLY 58 Ca 0.44 -0.72 0.04 0.00 0.00 0.00 0.00 46.02 45.78 2wbd n GLY 58 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2wbd h ILE 59 N 0.00 1.10 -0.67 -0.61 2.10 -1.61 0.74 117.51 118.55 2wbd h ILE 59 Ca -0.12 -0.21 -0.17 0.00 1.08 0.00 0.00 64.86 65.44 2wbd h ILE 59 Cb 0.79 0.45 -0.10 0.00 -1.09 0.00 0.00 36.82 36.87 2wbd h ILE 59 CO 0.16 0.11 0.21 0.00 -1.08 0.00 0.00 178.15 177.55 2wbd n ALA 60 N -2.47 4.36 -2.82 0.18 0.00 -1.26 -5.06 120.51 113.43 2wbd n ALA 60 Ca 0.04 -2.10 -0.10 0.00 0.00 0.00 0.00 53.44 51.28 2wbd n ALA 60 Cb 0.08 -1.22 0.05 0.00 0.00 0.00 0.00 19.45 18.35 2wbd n ALA 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wbd n GLY 61 N 0.02 0.06 0.00 0.00 0.00 0.25 -5.21 105.19 100.30 2wbd n GLY 61 Ca 0.36 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2wbd n GLY 61 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wbd n LYS 72 N -2.69 0.00 -0.08 1.61 5.02 -1.26 -4.59 118.16 116.17 2wbd n LYS 72 Ca -0.11 0.00 -0.09 0.00 -2.02 0.00 0.00 58.31 56.08 2wbd n LYS 72 Cb 0.58 0.00 0.06 0.00 -0.02 0.00 0.00 35.03 35.64 2wbd n LYS 72 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2wbd h LEU 73 N 0.00 0.81 -0.23 -0.35 5.85 -1.98 -0.50 115.31 118.90 2wbd h LEU 73 Ca 0.00 -0.33 -0.10 0.00 0.84 0.00 0.00 57.88 58.29 2wbd h LEU 73 Cb 0.00 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 40.80 2wbd h LEU 73 CO 0.00 1.06 -0.24 -2.24 -0.34 0.00 0.00 178.44 176.69 2wbd h ASP 74 N 0.65 0.61 -0.82 1.25 2.03 -1.93 -1.67 116.42 116.54 2wbd h ASP 74 Ca 0.07 -0.48 -0.03 0.00 -0.73 0.00 0.00 57.03 55.87 2wbd h ASP 74 Cb 0.86 -0.17 -0.04 0.00 -0.83 0.00 0.00 39.33 39.15 2wbd h ASP 74 CO 0.07 0.96 0.40 0.58 -1.03 0.00 0.00 179.24 180.23 2wbd h VAL 75 N 0.27 1.25 -0.42 4.15 2.07 -1.99 -1.62 116.25 119.96 2wbd h VAL 75 Ca 0.04 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 66.83 2wbd h VAL 75 Cb 0.79 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 2wbd h VAL 75 CO 0.06 0.30 0.17 0.25 0.02 0.00 0.00 177.57 178.37 2wbd h LEU 76 N 1.16 0.59 -0.56 2.57 5.85 -0.99 -1.66 115.31 122.26 2wbd h LEU 76 Ca 0.28 -0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 2wbd h LEU 76 Cb 0.11 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.96 2wbd h LEU 76 CO -0.04 0.59 0.35 0.28 -0.34 0.00 0.00 178.44 179.28 2wbd h SER 77 N 0.54 0.67 -0.81 1.25 0.02 -1.11 -0.36 113.55 113.75 2wbd h SER 77 Ca 0.14 -0.05 0.03 0.00 -0.84 0.00 0.00 61.79 61.08 2wbd h SER 77 Cb 0.19 -0.17 -0.05 0.00 0.14 0.00 0.00 62.40 62.52 2wbd h SER 77 CO -0.01 0.52 0.53 -1.13 -1.14 0.00 0.00 176.83 175.60 2wbd h ASN 78 N 0.76 0.86 0.56 3.07 -1.24 -1.11 -1.53 115.58 116.96 2wbd h ASN 78 Ca 0.20 -0.01 -0.21 0.00 0.71 0.00 0.00 56.30 56.99 2wbd h ASN 78 Cb -0.03 -0.20 -0.01 0.00 0.73 0.00 0.00 38.32 38.81 2wbd h ASN 78 CO -0.04 0.60 -0.93 0.44 -1.29 0.00 0.00 177.43 176.21 2wbd h ASP 79 N 1.00 0.31 -0.56 1.15 3.32 -0.54 -1.06 116.42 120.04 2wbd h ASP 79 Ca 0.32 -0.26 -0.09 0.00 0.02 0.00 0.00 57.03 57.02 2wbd h ASP 79 Cb 0.03 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 2wbd h ASP 79 CO -0.09 1.08 0.00 -0.07 -1.72 0.00 0.00 179.24 178.44 2wbd h LEU 80 N 0.12 0.98 0.15 1.55 3.38 -0.60 -0.87 115.31 120.03 2wbd h LEU 80 Ca -0.06 -0.27 -0.20 0.00 0.09 0.00 0.00 57.88 57.44 2wbd h LEU 80 Cb 1.57 -0.26 0.02 0.00 0.09 0.00 0.00 40.66 42.08 2wbd h LEU 80 CO 0.15 1.03 -0.88 0.58 0.09 0.00 0.00 178.44 179.40 2wbd h VAL 81 N 0.93 1.48 0.19 1.22 2.07 -1.25 -1.39 116.25 119.50 2wbd h VAL 81 Ca 0.17 -2.53 0.01 0.00 0.82 0.00 0.00 66.70 65.16 2wbd h VAL 81 Cb 0.53 3.15 -0.04 0.00 -1.52 0.00 0.00 31.29 33.41 2wbd h VAL 81 CO 0.03 0.72 -0.50 0.24 0.02 0.00 0.00 177.57 178.08 2wbd h MET 82 N -0.29 -0.75 -0.57 1.57 2.86 -1.28 -1.99 114.93 114.47 2wbd h MET 82 Ca -0.15 0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.54 2wbd h MET 82 Cb 1.69 0.17 -0.03 0.00 0.06 0.00 0.00 31.60 33.49 2wbd h MET 82 CO 0.17 -0.50 0.34 -0.97 1.06 0.00 0.00 176.91 177.01 2wbd h ASN 83 N -0.78 0.69 -0.39 1.22 -1.24 -1.20 -1.10 115.58 112.78 2wbd h ASN 83 Ca -0.01 -0.06 -0.06 0.00 0.71 0.00 0.00 56.30 56.88 2wbd h ASN 83 Cb 0.77 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 39.63 2wbd h ASN 83 CO -0.24 0.55 0.02 0.24 -1.29 0.00 0.00 177.43 176.72 2wbd h MET 84 N 0.77 0.67 -0.12 6.67 2.86 -1.25 -2.36 114.93 122.17 2wbd h MET 84 Ca 0.20 -0.20 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2wbd h MET 84 Cb -0.01 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.58 2wbd h MET 84 CO -0.04 0.75 -0.01 -0.07 1.06 0.00 0.00 176.91 178.61 2wbd h LEU 85 N 0.50 0.21 -0.44 1.22 3.38 -1.14 -2.39 115.31 116.66 2wbd h LEU 85 Ca 0.11 -0.32 0.09 0.00 0.09 0.00 0.00 57.88 57.85 2wbd h LEU 85 Cb 0.43 -0.06 -0.09 0.00 0.09 0.00 0.00 40.66 41.03 2wbd h LEU 85 CO 0.02 0.48 -0.20 0.11 0.09 0.00 0.00 178.44 178.94 2wbd h LYS 86 N -0.06 -0.10 -0.01 1.13 1.57 -1.23 -1.26 116.57 116.60 2wbd h LYS 86 Ca 0.03 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 2wbd h LYS 86 Cb 0.38 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2wbd h LYS 86 CO 0.01 -0.07 0.00 -1.13 -0.57 0.00 0.00 179.45 177.69 2wbd n SER 87 N -5.38 0.08 0.14 0.86 3.41 -0.89 -2.65 113.62 109.18 2wbd n SER 87 Ca 0.03 -1.77 0.08 0.00 -0.26 0.00 0.00 58.87 56.95 2wbd n SER 87 Cb 0.29 -0.01 0.05 0.00 -0.26 0.00 0.00 64.21 64.29 2wbd n SER 87 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2wbd h SER 88 N 0.09 0.00 -2.62 4.04 4.64 -0.69 -3.48 113.55 115.53 2wbd h SER 88 Ca 0.00 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.09 2wbd h SER 88 Cb 0.02 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.14 2wbd h SER 88 CO 0.00 0.19 -0.33 0.49 -0.87 0.00 0.00 176.83 176.31 2wbd n PHE 89 N -2.97 -1.05 -0.44 4.77 3.01 -1.08 -4.79 117.46 114.91 2wbd n PHE 89 Ca 0.00 0.27 0.00 0.00 1.01 0.00 0.00 57.45 58.73 2wbd n PHE 89 Cb 0.63 -2.93 0.00 0.00 -0.01 0.00 0.00 39.48 37.16 2wbd n PHE 89 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2wbd n ALA 90 N -2.67 1.30 -2.29 4.37 0.00 -1.26 -4.03 120.51 115.93 2wbd n ALA 90 Ca -0.07 -0.25 -0.16 0.00 0.00 0.00 0.00 53.44 52.96 2wbd n ALA 90 Cb 0.57 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.92 2wbd n ALA 90 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2wbd s THR 91 N -0.03 1.43 0.00 0.00 -4.23 -1.26 -0.63 115.64 110.91 2wbd s THR 91 Ca 0.00 -2.13 0.00 0.00 -1.18 0.00 0.00 61.69 58.38 2wbd s THR 91 Cb 0.00 -1.94 0.00 0.00 1.34 0.00 0.00 72.50 71.90 2wbd s THR 91 CO 0.00 -0.67 0.00 0.00 -0.54 0.00 0.00 174.62 173.41 2wbd s VAL 93 N -0.77 -0.01 -0.03 0.00 1.01 -1.25 -0.63 120.40 118.72 2wbd s VAL 93 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 2wbd s VAL 93 Cb 0.00 -0.09 0.03 0.00 0.00 0.00 0.00 36.38 36.32 2wbd s VAL 93 CO 0.00 0.01 0.04 -0.76 0.00 0.00 0.00 175.10 174.39 2wbd s LEU 94 N 0.17 0.69 -0.22 3.92 1.43 0.04 -2.16 118.68 122.54 2wbd s LEU 94 Ca -0.01 0.05 -0.01 0.00 -1.03 0.00 0.00 54.13 53.13 2wbd s LEU 94 Cb -0.02 -0.12 0.02 0.00 0.03 0.00 0.00 46.19 46.11 2wbd s LEU 94 CO -0.00 -0.18 -0.11 -0.69 0.23 0.00 0.00 176.35 175.60 2wbd s VAL 95 N 1.54 2.61 0.21 -1.59 1.01 0.31 0.06 120.40 124.55 2wbd s VAL 95 Ca -0.03 -0.95 0.07 0.00 0.00 0.00 0.00 61.98 61.07 2wbd s VAL 95 Cb -0.13 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.97 2wbd s VAL 95 CO -0.03 0.34 0.07 -0.55 0.00 0.00 0.00 175.10 174.93 2wbd s SER 96 N 1.32 5.03 0.39 3.32 0.15 -1.26 0.62 113.70 123.27 2wbd s SER 96 Ca 0.02 -0.36 0.07 0.00 0.70 0.00 0.00 55.95 56.38 2wbd s SER 96 Cb -0.15 -1.15 0.81 0.00 -1.71 0.00 0.00 66.02 63.82 2wbd s SER 96 CO -0.07 0.04 2.01 -0.08 1.20 0.00 0.00 173.24 176.33 2wbd h GLU 97 N 2.23 0.63 -0.26 5.44 4.22 -1.74 -3.14 114.58 121.96 2wbd h GLU 97 Ca -0.47 -0.04 -0.14 0.00 0.08 0.00 0.00 59.36 58.79 2wbd h GLU 97 Cb 1.22 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.33 2wbd h GLU 97 CO 0.60 0.42 -0.38 0.93 -2.18 0.00 0.00 179.01 178.40 2wbd h GLU 98 N 0.65 0.71 -5.22 1.92 4.39 -1.95 -3.45 114.58 111.64 2wbd h GLU 98 Ca 0.24 -0.42 -0.61 0.00 0.34 0.00 0.00 59.36 58.90 2wbd h GLU 98 Cb 0.13 0.04 -0.13 0.00 -0.10 0.00 0.00 28.75 28.69 2wbd h GLU 98 CO -0.07 1.04 -0.43 -0.51 -1.16 0.00 0.00 179.01 177.89 2wbd s ASP 99 N -6.66 6.22 0.48 1.42 1.01 -1.19 -4.98 116.67 112.98 2wbd s ASP 99 Ca -0.12 0.25 0.18 0.00 0.71 0.00 0.00 52.55 53.56 2wbd s ASP 99 Cb 0.08 -2.13 1.15 0.00 1.01 0.00 0.00 42.92 43.03 2wbd s ASP 99 CO 0.84 0.06 2.04 0.50 0.21 0.00 0.00 175.17 178.82 2wbd h LYS 100 N 7.27 0.00 -6.48 8.23 1.63 -1.87 -3.42 116.57 121.93 2wbd h LYS 100 Ca -0.38 0.00 -0.63 0.00 -0.85 0.00 0.00 60.65 58.79 2wbd h LYS 100 Cb 1.16 0.00 -0.19 0.00 -0.60 0.00 0.00 32.23 32.60 2wbd h LYS 100 CO 0.69 0.14 -0.82 -3.38 -3.45 0.00 0.00 179.45 172.64 2wbd s HIS 101 N -4.61 2.17 0.36 1.91 -3.43 -1.26 -4.96 115.29 105.47 2wbd s HIS 101 Ca -0.04 -0.39 -0.28 0.00 -0.80 0.00 0.00 55.06 53.56 2wbd s HIS 101 Cb 0.15 -1.09 -0.10 0.00 -1.43 0.00 0.00 32.58 30.11 2wbd s HIS 101 CO 0.67 0.43 1.33 0.00 -2.00 0.00 0.00 174.74 175.16 2wbd s ALA 102 N -1.64 3.43 -0.11 -1.38 0.00 -1.26 -4.86 121.76 115.94 2wbd s ALA 102 Ca 0.18 1.29 -0.27 0.00 0.00 0.00 0.00 51.96 53.16 2wbd s ALA 102 Cb -0.08 -3.50 -0.02 0.00 0.00 0.00 0.00 23.12 19.53 2wbd s ALA 102 CO 0.08 -0.74 0.88 0.42 0.00 0.00 0.00 175.76 176.40 2wbd s ILE 103 N -1.18 4.88 -0.24 0.00 -1.09 0.11 -4.87 121.20 118.81 2wbd s ILE 103 Ca 0.52 1.78 -0.17 0.00 -2.23 0.00 0.00 60.65 60.55 2wbd s ILE 103 Cb -0.40 -4.20 -0.03 0.00 -1.58 0.00 0.00 42.46 36.25 2wbd s ILE 103 CO 0.53 0.08 0.46 -0.63 -1.23 0.00 0.00 174.94 174.15 2wbd s ILE 104 N 1.72 5.13 0.32 2.92 -1.09 -1.26 -0.78 121.20 128.15 2wbd s ILE 104 Ca 0.43 0.80 -0.29 0.00 -2.23 0.00 0.00 60.65 59.36 2wbd s ILE 104 Cb -0.18 -3.78 -0.10 0.00 -1.58 0.00 0.00 42.46 36.82 2wbd s ILE 104 CO 0.17 0.16 1.29 -0.69 -1.23 0.00 0.00 174.94 174.64 2wbd s VAL 105 N 1.88 2.79 0.14 2.92 1.01 0.20 -4.95 120.40 124.39 2wbd s VAL 105 Ca 0.20 0.79 -0.34 0.00 0.00 0.00 0.00 61.98 62.63 2wbd s VAL 105 Cb -0.15 -3.50 -0.17 0.00 0.00 0.00 0.00 36.38 32.56 2wbd s VAL 105 CO 0.09 0.18 1.08 -0.62 0.00 0.00 0.00 175.10 175.84 2wbd n GLU 106 N 0.94 0.85 -0.33 2.72 1.02 -1.26 -4.80 120.64 119.77 2wbd n GLU 106 Ca 0.00 0.30 -0.02 0.00 -0.02 0.00 0.00 57.16 57.42 2wbd n GLU 106 Cb 0.42 -1.75 0.01 0.00 -0.02 0.00 0.00 31.44 30.10 2wbd n GLU 106 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 2wbd n PRO 107 N 1.67 -0.23 0.00 3.49 -0.02 -1.26 -1.06 135.00 137.59 2wbd n PRO 107 Ca 0.16 1.30 0.15 0.00 -2.02 0.00 0.00 63.50 63.09 2wbd n PRO 107 Cb 0.22 -1.92 0.83 0.00 -0.02 0.00 0.00 33.50 32.61 2wbd n PRO 107 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 2wbd n GLU 108 N -5.21 0.73 -0.16 -0.52 0.00 -1.26 -2.46 120.64 111.75 2wbd n GLU 108 Ca 0.07 -0.04 0.07 0.00 0.00 0.00 0.00 57.16 57.26 2wbd n GLU 108 Cb 0.32 -1.50 0.15 0.00 0.00 0.00 0.00 31.44 30.41 2wbd n GLU 108 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2wbd n LYS 109 N -1.11 2.40 -2.70 3.44 5.02 -0.22 -5.04 118.16 119.95 2wbd n LYS 109 Ca 0.19 -1.97 -0.40 0.00 -2.02 0.00 0.00 58.31 54.11 2wbd n LYS 109 Cb 0.19 -1.31 -0.06 0.00 -0.02 0.00 0.00 35.03 33.83 2wbd n LYS 109 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2wbd s ARG 110 N -1.02 4.79 0.00 1.97 0.52 -1.03 -4.05 118.95 120.13 2wbd s ARG 110 Ca 0.25 1.53 0.00 0.00 -0.52 0.00 0.00 55.73 56.99 2wbd s ARG 110 Cb 0.14 -3.21 0.00 0.00 0.52 0.00 0.00 34.95 32.40 2wbd s ARG 110 CO 0.18 0.44 0.00 0.41 0.02 0.00 0.00 175.30 176.35 2wbd n GLY 111 N 1.34 4.61 0.07 -3.53 0.00 -0.74 -4.74 105.19 102.20 2wbd n GLY 111 Ca -0.01 -1.70 0.14 0.00 0.00 0.00 0.00 46.02 44.45 2wbd n GLY 111 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2wbd n LYS 112 N 0.00 0.43 -4.43 1.61 2.85 -1.11 -3.79 118.16 113.72 2wbd n LYS 112 Ca 0.00 -0.14 -0.33 0.00 -1.05 0.00 0.00 58.31 56.79 2wbd n LYS 112 Cb 0.00 -1.50 -0.10 0.00 -0.65 0.00 0.00 35.03 32.78 2wbd n LYS 112 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 2wbd s TYR 113 N -2.67 2.96 -0.29 5.58 2.02 0.19 -0.15 117.35 125.00 2wbd s TYR 113 Ca 0.23 0.02 -0.09 0.00 -0.37 0.00 0.00 57.07 56.85 2wbd s TYR 113 Cb 0.19 -1.65 -0.02 0.00 -0.40 0.00 0.00 41.96 40.09 2wbd s TYR 113 CO 0.52 0.39 0.13 0.08 -1.57 0.00 0.00 175.55 175.11 2wbd s VAL 114 N -0.98 4.56 -0.19 0.71 1.01 0.25 -1.50 120.40 124.26 2wbd s VAL 114 Ca 0.17 -0.31 -0.07 0.00 0.00 0.00 0.00 61.98 61.77 2wbd s VAL 114 Cb -0.11 -3.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.97 2wbd s VAL 114 CO 0.07 0.16 0.05 -0.69 0.00 0.00 0.00 175.10 174.69 2wbd s VAL 115 N 1.62 4.61 -0.11 2.92 1.01 -0.92 -0.40 120.40 129.13 2wbd s VAL 115 Ca 0.05 -0.09 -0.00 0.00 0.00 0.00 0.00 61.98 61.94 2wbd s VAL 115 Cb -0.16 -3.08 -0.02 0.00 0.00 0.00 0.00 36.38 33.11 2wbd s VAL 115 CO 0.06 0.44 -0.10 0.00 0.00 0.00 0.00 175.10 175.50 2wbd s PHE 117 N -0.04 -0.33 -0.33 0.00 -0.71 0.20 -0.99 117.98 115.78 2wbd s PHE 117 Ca -0.02 0.25 -0.04 0.00 -1.04 0.00 0.00 56.93 56.09 2wbd s PHE 117 Cb -0.14 0.30 0.06 0.00 -1.21 0.00 0.00 43.02 42.03 2wbd s PHE 117 CO 0.03 -0.65 0.07 0.34 -1.34 0.00 0.00 175.22 173.68 2wbd s ASP 118 N -2.22 5.10 0.25 1.98 -1.08 -0.19 -1.74 116.67 118.78 2wbd s ASP 118 Ca -0.03 -1.38 -0.03 0.00 -0.52 0.00 0.00 52.55 50.59 2wbd s ASP 118 Cb -0.00 -1.79 0.30 0.00 -1.46 0.00 0.00 42.92 39.97 2wbd s ASP 118 CO -0.05 -0.34 1.73 1.55 0.52 0.00 0.00 175.17 178.59 2wbd h PRO 119 N 8.08 0.80 -1.92 4.34 0.13 -1.85 0.14 132.00 141.73 2wbd h PRO 119 Ca -0.20 -0.23 -0.41 0.00 -0.87 0.00 0.00 66.00 64.29 2wbd h PRO 119 Cb 1.07 -0.09 -0.31 0.00 0.13 0.00 0.00 31.00 31.80 2wbd h PRO 119 CO 0.59 0.83 -0.75 -1.17 -0.23 0.00 0.00 178.00 177.27 2wbd s LEU 120 N -9.14 0.18 0.16 1.56 2.96 -1.24 -4.19 118.68 108.99 2wbd s LEU 120 Ca -0.10 -2.12 -0.30 0.00 -0.22 0.00 0.00 54.13 51.39 2wbd s LEU 120 Cb 0.14 0.46 -0.07 0.00 0.50 0.00 0.00 46.19 47.22 2wbd s LEU 120 CO 0.82 -0.19 0.95 -0.62 -1.32 0.00 0.00 176.35 175.99 2wbd s ASP 121 N 0.86 7.56 0.00 3.68 2.15 0.22 -3.24 116.67 127.90 2wbd s ASP 121 Ca 0.25 1.86 0.00 0.00 0.43 0.00 0.00 52.55 55.09 2wbd s ASP 121 Cb -0.07 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 39.96 2wbd s ASP 121 CO -0.08 0.03 0.00 0.61 -0.17 0.00 0.00 175.17 175.55 2wbd n GLY 122 N 1.94 0.78 0.00 2.66 0.00 -1.26 -1.94 105.19 107.36 2wbd n GLY 122 Ca 0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.07 2wbd n GLY 122 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wbd n SER 123 N 0.00 0.00 0.05 1.61 3.41 -1.20 -2.12 113.62 115.38 2wbd n SER 123 Ca 0.00 -0.67 -0.12 0.00 -0.26 0.00 0.00 58.87 57.82 2wbd n SER 123 Cb 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 2wbd n SER 123 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2wbd h SER 124 N 0.00 -0.16 -0.42 4.04 0.02 -1.90 -3.32 113.55 111.80 2wbd h SER 124 Ca 0.00 -0.37 -0.18 0.00 -0.84 0.00 0.00 61.79 60.40 2wbd h SER 124 Cb 0.00 0.04 -0.11 0.00 0.14 0.00 0.00 62.40 62.47 2wbd h SER 124 CO 0.00 0.34 0.23 0.59 -1.14 0.00 0.00 176.83 176.85 2wbd n ASN 125 N -4.94 3.33 0.30 3.07 4.13 -0.90 -4.61 115.26 115.65 2wbd n ASN 125 Ca -0.08 -2.68 0.19 0.00 1.68 0.00 0.00 54.58 53.69 2wbd n ASN 125 Cb 0.27 -0.64 0.88 0.00 -1.54 0.00 0.00 39.78 38.74 2wbd n ASN 125 CO 0.00 0.00 0.00 -0.29 0.28 0.00 0.00 177.26 177.25 2wbd h ILE 126 N 0.85 0.04 0.00 2.41 2.10 -1.64 -2.81 117.51 118.46 2wbd h ILE 126 Ca 0.22 -0.34 -0.02 0.00 1.08 0.00 0.00 64.86 65.80 2wbd h ILE 126 Cb 1.71 1.32 -0.00 0.00 -1.09 0.00 0.00 36.82 38.76 2wbd h ILE 126 CO 0.45 0.01 -0.10 0.44 -1.08 0.00 0.00 178.15 177.87 2wbd h ASP 127 N 0.00 0.00 -0.67 2.19 3.32 -1.89 -1.41 116.42 117.96 2wbd h ASP 127 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2wbd h ASP 127 Cb 0.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.87 2wbd h ASP 127 CO 0.00 0.10 0.00 0.00 -1.72 0.00 0.00 179.24 177.62 2wbd n LEU 129 N 1.32 -1.42 -4.64 0.00 4.77 -0.53 -4.97 117.00 111.54 2wbd n LEU 129 Ca 0.25 0.47 -0.41 0.00 -0.03 0.00 0.00 56.01 56.28 2wbd n LEU 129 Cb 0.75 -2.69 0.01 0.00 -2.33 0.00 0.00 43.42 39.15 2wbd n LEU 129 CO 0.20 -1.00 0.69 0.55 -1.33 0.00 0.00 177.39 176.50 2wbd n VAL 130 N -2.30 2.48 -1.59 4.08 3.14 -1.26 -4.92 118.33 117.95 2wbd n VAL 130 Ca -0.19 -0.50 -0.42 0.00 -2.96 0.00 0.00 64.34 60.27 2wbd n VAL 130 Cb 0.64 -1.29 0.01 0.00 -1.06 0.00 0.00 33.84 32.14 2wbd n VAL 130 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2wbd n SER 131 N 0.42 0.96 -4.40 6.55 7.64 -1.26 -4.81 113.62 118.73 2wbd n SER 131 Ca 0.09 1.03 -0.20 0.00 1.01 0.00 0.00 58.87 60.79 2wbd n SER 131 Cb 0.39 -1.32 -0.10 0.00 -1.01 0.00 0.00 64.21 62.17 2wbd n SER 131 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2wbd s VAL 132 N -1.28 1.72 0.19 0.44 -7.23 -1.25 -4.83 120.40 108.16 2wbd s VAL 132 Ca 0.63 -2.17 -0.10 0.00 -1.81 0.00 0.00 61.98 58.53 2wbd s VAL 132 Cb -0.57 -2.28 -0.01 0.00 0.56 0.00 0.00 36.38 34.08 2wbd s VAL 132 CO 0.57 -0.42 0.35 -0.83 -0.31 0.00 0.00 175.10 174.46 2wbd s GLY 133 N -3.40 0.52 -0.04 2.32 0.00 -0.82 -1.46 107.32 104.44 2wbd s GLY 133 Ca 0.27 -0.89 0.04 0.00 0.00 0.00 0.00 44.72 44.14 2wbd s GLY 133 CO 0.10 -0.77 -0.15 -1.59 0.00 0.00 0.00 173.10 170.69 2wbd s THR 134 N -3.99 2.98 -0.07 0.90 2.01 0.22 0.70 115.64 118.39 2wbd s THR 134 Ca 0.20 -0.77 0.01 0.00 0.31 0.00 0.00 61.69 61.44 2wbd s THR 134 Cb 0.02 -2.16 0.02 0.00 0.01 0.00 0.00 72.50 70.39 2wbd s THR 134 CO 0.03 0.58 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.82 2wbd s ILE 135 N -0.73 0.94 0.11 1.82 1.01 0.04 -0.26 121.20 124.13 2wbd s ILE 135 Ca 0.12 -0.33 0.04 0.00 0.00 0.00 0.00 60.65 60.48 2wbd s ILE 135 Cb -0.11 -0.91 -0.04 0.00 0.01 0.00 0.00 42.46 41.41 2wbd s ILE 135 CO 0.01 0.32 -0.11 0.72 0.00 0.00 0.00 174.94 175.88 2wbd s PHE 136 N 1.02 1.19 -0.22 3.97 -0.71 -0.60 -1.02 117.98 121.61 2wbd s PHE 136 Ca -0.08 -0.63 -0.05 0.00 -1.04 0.00 0.00 56.93 55.12 2wbd s PHE 136 Cb -0.15 -0.63 0.11 0.00 -1.21 0.00 0.00 43.02 41.14 2wbd s PHE 136 CO -0.00 0.06 0.41 0.20 -1.34 0.00 0.00 175.22 174.54 2wbd s GLY 137 N -2.53 -0.40 -0.19 1.99 0.00 -0.16 -1.34 107.32 104.68 2wbd s GLY 137 Ca 0.08 1.30 -0.04 0.00 0.00 0.00 0.00 44.72 46.06 2wbd s GLY 137 CO 0.01 2.54 -0.04 -0.42 0.00 0.00 0.00 173.10 175.19 2wbd s ILE 138 N 2.60 3.62 0.24 0.90 1.01 -0.45 -0.52 121.20 128.60 2wbd s ILE 138 Ca 0.04 -0.43 0.12 0.00 0.00 0.00 0.00 60.65 60.38 2wbd s ILE 138 Cb -0.13 -2.62 -0.05 0.00 0.01 0.00 0.00 42.46 39.67 2wbd s ILE 138 CO -0.14 0.44 -0.22 -0.31 0.00 0.00 0.00 174.94 174.71 2wbd s TYR 139 N 1.04 2.29 -0.03 3.97 2.02 0.46 -0.62 117.35 126.48 2wbd s TYR 139 Ca 0.01 -0.34 -0.20 0.00 -0.37 0.00 0.00 57.07 56.16 2wbd s TYR 139 Cb -0.15 -1.06 -0.05 0.00 -0.40 0.00 0.00 41.96 40.30 2wbd s TYR 139 CO 0.01 0.62 0.59 0.50 -1.57 0.00 0.00 175.55 175.69 2wbd s ARG 140 N -3.12 4.32 0.28 -0.62 3.52 -1.26 -0.58 118.95 121.50 2wbd s ARG 140 Ca 0.26 0.70 -0.30 0.00 -0.13 0.00 0.00 55.73 56.26 2wbd s ARG 140 Cb -0.06 -3.37 -0.10 0.00 -1.56 0.00 0.00 34.95 29.86 2wbd s ARG 140 CO 0.13 0.31 1.43 0.21 -0.81 0.00 0.00 175.30 176.56 2wbd s LYS 141 N 0.03 4.26 -0.11 5.12 2.20 0.79 -4.79 119.74 127.24 2wbd s LYS 141 Ca 0.31 2.33 0.16 0.00 -0.36 0.00 0.00 55.97 58.42 2wbd s LYS 141 Cb -0.18 -3.08 -0.24 0.00 -1.51 0.00 0.00 37.83 32.83 2wbd s LYS 141 CO 0.16 -0.41 0.37 1.63 -0.36 0.00 0.00 175.35 176.74 2wbd n LYS 142 N 1.85 0.66 -4.36 4.03 4.76 -1.26 -4.99 118.16 118.85 2wbd n LYS 142 Ca 0.05 0.10 -0.19 0.00 -2.87 0.00 0.00 58.31 55.40 2wbd n LYS 142 Cb 0.40 -1.64 -0.10 0.00 -1.84 0.00 0.00 35.03 31.85 2wbd n LYS 142 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2wbd s SER 143 N -5.65 2.60 0.00 4.39 1.04 -1.26 -5.03 113.70 109.79 2wbd s SER 143 Ca -0.07 -1.07 0.10 0.00 0.48 0.00 0.00 55.95 55.39 2wbd s SER 143 Cb 0.07 -0.14 0.43 0.00 0.10 0.00 0.00 66.02 66.49 2wbd s SER 143 CO 0.83 -0.22 1.30 0.35 0.98 0.00 0.00 173.24 176.49 2wbd n THR 144 N -0.43 0.15 -0.86 2.02 -2.24 -1.26 -4.91 114.28 106.75 2wbd n THR 144 Ca -0.07 -0.17 -0.33 0.00 -2.27 0.00 0.00 64.05 61.20 2wbd n THR 144 Cb 0.61 0.05 0.12 0.00 -2.10 0.00 0.00 70.33 69.01 2wbd n THR 144 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2wbd n ASP 145 N -0.17 -1.56 -4.65 3.42 9.92 -1.26 -4.90 116.55 117.34 2wbd n ASP 145 Ca 0.08 0.39 -0.47 0.00 -0.53 0.00 0.00 54.79 54.27 2wbd n ASP 145 Cb 0.14 -1.25 -0.04 0.00 -0.64 0.00 0.00 41.12 39.33 2wbd n ASP 145 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 2wbd n GLU 146 N -1.90 1.91 -1.72 -1.24 4.07 -1.26 -4.88 120.64 115.62 2wbd n GLU 146 Ca 0.08 0.69 -0.43 0.00 -0.06 0.00 0.00 57.16 57.44 2wbd n GLU 146 Cb 0.53 -2.39 -0.02 0.00 -0.06 0.00 0.00 31.44 29.50 2wbd n GLU 146 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 2wbd n PRO 147 N 2.80 2.51 -3.89 5.31 -0.04 -1.26 -5.01 135.00 135.41 2wbd n PRO 147 Ca 0.16 0.89 -0.09 0.00 -0.04 0.00 0.00 63.50 64.42 2wbd n PRO 147 Cb 0.28 -2.64 -0.05 0.00 -0.04 0.00 0.00 33.50 31.05 2wbd n PRO 147 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2wbd s SER 148 N 0.45 -0.15 0.30 3.54 1.04 -1.26 -4.99 113.70 112.62 2wbd s SER 148 Ca 0.65 -0.74 0.09 0.00 0.48 0.00 0.00 55.95 56.44 2wbd s SER 148 Cb -0.54 0.58 0.90 0.00 0.10 0.00 0.00 66.02 67.06 2wbd s SER 148 CO 0.49 -1.11 1.38 -0.62 0.98 0.00 0.00 173.24 174.36 2wbd n GLU 149 N -0.36 -0.06 -0.31 4.02 1.02 -1.26 -1.15 120.64 122.54 2wbd n GLU 149 Ca -0.05 1.27 0.21 0.00 -0.02 0.00 0.00 57.16 58.57 2wbd n GLU 149 Cb 0.62 -2.13 0.49 0.00 -0.02 0.00 0.00 31.44 30.39 2wbd n GLU 149 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2wbd h LYS 150 N 0.00 0.42 0.00 3.49 1.57 -1.98 -0.44 116.57 119.64 2wbd h LYS 150 Ca 0.63 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.38 2wbd h LYS 150 Cb 1.49 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.71 2wbd h LYS 150 CO -0.76 0.28 0.00 -0.44 -0.57 0.00 0.00 179.45 177.96 2wbd h ASP 151 N 0.44 0.00 1.13 0.86 3.32 -1.54 -1.11 116.42 119.51 2wbd h ASP 151 Ca 0.57 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.59 2wbd h ASP 151 Cb 1.39 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.93 2wbd h ASP 151 CO -0.29 0.00 -0.89 0.00 -1.72 0.00 0.00 179.24 176.34 2wbd h ALA 152 N 2.07 0.61 0.00 3.45 0.00 -1.24 -3.40 119.26 120.74 2wbd h ALA 152 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2wbd h ALA 152 Cb 0.18 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2wbd h ALA 152 CO 0.00 0.17 0.00 1.28 0.00 0.00 0.00 179.25 180.70 2wbd n LEU 153 N -2.80 3.30 -4.83 0.00 4.77 -0.42 -4.84 117.00 112.19 2wbd n LEU 153 Ca -0.01 -1.53 -0.35 0.00 -0.03 0.00 0.00 56.01 54.09 2wbd n LEU 153 Cb 0.60 -0.66 -0.06 0.00 -2.33 0.00 0.00 43.42 40.97 2wbd n LEU 153 CO 0.40 0.61 0.37 -1.10 -1.33 0.00 0.00 177.39 176.33 2wbd s GLN 154 N 0.43 4.15 0.48 3.23 -0.21 -1.26 -4.26 119.66 122.21 2wbd s GLN 154 Ca 0.00 0.74 -0.21 0.00 0.02 0.00 0.00 55.36 55.91 2wbd s GLN 154 Cb 0.00 -2.85 -0.08 0.00 1.00 0.00 0.00 33.01 31.08 2wbd s GLN 154 CO 0.00 0.39 1.06 -1.25 -2.12 0.00 0.00 175.29 173.37 2wbd s PRO 155 N -2.08 3.81 0.56 2.91 0.04 -1.26 -4.68 135.00 134.29 2wbd s PRO 155 Ca 0.43 1.44 0.26 0.00 0.04 0.00 0.00 61.00 63.17 2wbd s PRO 155 Cb -0.15 -2.18 1.48 0.00 0.04 0.00 0.00 34.50 33.68 2wbd s PRO 155 CO 0.20 -0.44 2.02 0.78 0.04 0.00 0.00 177.00 179.60 2wbd h GLY 156 N 1.71 0.00 -0.82 0.56 0.00 -1.60 0.27 103.07 103.20 2wbd h GLY 156 Ca -0.49 0.00 0.40 0.00 0.00 0.00 0.00 47.33 47.24 2wbd h GLY 156 CO 0.59 0.00 0.99 3.21 0.00 0.00 0.00 176.54 181.33 2wbd h ARG 157 N 0.00 0.03 -0.12 4.80 2.47 -1.66 -1.39 114.38 118.52 2wbd h ARG 157 Ca 0.19 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.90 2wbd h ARG 157 Cb 0.84 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.15 2wbd h ARG 157 CO -0.00 0.02 0.00 0.09 0.56 0.00 0.00 179.97 180.64 2wbd n ASN 158 N -4.18 1.12 -4.76 7.04 4.13 0.08 -4.93 115.26 113.76 2wbd n ASN 158 Ca 0.31 -1.65 -0.41 0.00 1.68 0.00 0.00 54.58 54.51 2wbd n ASN 158 Cb 1.43 -0.08 -0.02 0.00 -1.54 0.00 0.00 39.78 39.58 2wbd n ASN 158 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2wbd s LEU 159 N -1.51 4.39 -0.18 3.41 1.43 -0.53 -4.58 118.68 121.12 2wbd s LEU 159 Ca 0.29 2.76 -0.20 0.00 -1.03 0.00 0.00 54.13 55.95 2wbd s LEU 159 Cb 0.15 -3.65 -0.22 0.00 0.03 0.00 0.00 46.19 42.51 2wbd s LEU 159 CO 0.23 -0.65 0.34 0.58 0.23 0.00 0.00 176.35 177.08 2wbd h VAL 160 N 3.16 0.98 -3.83 -1.59 2.07 -1.22 -3.49 116.25 112.34 2wbd h VAL 160 Ca -0.48 -2.25 -0.09 0.00 0.82 0.00 0.00 66.70 64.69 2wbd h VAL 160 Cb 1.23 2.45 -0.13 0.00 -1.52 0.00 0.00 31.29 33.31 2wbd h VAL 160 CO 0.69 0.47 -0.34 0.00 0.02 0.00 0.00 177.57 178.41 2wbd s ALA 161 N -2.39 -0.15 0.02 1.67 0.00 -1.19 -4.53 121.76 115.20 2wbd s ALA 161 Ca -0.26 -0.72 -0.28 0.00 0.00 0.00 0.00 51.96 50.71 2wbd s ALA 161 Cb 0.05 0.67 0.10 0.00 0.00 0.00 0.00 23.12 23.93 2wbd s ALA 161 CO 0.65 -0.58 0.83 0.00 0.00 0.00 0.00 175.76 176.66 2wbd s ALA 162 N -3.91 -1.78 0.00 0.00 0.00 -0.52 -1.33 121.76 114.22 2wbd s ALA 162 Ca 0.10 0.92 0.00 0.00 0.00 0.00 0.00 51.96 52.99 2wbd s ALA 162 Cb 0.04 0.48 0.00 0.00 0.00 0.00 0.00 23.12 23.64 2wbd s ALA 162 CO -0.06 -0.69 0.00 0.41 0.00 0.00 0.00 175.76 175.42 2wbd n GLY 163 N -0.22 -0.62 3.58 0.00 0.00 -0.45 -0.67 105.19 106.81 2wbd n GLY 163 Ca -0.11 -0.56 -0.08 0.00 0.00 0.00 0.00 46.02 45.27 2wbd n GLY 163 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2wbd s TYR 164 N -4.00 -0.29 -0.18 1.61 -0.85 -0.74 -1.55 117.35 111.35 2wbd s TYR 164 Ca 0.00 0.43 -0.05 0.00 -0.52 0.00 0.00 57.07 56.94 2wbd s TYR 164 Cb 0.00 0.47 -0.03 0.00 0.38 0.00 0.00 41.96 42.79 2wbd s TYR 164 CO 0.00 -0.31 -0.01 0.00 -1.52 0.00 0.00 175.55 173.71 2wbd s ALA 165 N -1.50 3.05 -0.21 9.51 0.00 0.64 -0.95 121.76 132.30 2wbd s ALA 165 Ca 0.02 -0.90 -0.05 0.00 0.00 0.00 0.00 51.96 51.03 2wbd s ALA 165 Cb -0.01 -1.69 -0.02 0.00 0.00 0.00 0.00 23.12 21.40 2wbd s ALA 165 CO -0.02 0.04 0.00 -1.17 0.00 0.00 0.00 175.76 174.61 2wbd s LEU 166 N 0.67 3.23 -1.12 0.00 2.96 -0.56 -0.61 118.68 123.25 2wbd s LEU 166 Ca -0.01 -0.23 -0.09 0.00 -0.22 0.00 0.00 54.13 53.58 2wbd s LEU 166 Cb -0.14 -1.83 0.27 0.00 0.50 0.00 0.00 46.19 45.00 2wbd s LEU 166 CO 0.02 0.04 1.18 -1.22 -1.32 0.00 0.00 176.35 175.04 2wbd n TYR 167 N 4.43 5.00 -0.88 5.38 4.01 -0.54 -1.60 117.16 132.97 2wbd n TYR 167 Ca -0.17 -3.76 0.00 0.00 -0.16 0.00 0.00 57.90 53.81 2wbd n TYR 167 Cb 0.52 -1.70 0.00 0.00 -0.31 0.00 0.00 39.34 37.84 2wbd n TYR 167 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wbd n GLY 168 N 2.65 2.46 0.51 2.72 0.00 -1.26 -3.82 105.19 108.44 2wbd n GLY 168 Ca 0.25 -1.84 0.34 0.00 0.00 0.00 0.00 46.02 44.77 2wbd n GLY 168 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2wbd h SER 169 N 0.00 0.16 -5.52 1.61 4.64 -1.99 -3.41 113.55 109.04 2wbd h SER 169 Ca 0.00 0.05 -0.21 0.00 -0.47 0.00 0.00 61.79 61.15 2wbd h SER 169 Cb 0.00 0.03 -0.15 0.00 -0.31 0.00 0.00 62.40 61.97 2wbd h SER 169 CO 0.00 -0.01 -0.61 0.00 -0.87 0.00 0.00 176.83 175.34 2wbd s ALA 170 N -5.14 1.01 -0.29 5.18 0.00 -1.26 -5.14 121.76 116.11 2wbd s ALA 170 Ca -0.06 -1.59 -0.11 0.00 0.00 0.00 0.00 51.96 50.20 2wbd s ALA 170 Cb 0.25 1.20 -0.04 0.00 0.00 0.00 0.00 23.12 24.54 2wbd s ALA 170 CO 0.82 -0.56 0.18 0.99 0.00 0.00 0.00 175.76 177.18 2wbd s THR 171 N -4.12 5.09 -0.07 0.00 2.01 -1.26 -4.41 115.64 112.89 2wbd s THR 171 Ca 0.33 -0.02 0.05 0.00 0.31 0.00 0.00 61.69 62.36 2wbd s THR 171 Cb 0.07 -3.48 -0.01 0.00 0.01 0.00 0.00 72.50 69.09 2wbd s THR 171 CO 0.08 0.19 -0.22 -0.32 -0.69 0.00 0.00 174.62 173.66 2wbd s MET 172 N 1.72 2.68 -0.21 4.92 -2.45 -0.63 0.24 119.30 125.57 2wbd s MET 172 Ca 0.06 -0.85 -0.12 0.00 -1.25 0.00 0.00 55.69 53.53 2wbd s MET 172 Cb -0.16 -2.26 -0.05 0.00 1.25 0.00 0.00 34.83 33.61 2wbd s MET 172 CO 0.09 0.38 0.24 -1.17 1.05 0.00 0.00 175.02 175.62 2wbd s LEU 173 N -0.15 4.17 -0.30 4.11 2.96 0.42 -1.49 118.68 128.39 2wbd s LEU 173 Ca -0.03 0.32 -0.06 0.00 -0.22 0.00 0.00 54.13 54.14 2wbd s LEU 173 Cb -0.14 -2.26 0.02 0.00 0.50 0.00 0.00 46.19 44.31 2wbd s LEU 173 CO 0.04 0.06 0.07 -0.69 -1.32 0.00 0.00 176.35 174.51 2wbd s VAL 174 N 0.87 3.78 -0.28 1.68 1.01 -0.12 1.00 120.40 128.34 2wbd s VAL 174 Ca 0.12 -0.88 -0.03 0.00 0.00 0.00 0.00 61.98 61.20 2wbd s VAL 174 Cb -0.13 -3.01 0.03 0.00 0.00 0.00 0.00 36.38 33.27 2wbd s VAL 174 CO 0.04 0.01 -0.01 -0.22 0.00 0.00 0.00 175.10 174.91 2wbd s LEU 175 N 1.45 3.57 -0.17 3.92 2.96 -0.24 -1.79 118.68 128.38 2wbd s LEU 175 Ca 0.01 -0.99 -0.07 0.00 -0.22 0.00 0.00 54.13 52.86 2wbd s LEU 175 Cb -0.18 -1.72 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 2wbd s LEU 175 CO 0.02 -0.19 0.07 0.00 -1.32 0.00 0.00 176.35 174.93 2wbd s ALA 176 N 1.33 3.47 0.00 5.97 0.00 0.16 -1.72 121.76 130.96 2wbd s ALA 176 Ca -0.01 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.21 2wbd s ALA 176 Cb -0.18 -1.89 0.00 0.00 0.00 0.00 0.00 23.12 21.05 2wbd s ALA 176 CO -0.02 0.28 0.00 -1.33 0.00 0.00 0.00 175.76 174.69 2wbd n MET 177 N 3.19 0.00 0.24 0.00 2.81 -0.67 -1.44 117.12 121.26 2wbd n MET 177 Ca -0.17 0.00 0.11 0.00 -1.81 0.00 0.00 57.70 55.83 2wbd n MET 177 Cb 0.53 0.00 0.60 0.00 -0.71 0.00 0.00 33.22 33.64 2wbd n MET 177 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 2wbd h ASP 178 N 0.00 0.00 -0.06 7.83 3.32 -1.96 -1.04 116.42 124.52 2wbd h ASP 178 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2wbd h ASP 178 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2wbd h ASP 178 CO 0.00 0.18 0.00 0.00 -1.72 0.00 0.00 179.24 177.70 2wbd n GLY 180 N 0.83 -0.94 3.44 0.00 0.00 -0.40 -4.89 105.19 103.24 2wbd n GLY 180 Ca 0.12 -1.85 -0.34 0.00 0.00 0.00 0.00 46.02 43.95 2wbd n GLY 180 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wbd s VAL 181 N 0.00 3.62 0.01 1.61 1.01 -1.26 -1.66 120.40 123.73 2wbd s VAL 181 Ca 0.00 -0.45 0.06 0.00 0.00 0.00 0.00 61.98 61.59 2wbd s VAL 181 Cb 0.00 -2.58 -0.02 0.00 0.00 0.00 0.00 36.38 33.78 2wbd s VAL 181 CO 0.00 0.49 -0.17 0.20 0.00 0.00 0.00 175.10 175.62 2wbd s ASN 182 N 0.52 2.03 -0.14 3.32 -0.87 -0.70 -0.43 114.94 118.67 2wbd s ASN 182 Ca -0.05 -0.39 -0.00 0.00 -1.57 0.00 0.00 52.86 50.85 2wbd s ASN 182 Cb -0.15 -0.19 -0.01 0.00 -0.02 0.00 0.00 41.25 40.88 2wbd s ASN 182 CO 0.03 0.16 -0.13 0.00 -2.57 0.00 0.00 177.10 174.60 2wbd s PHE 184 N 0.55 2.56 -0.23 0.00 0.40 0.28 -1.08 117.98 120.47 2wbd s PHE 184 Ca -0.08 -0.54 -0.08 0.00 -0.60 0.00 0.00 56.93 55.63 2wbd s PHE 184 Cb -0.16 -1.64 -0.04 0.00 0.51 0.00 0.00 43.02 41.70 2wbd s PHE 184 CO 0.04 -0.10 0.09 1.41 0.70 0.00 0.00 175.22 177.36 2wbd s MET 185 N -0.26 3.83 -0.13 0.44 1.75 0.16 0.16 119.30 125.25 2wbd s MET 185 Ca 0.00 -0.40 -0.29 0.00 -1.25 0.00 0.00 55.69 53.75 2wbd s MET 185 Cb -0.13 -3.34 -0.03 0.00 2.84 0.00 0.00 34.83 34.17 2wbd s MET 185 CO 0.03 -0.01 1.36 -1.17 -0.65 0.00 0.00 175.02 174.58 2wbd s LEU 186 N 1.16 4.22 -0.57 4.11 2.96 0.14 -0.36 118.68 130.34 2wbd s LEU 186 Ca 0.05 1.84 -0.18 0.00 -0.22 0.00 0.00 54.13 55.62 2wbd s LEU 186 Cb -0.14 -3.54 0.11 0.00 0.50 0.00 0.00 46.19 43.12 2wbd s LEU 186 CO 0.04 -0.79 0.65 -0.62 -1.32 0.00 0.00 176.35 174.30 2wbd s ASP 187 N 2.28 6.18 0.56 3.68 -1.08 0.13 -4.66 116.67 123.77 2wbd s ASP 187 Ca 0.60 -1.50 0.24 0.00 -0.52 0.00 0.00 52.55 51.37 2wbd s ASP 187 Cb -0.25 -2.28 1.55 0.00 -1.46 0.00 0.00 42.92 40.48 2wbd s ASP 187 CO 0.19 -1.04 2.15 1.55 0.52 0.00 0.00 175.17 178.54 2wbd h PRO 188 N 9.10 0.00 0.00 4.34 0.13 -1.94 0.23 132.00 143.86 2wbd h PRO 188 Ca -0.30 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.82 2wbd h PRO 188 Cb 1.09 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 2wbd h PRO 188 CO 1.08 0.00 -0.05 0.00 -0.23 0.00 0.00 178.00 178.80 2wbd h ALA 189 N 1.91 1.31 0.00 -0.56 0.00 -1.97 -3.31 119.26 116.64 2wbd h ALA 189 Ca 0.05 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2wbd h ALA 189 Cb 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2wbd h ALA 189 CO -0.00 0.06 0.00 0.44 0.00 0.00 0.00 179.25 179.75 2wbd n ILE 190 N -3.60 0.00 -2.90 0.00 -5.35 -0.89 -5.06 119.36 101.56 2wbd n ILE 190 Ca -0.02 -0.09 -0.09 0.00 -0.27 0.00 0.00 62.75 62.28 2wbd n ILE 190 Cb 0.16 1.10 0.03 0.00 -1.74 0.00 0.00 39.64 39.18 2wbd n ILE 190 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wbd n GLY 191 N 0.16 0.40 3.17 3.28 0.00 0.75 -5.05 105.19 107.90 2wbd n GLY 191 Ca 0.00 -0.33 -0.27 0.00 0.00 0.00 0.00 46.02 45.42 2wbd n GLY 191 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wbd s GLU 192 N -5.48 1.79 -0.19 1.61 0.41 -1.18 -4.95 118.70 110.70 2wbd s GLU 192 Ca 0.22 -0.66 -0.29 0.00 -0.41 0.00 0.00 54.97 53.82 2wbd s GLU 192 Cb -0.10 -1.60 0.00 0.00 -1.78 0.00 0.00 34.13 30.66 2wbd s GLU 192 CO 0.27 0.31 1.04 -0.06 -0.49 0.00 0.00 175.26 176.33 2wbd s PHE 193 N -0.14 3.38 -0.16 1.61 0.08 -1.26 -0.69 117.98 120.81 2wbd s PHE 193 Ca -0.00 1.50 -0.05 0.00 0.12 0.00 0.00 56.93 58.49 2wbd s PHE 193 Cb -0.10 -3.25 -0.03 0.00 -0.57 0.00 0.00 43.02 39.06 2wbd s PHE 193 CO 0.01 -0.43 0.02 0.42 -0.10 0.00 0.00 175.22 175.14 2wbd s ILE 194 N 2.80 4.42 -0.26 0.64 -1.09 0.51 -1.73 121.20 126.49 2wbd s ILE 194 Ca 0.46 -0.17 -0.29 0.00 -2.23 0.00 0.00 60.65 58.42 2wbd s ILE 194 Cb -0.16 -2.95 -0.02 0.00 -1.58 0.00 0.00 42.46 37.74 2wbd s ILE 194 CO 0.10 0.50 1.66 -0.22 -1.23 0.00 0.00 174.94 175.74 2wbd s LEU 195 N 0.16 3.78 -0.06 2.97 2.96 0.17 0.36 118.68 129.03 2wbd s LEU 195 Ca 0.02 1.51 0.05 0.00 -0.22 0.00 0.00 54.13 55.49 2wbd s LEU 195 Cb -0.13 -3.53 -0.07 0.00 0.50 0.00 0.00 46.19 42.96 2wbd s LEU 195 CO 0.01 -1.38 0.02 1.33 -1.32 0.00 0.00 176.35 175.02 2wbd n VAL 196 N 6.70 0.41 -3.91 1.68 0.24 -0.24 -4.76 118.33 118.45 2wbd n VAL 196 Ca 0.20 -0.25 -0.28 0.00 -2.04 0.00 0.00 64.34 61.96 2wbd n VAL 196 Cb 0.46 -0.84 -0.17 0.00 -1.47 0.00 0.00 33.84 31.82 2wbd n VAL 196 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2wbd s ASP 197 N -3.73 2.69 0.08 -1.34 1.01 -1.13 -5.02 116.67 109.24 2wbd s ASP 197 Ca -0.03 -0.58 -0.14 0.00 0.71 0.00 0.00 52.55 52.51 2wbd s ASP 197 Cb 0.02 -0.93 -0.06 0.00 1.01 0.00 0.00 42.92 42.96 2wbd s ASP 197 CO 0.24 -0.16 0.48 -0.54 0.21 0.00 0.00 175.17 175.40 2wbd s LYS 198 N 1.63 3.94 -1.13 8.23 1.02 -1.26 -1.14 119.74 131.03 2wbd s LYS 198 Ca 0.02 0.43 -0.30 0.00 0.02 0.00 0.00 55.97 56.14 2wbd s LYS 198 Cb -0.14 -3.07 0.04 0.00 -0.52 0.00 0.00 37.83 34.13 2wbd s LYS 198 CO -0.08 0.58 0.56 -3.47 -0.92 0.00 0.00 175.35 172.02 2wbd n ASP 199 N 1.24 -3.31 -4.77 2.83 2.03 0.04 -4.80 116.55 109.82 2wbd n ASP 199 Ca -0.09 -1.19 -0.39 0.00 0.52 0.00 0.00 54.79 53.63 2wbd n ASP 199 Cb 0.52 -1.43 -0.03 0.00 -0.72 0.00 0.00 41.12 39.45 2wbd n ASP 199 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2wbd s VAL 200 N -3.72 3.27 -0.03 5.18 -7.23 0.43 -4.83 120.40 113.47 2wbd s VAL 200 Ca 0.41 1.16 0.06 0.00 -1.81 0.00 0.00 61.98 61.80 2wbd s VAL 200 Cb -0.23 -3.69 -0.01 0.00 0.56 0.00 0.00 36.38 33.01 2wbd s VAL 200 CO 0.89 0.18 -0.20 -0.54 -0.31 0.00 0.00 175.10 175.13 2wbd s LYS 201 N -1.95 1.82 0.42 4.82 -0.14 -1.26 -4.46 119.74 118.99 2wbd s LYS 201 Ca 0.52 -0.72 -0.23 0.00 -1.36 0.00 0.00 55.97 54.18 2wbd s LYS 201 Cb -0.31 -1.66 -0.09 0.00 -1.68 0.00 0.00 37.83 34.08 2wbd s LYS 201 CO 0.40 0.37 1.03 -1.50 -0.76 0.00 0.00 175.35 174.89 2wbd s ILE 202 N -0.27 3.86 0.46 2.17 2.07 -0.10 -5.00 121.20 124.39 2wbd s ILE 202 Ca 0.02 1.31 -0.24 0.00 -1.41 0.00 0.00 60.65 60.33 2wbd s ILE 202 Cb -0.10 -3.62 -0.08 0.00 0.13 0.00 0.00 42.46 38.79 2wbd s ILE 202 CO 0.01 -0.10 1.30 0.29 -1.91 0.00 0.00 174.94 174.53 2wbd n LYS 203 N -0.37 1.89 -0.32 3.50 5.02 -1.26 -4.87 118.16 121.75 2wbd n LYS 203 Ca 0.06 0.68 0.01 0.00 -2.02 0.00 0.00 58.31 57.04 2wbd n LYS 203 Cb 0.51 -2.46 0.14 0.00 -0.02 0.00 0.00 35.03 33.20 2wbd n LYS 203 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 2wbd h LYS 204 N 1.92 0.98 -3.43 1.97 3.64 -1.95 -3.40 116.57 116.29 2wbd h LYS 204 Ca -0.49 -0.06 -0.24 0.00 -1.27 0.00 0.00 60.65 58.59 2wbd h LYS 204 Cb 1.29 -0.22 -0.30 0.00 -0.41 0.00 0.00 32.23 32.59 2wbd h LYS 204 CO 0.59 0.65 -0.64 0.21 -2.27 0.00 0.00 179.45 177.99 2wbd s LYS 205 N -6.06 0.06 0.04 1.90 2.20 -1.26 -2.10 119.74 114.52 2wbd s LYS 205 Ca -0.13 0.22 0.01 0.00 -0.36 0.00 0.00 55.97 55.71 2wbd s LYS 205 Cb 0.18 -0.10 0.01 0.00 -1.51 0.00 0.00 37.83 36.41 2wbd s LYS 205 CO 0.79 -0.10 0.05 0.41 -0.36 0.00 0.00 175.35 176.14 2wbd n GLY 206 N 3.69 2.40 0.26 5.54 0.00 -1.26 -4.77 105.19 111.06 2wbd n GLY 206 Ca -0.21 -2.16 0.02 0.00 0.00 0.00 0.00 46.02 43.67 2wbd n GLY 206 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wbd n LYS 207 N -0.89 0.45 -4.08 1.61 5.02 -1.26 -4.77 118.16 114.25 2wbd n LYS 207 Ca 0.01 -1.17 -0.19 0.00 -2.02 0.00 0.00 58.31 54.94 2wbd n LYS 207 Cb 0.05 -0.70 -0.16 0.00 -0.02 0.00 0.00 35.03 34.19 2wbd n LYS 207 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2wbd s ILE 208 N -0.55 0.39 0.12 -0.18 1.01 -1.26 -0.41 121.20 120.31 2wbd s ILE 208 Ca 0.05 -0.04 0.07 0.00 0.00 0.00 0.00 60.65 60.73 2wbd s ILE 208 Cb 0.05 -0.44 -0.04 0.00 0.01 0.00 0.00 42.46 42.04 2wbd s ILE 208 CO 0.00 0.19 -0.10 -0.72 0.00 0.00 0.00 174.94 174.32 2wbd s TYR 209 N 0.91 2.72 -0.08 3.97 1.13 -0.64 -1.93 117.35 123.44 2wbd s TYR 209 Ca -0.11 -0.17 -0.03 0.00 -1.41 0.00 0.00 57.07 55.36 2wbd s TYR 209 Cb -0.14 -1.41 0.04 0.00 -1.10 0.00 0.00 41.96 39.35 2wbd s TYR 209 CO -0.00 0.44 0.06 0.45 -2.51 0.00 0.00 175.55 173.99 2wbd s SER 210 N -2.33 1.56 -0.12 -0.18 0.15 -0.69 -2.82 113.70 109.28 2wbd s SER 210 Ca 0.22 -0.15 -0.33 0.00 0.70 0.00 0.00 55.95 56.39 2wbd s SER 210 Cb -0.11 -0.21 0.13 0.00 -1.71 0.00 0.00 66.02 64.13 2wbd s SER 210 CO 0.14 -0.27 1.27 -1.48 1.20 0.00 0.00 173.24 174.10 2wbd s LEU 211 N 2.14 -0.08 -1.01 3.45 2.34 -1.26 -1.41 118.68 122.85 2wbd s LEU 211 Ca 0.04 -0.06 -0.23 0.00 0.06 0.00 0.00 54.13 53.94 2wbd s LEU 211 Cb -0.13 1.33 0.03 0.00 -0.56 0.00 0.00 46.19 46.86 2wbd s LEU 211 CO -0.05 -0.23 1.55 0.21 -1.06 0.00 0.00 176.35 176.77 2wbd s ASN 212 N -2.56 6.26 0.00 1.48 3.84 -1.26 -4.83 114.94 117.87 2wbd s ASN 212 Ca 0.12 -1.35 0.16 0.00 0.21 0.00 0.00 52.86 52.00 2wbd s ASN 212 Cb 0.02 -2.57 0.84 0.00 -0.55 0.00 0.00 41.25 38.99 2wbd s ASN 212 CO -0.04 -1.73 1.42 -0.62 -2.79 0.00 0.00 177.10 173.34 2wbd n GLU 213 N 8.86 0.31 0.17 0.43 1.02 -1.26 -2.72 120.64 127.45 2wbd n GLU 213 Ca 0.35 0.10 0.05 0.00 -0.02 0.00 0.00 57.16 57.64 2wbd n GLU 213 Cb 0.50 -1.50 0.19 0.00 -0.02 0.00 0.00 31.44 30.61 2wbd n GLU 213 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 2wbd h GLY 214 N 2.55 0.00 -2.91 0.62 0.00 -2.06 -3.11 103.07 98.16 2wbd h GLY 214 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.15 2wbd h GLY 214 CO 0.00 0.00 0.23 -1.72 0.00 0.00 0.00 176.54 175.05 2wbd n TYR 215 N -3.30 1.58 -0.19 5.60 4.01 -1.10 -4.56 117.16 119.20 2wbd n TYR 215 Ca 0.01 -0.94 0.12 0.00 -0.16 0.00 0.00 57.90 56.93 2wbd n TYR 215 Cb 0.61 -0.53 0.44 0.00 -0.31 0.00 0.00 39.34 39.54 2wbd n TYR 215 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2wbd h ALA 216 N 2.13 1.94 0.00 -0.72 0.00 -1.77 -2.03 119.26 118.81 2wbd h ALA 216 Ca 0.22 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 2wbd h ALA 216 Cb 1.81 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.48 2wbd h ALA 216 CO 0.51 -0.12 -0.29 1.57 0.00 0.00 0.00 179.25 180.92 2wbd h LYS 217 N 0.56 0.00 -0.02 0.00 2.10 -1.90 -2.02 116.57 115.30 2wbd h LYS 217 Ca 0.37 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.02 2wbd h LYS 217 Cb 0.65 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.98 2wbd h LYS 217 CO -0.13 0.29 -0.12 -0.25 -2.00 0.00 0.00 179.45 177.24 2wbd n ASP 218 N -3.82 1.67 -4.55 7.07 8.00 -0.78 -5.01 116.55 119.12 2wbd n ASP 218 Ca -0.01 -1.42 -0.39 0.00 0.71 0.00 0.00 54.79 53.68 2wbd n ASP 218 Cb 0.38 0.08 0.04 0.00 -0.02 0.00 0.00 41.12 41.60 2wbd n ASP 218 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 2wbd n PHE 219 N 0.12 0.31 -2.14 1.24 3.72 -0.76 -4.39 117.46 115.56 2wbd n PHE 219 Ca 0.15 0.48 -0.41 0.00 -0.05 0.00 0.00 57.45 57.62 2wbd n PHE 219 Cb 0.40 -2.09 -0.03 0.00 -0.94 0.00 0.00 39.48 36.83 2wbd n PHE 219 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2wbd s ASP 220 N -1.09 6.81 0.56 4.37 3.68 -1.26 -4.86 116.67 124.88 2wbd s ASP 220 Ca 0.70 2.52 0.28 0.00 2.13 0.00 0.00 52.55 58.18 2wbd s ASP 220 Cb -0.47 -2.62 1.49 0.00 -1.45 0.00 0.00 42.92 39.87 2wbd s ASP 220 CO 0.52 -0.58 1.97 -0.65 0.13 0.00 0.00 175.17 176.57 2wbd h PRO 221 N 5.01 0.00 -0.25 4.34 0.11 -1.96 0.33 132.00 139.58 2wbd h PRO 221 Ca -0.46 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.51 2wbd h PRO 221 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2wbd h PRO 221 CO 0.76 0.00 -0.45 0.00 -0.21 0.00 0.00 178.00 178.10 2wbd h ALA 222 N 1.62 0.75 -0.13 -0.75 0.00 -1.91 -1.41 119.26 117.43 2wbd h ALA 222 Ca 0.22 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 2wbd h ALA 222 Cb 1.02 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 2wbd h ALA 222 CO -0.00 0.66 0.00 0.28 0.00 0.00 0.00 179.25 180.20 2wbd h VAL 223 N 0.51 1.25 -0.03 0.00 2.07 -0.74 -1.28 116.25 118.03 2wbd h VAL 223 Ca 0.03 -0.80 0.04 0.00 0.82 0.00 0.00 66.70 66.79 2wbd h VAL 223 Cb 0.98 1.52 -0.05 0.00 -1.52 0.00 0.00 31.29 32.22 2wbd h VAL 223 CO 0.09 0.23 -0.35 0.74 0.02 0.00 0.00 177.57 178.30 2wbd h THR 224 N -0.03 0.25 -0.36 2.57 2.02 -1.29 -1.05 112.91 115.02 2wbd h THR 224 Ca 0.04 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.21 2wbd h THR 224 Cb 0.35 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 66.99 2wbd h THR 224 CO 0.01 0.00 0.21 -0.08 0.37 0.00 0.00 175.52 176.02 2wbd h GLU 225 N -0.49 0.49 -0.60 6.66 4.81 -1.16 -2.23 114.58 122.06 2wbd h GLU 225 Ca 0.06 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 59.19 2wbd h GLU 225 Cb 0.59 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 2wbd h GLU 225 CO -0.30 0.39 0.15 -0.92 -0.73 0.00 0.00 179.01 177.59 2wbd h TYR 226 N 0.46 1.01 -0.46 0.92 3.20 -0.98 -2.16 116.97 118.96 2wbd h TYR 226 Ca 0.13 -0.12 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 2wbd h TYR 226 Cb 0.03 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 37.99 2wbd h TYR 226 CO -0.03 0.86 0.01 0.82 -1.64 0.00 0.00 178.16 178.18 2wbd h ILE 227 N 0.88 1.23 -0.45 1.81 1.08 -1.04 -2.52 117.51 118.50 2wbd h ILE 227 Ca 0.19 -0.95 0.02 0.00 -0.39 0.00 0.00 64.86 63.73 2wbd h ILE 227 Cb 0.35 0.87 -0.02 0.00 -3.07 0.00 0.00 36.82 34.94 2wbd h ILE 227 CO 0.00 0.34 0.30 -0.61 -0.69 0.00 0.00 178.15 177.49 2wbd h GLN 228 N 0.71 0.51 0.00 2.37 4.15 -0.77 -1.06 115.11 121.02 2wbd h GLN 228 Ca 0.14 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.53 2wbd h GLN 228 Cb 0.42 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.99 2wbd h GLN 228 CO 0.02 0.34 0.00 0.00 -1.93 0.00 0.00 178.83 177.25 2wbd h ARG 229 N 0.53 0.00 0.04 1.69 3.08 -1.12 0.58 114.38 119.17 2wbd h ARG 229 Ca 0.18 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.97 2wbd h ARG 229 Cb 0.07 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.09 2wbd h ARG 229 CO -0.04 0.00 -1.36 0.87 -1.07 0.00 0.00 179.97 178.36 2wbd h LYS 230 N 0.00 0.08 0.02 0.04 1.79 -1.12 -3.17 116.57 114.21 2wbd h LYS 230 Ca 0.00 -0.13 -0.37 0.00 -2.18 0.00 0.00 60.65 57.97 2wbd h LYS 230 Cb 0.60 0.05 -0.06 0.00 -1.58 0.00 0.00 32.23 31.24 2wbd h LYS 230 CO 0.00 0.89 -2.27 1.63 -1.08 0.00 0.00 179.45 178.62 2wbd n LYS 231 N -3.30 0.68 -3.23 3.15 5.02 -0.95 -0.53 118.16 119.00 2wbd n LYS 231 Ca -0.10 0.13 -0.26 0.00 -2.02 0.00 0.00 58.31 56.07 2wbd n LYS 231 Cb 1.00 -1.59 -0.06 0.00 -0.02 0.00 0.00 35.03 34.37 2wbd n LYS 231 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2wbd n PHE 232 N -3.09 2.83 -1.64 2.13 3.01 0.20 -4.72 117.46 116.19 2wbd n PHE 232 Ca -0.35 -3.99 -0.47 0.00 1.01 0.00 0.00 57.45 53.64 2wbd n PHE 232 Cb 1.07 -0.49 -0.04 0.00 -0.01 0.00 0.00 39.48 40.00 2wbd n PHE 232 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 2wbd n PRO 233 N 0.58 1.77 0.28 -1.08 -0.02 -1.20 -4.54 135.00 130.80 2wbd n PRO 233 Ca 0.28 0.64 0.18 0.00 -2.02 0.00 0.00 63.50 62.58 2wbd n PRO 233 Cb 0.45 -2.32 0.78 0.00 -0.02 0.00 0.00 33.50 32.39 2wbd n PRO 233 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2wbd h PRO 234 N 4.86 0.00 0.00 0.52 0.13 -1.93 -3.45 132.00 132.13 2wbd h PRO 234 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2wbd h PRO 234 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 2wbd h PRO 234 CO 0.81 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.18 2wbd n ASP 235 N -3.02 0.00 -0.54 1.44 5.68 -1.26 -5.02 116.55 113.83 2wbd n ASP 235 Ca -0.00 0.00 0.09 0.00 -0.50 0.00 0.00 54.79 54.38 2wbd n ASP 235 Cb 0.25 0.00 0.03 0.00 -1.14 0.00 0.00 41.12 40.26 2wbd n ASP 235 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2wbd n ASN 236 N 0.00 2.06 -4.78 -1.12 3.02 -1.26 -5.05 115.26 108.13 2wbd n ASN 236 Ca 0.00 -1.53 -0.31 0.00 -0.03 0.00 0.00 54.58 52.70 2wbd n ASN 236 Cb 0.00 0.25 0.07 0.00 -0.61 0.00 0.00 39.78 39.49 2wbd n ASN 236 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2wbd s SER 237 N -1.75 4.91 0.36 6.41 1.04 -1.26 -5.00 113.70 118.41 2wbd s SER 237 Ca 0.17 1.81 -0.27 0.00 0.48 0.00 0.00 55.95 58.14 2wbd s SER 237 Cb 0.14 -2.52 -0.09 0.00 0.10 0.00 0.00 66.02 63.65 2wbd s SER 237 CO 0.33 -1.76 1.20 0.00 0.98 0.00 0.00 173.24 173.99 2wbd s ALA 238 N -2.80 3.28 0.54 5.32 0.00 -1.26 -4.78 121.76 122.06 2wbd s ALA 238 Ca 0.62 1.04 -0.22 0.00 0.00 0.00 0.00 51.96 53.40 2wbd s ALA 238 Cb -0.17 -3.40 -0.05 0.00 0.00 0.00 0.00 23.12 19.50 2wbd s ALA 238 CO 0.52 -0.51 1.33 -2.14 0.00 0.00 0.00 175.76 174.96 2wbd s PRO 239 N -2.03 3.16 0.48 0.00 0.02 -1.26 -4.94 135.00 130.44 2wbd s PRO 239 Ca 0.53 2.18 -0.23 0.00 0.02 0.00 0.00 61.00 63.50 2wbd s PRO 239 Cb -0.33 -2.24 -0.07 0.00 0.02 0.00 0.00 34.50 31.88 2wbd s PRO 239 CO 0.43 -1.15 1.25 0.71 -0.33 0.00 0.00 177.00 177.91 2wbd s TYR 240 N -1.34 2.65 0.58 6.54 1.51 0.31 -5.01 117.35 122.59 2wbd s TYR 240 Ca 0.71 1.46 -0.16 0.00 -1.01 0.00 0.00 57.07 58.08 2wbd s TYR 240 Cb -0.39 -3.57 -0.05 0.00 -0.11 0.00 0.00 41.96 37.84 2wbd s TYR 240 CO 0.46 -2.10 1.04 0.20 -1.11 0.00 0.00 175.55 174.04 2wbd s GLY 241 N -1.13 2.08 0.01 0.71 0.00 0.45 -4.79 107.32 104.65 2wbd s GLY 241 Ca 0.66 0.31 0.01 0.00 0.00 0.00 0.00 44.72 45.70 2wbd s GLY 241 CO 0.41 0.62 0.05 0.00 0.00 0.00 0.00 173.10 174.18 2wbd s ALA 242 N -2.54 3.46 -0.23 3.20 0.00 -1.26 -1.61 121.76 122.78 2wbd s ALA 242 Ca 0.62 -0.93 -0.10 0.00 0.00 0.00 0.00 51.96 51.55 2wbd s ALA 242 Cb -0.14 -1.46 0.09 0.00 0.00 0.00 0.00 23.12 21.61 2wbd s ALA 242 CO 0.37 0.69 0.53 1.03 0.00 0.00 0.00 175.76 178.37 2wbd s ARG 243 N -1.80 0.48 -0.32 0.00 1.81 -1.13 -4.97 118.95 113.02 2wbd s ARG 243 Ca 0.23 1.11 0.00 0.00 -1.72 0.00 0.00 55.73 55.35 2wbd s ARG 243 Cb -0.12 0.32 0.14 0.00 -0.45 0.00 0.00 34.95 34.84 2wbd s ARG 243 CO 0.14 -0.19 0.30 -0.47 -0.68 0.00 0.00 175.30 174.40 2wbd s TYR 244 N 2.16 -0.28 0.09 -0.53 5.04 -1.26 -4.13 117.35 118.44 2wbd s TYR 244 Ca -0.06 -0.51 -0.17 0.00 -2.44 0.00 0.00 57.07 53.89 2wbd s TYR 244 Cb -0.10 -0.51 -0.07 0.00 0.35 0.00 0.00 41.96 41.63 2wbd s TYR 244 CO -0.16 -0.92 1.49 0.28 -1.34 0.00 0.00 175.55 174.90 2wbd h VAL 245 N 5.85 1.28 0.00 3.14 2.07 -1.97 -3.48 116.25 123.15 2wbd h VAL 245 Ca -0.07 -1.11 0.00 0.00 0.82 0.00 0.00 66.70 66.34 2wbd h VAL 245 Cb 1.06 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 32.23 2wbd h VAL 245 CO 0.30 0.35 0.00 0.61 0.02 0.00 0.00 177.57 178.86 2wbd n GLY 246 N -0.16 0.83 2.64 2.17 0.00 -1.26 -5.04 105.19 104.37 2wbd n GLY 246 Ca -0.03 -0.46 -0.27 0.00 0.00 0.00 0.00 46.02 45.26 2wbd n GLY 246 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2wbd s SER 247 N -2.43 2.69 0.24 1.61 0.15 -1.26 -4.91 113.70 109.79 2wbd s SER 247 Ca 0.00 -0.78 -0.06 0.00 0.70 0.00 0.00 55.95 55.81 2wbd s SER 247 Cb 0.00 -0.37 0.42 0.00 -1.71 0.00 0.00 66.02 64.35 2wbd s SER 247 CO 0.00 -0.35 1.69 -0.03 1.20 0.00 0.00 173.24 175.75 2wbd h MET 248 N 8.36 0.28 -1.01 5.44 4.05 -1.93 -1.65 114.93 128.47 2wbd h MET 248 Ca -0.16 -0.02 0.05 0.00 -0.28 0.00 0.00 59.70 59.29 2wbd h MET 248 Cb 1.12 -0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 31.80 2wbd h MET 248 CO 0.33 0.18 0.66 0.28 0.23 0.00 0.00 176.91 178.59 2wbd h VAL 249 N 0.28 1.14 -0.16 -5.77 2.07 -1.95 0.11 116.25 111.97 2wbd h VAL 249 Ca 0.39 -0.43 -0.14 0.00 0.82 0.00 0.00 66.70 67.34 2wbd h VAL 249 Cb 0.64 -0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 2wbd h VAL 249 CO -0.47 0.23 -0.46 0.00 0.02 0.00 0.00 177.57 176.89 2wbd h ALA 250 N 1.43 0.27 -0.06 1.67 0.00 -1.66 -1.28 119.26 119.63 2wbd h ALA 250 Ca 0.42 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2wbd h ALA 250 Cb 0.07 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2wbd h ALA 250 CO -0.15 0.42 0.00 -0.44 0.00 0.00 0.00 179.25 179.08 2wbd h ASP 251 N 0.24 0.09 -0.73 0.00 3.32 -1.17 -0.87 116.42 117.31 2wbd h ASP 251 Ca -0.01 -0.30 0.03 0.00 0.02 0.00 0.00 57.03 56.77 2wbd h ASP 251 Cb 1.08 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.56 2wbd h ASP 251 CO 0.10 0.37 0.46 0.58 -1.72 0.00 0.00 179.24 179.03 2wbd h VAL 252 N -0.18 1.11 -0.35 -1.35 2.07 -0.88 0.11 116.25 116.78 2wbd h VAL 252 Ca 0.02 -0.31 -0.07 0.00 0.82 0.00 0.00 66.70 67.16 2wbd h VAL 252 Cb 0.32 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 2wbd h VAL 252 CO 0.00 0.17 -0.05 -0.74 0.02 0.00 0.00 177.57 176.97 2wbd h HIS 253 N 0.91 0.72 -0.82 1.57 -0.00 -1.11 0.54 115.15 116.95 2wbd h HIS 253 Ca 0.29 -0.14 0.04 0.00 -0.00 0.00 0.00 60.37 60.55 2wbd h HIS 253 Cb 0.00 -0.18 -0.05 0.00 -0.00 0.00 0.00 27.41 27.19 2wbd h HIS 253 CO -0.04 0.79 0.54 -0.09 -0.00 0.00 0.00 177.93 179.13 2wbd h ARG 254 N 0.44 0.98 -0.71 5.26 2.43 -0.95 -1.52 114.38 120.32 2wbd h ARG 254 Ca 0.09 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 2wbd h ARG 254 Cb 0.54 -0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 29.83 2wbd h ARG 254 CO 0.03 0.65 0.41 1.15 -1.51 0.00 0.00 179.97 180.70 2wbd h THR 255 N 1.01 1.20 -0.01 0.20 2.02 0.10 -1.10 112.91 116.34 2wbd h THR 255 Ca 0.33 -0.48 -0.00 0.00 0.77 0.00 0.00 66.41 67.03 2wbd h THR 255 Cb 0.04 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 66.67 2wbd h THR 255 CO -0.10 0.22 -0.01 0.25 0.37 0.00 0.00 175.52 176.25 2wbd h LEU 256 N 0.98 0.02 -0.30 2.58 5.85 -0.06 -0.02 115.31 124.37 2wbd h LEU 256 Ca 0.25 -0.59 -0.09 0.00 0.84 0.00 0.00 57.88 58.30 2wbd h LEU 256 Cb -0.01 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 2wbd h LEU 256 CO -0.05 0.61 -0.15 0.58 -0.34 0.00 0.00 178.44 179.10 2wbd h VAL 257 N -0.56 1.29 -0.01 1.05 2.07 -1.27 -3.36 116.25 115.46 2wbd h VAL 257 Ca -0.00 -1.25 0.00 0.00 0.82 0.00 0.00 66.70 66.27 2wbd h VAL 257 Cb 0.61 1.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 2wbd h VAL 257 CO 0.00 0.40 -0.07 -1.22 0.02 0.00 0.00 177.57 176.71 2wbd n TYR 258 N -4.39 0.00 -0.18 1.57 4.01 -0.42 -4.88 117.16 112.87 2wbd n TYR 258 Ca -0.03 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.73 2wbd n TYR 258 Cb 0.38 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.40 2wbd n TYR 258 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wbd n GLY 259 N 0.81 -1.82 0.00 2.72 0.00 -0.02 -4.67 105.19 102.22 2wbd n GLY 259 Ca 0.07 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.63 2wbd n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wbd n GLY 260 N -2.31 0.17 3.05 -0.02 0.00 -1.26 -4.54 105.19 100.28 2wbd n GLY 260 Ca -0.00 -1.92 -0.13 0.00 0.00 0.00 0.00 46.02 43.98 2wbd n GLY 260 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2wbd s ILE 261 N 0.00 -0.04 -0.10 -0.61 2.07 -0.81 -0.86 121.20 120.85 2wbd s ILE 261 Ca 0.00 0.13 -0.00 0.00 -1.41 0.00 0.00 60.65 59.37 2wbd s ILE 261 Cb 0.00 -0.36 -0.03 0.00 0.13 0.00 0.00 42.46 42.21 2wbd s ILE 261 CO 0.00 0.05 -0.08 0.12 -1.91 0.00 0.00 174.94 173.12 2wbd s PHE 262 N 1.10 2.91 -0.08 3.50 5.36 0.75 -1.70 117.98 129.82 2wbd s PHE 262 Ca -0.08 -0.20 -0.00 0.00 -0.96 0.00 0.00 56.93 55.69 2wbd s PHE 262 Cb -0.09 -1.79 0.02 0.00 -0.34 0.00 0.00 43.02 40.82 2wbd s PHE 262 CO -0.07 0.13 -0.06 -0.51 -1.46 0.00 0.00 175.22 173.25 2wbd s LEU 263 N -0.30 1.12 -0.57 6.12 1.02 -0.50 -0.73 118.68 124.83 2wbd s LEU 263 Ca 0.04 -0.21 0.04 0.00 0.02 0.00 0.00 54.13 54.02 2wbd s LEU 263 Cb -0.13 -0.66 0.15 0.00 0.02 0.00 0.00 46.19 45.57 2wbd s LEU 263 CO 0.02 -0.11 0.35 -0.47 0.02 0.00 0.00 176.35 176.17 2wbd s TYR 264 N 1.49 3.00 0.72 0.29 6.14 0.01 -4.46 117.35 124.55 2wbd s TYR 264 Ca -0.01 -3.06 -0.07 0.00 0.64 0.00 0.00 57.07 54.57 2wbd s TYR 264 Cb -0.13 -2.51 0.16 0.00 0.42 0.00 0.00 41.96 39.90 2wbd s TYR 264 CO -0.04 -0.68 0.99 -0.35 0.64 0.00 0.00 175.55 176.11 2wbd n PRO 265 N 2.73 -0.53 -2.97 4.97 -0.04 -1.26 -1.59 135.00 136.32 2wbd n PRO 265 Ca 0.13 -2.06 -0.24 0.00 -0.04 0.00 0.00 63.50 61.29 2wbd n PRO 265 Cb 0.34 -0.85 0.01 0.00 -0.04 0.00 0.00 33.50 32.96 2wbd n PRO 265 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wbd s ALA 266 N -3.52 3.67 0.17 0.55 0.00 -1.26 -4.40 121.76 116.96 2wbd s ALA 266 Ca 0.60 -0.94 0.01 0.00 0.00 0.00 0.00 51.96 51.63 2wbd s ALA 266 Cb -0.02 -2.22 -0.00 0.00 0.00 0.00 0.00 23.12 20.87 2wbd s ALA 266 CO 0.41 -0.35 0.20 0.27 0.00 0.00 0.00 175.76 176.30 2wbd n ASN 267 N -2.09 -0.55 -0.12 0.00 0.23 -0.98 -4.24 115.26 107.51 2wbd n ASN 267 Ca 0.00 -1.97 -0.01 0.00 -0.53 0.00 0.00 54.58 52.07 2wbd n ASN 267 Cb 0.57 1.09 0.25 0.00 -2.08 0.00 0.00 39.78 39.61 2wbd n ASN 267 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 2wbd h LYS 268 N 0.00 0.79 0.00 -3.83 1.57 -1.89 -2.18 116.57 111.03 2wbd h LYS 268 Ca -0.13 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.54 2wbd h LYS 268 Cb 0.58 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.75 2wbd h LYS 268 CO 0.17 0.65 -0.15 1.63 -0.57 0.00 0.00 179.45 181.19 2wbd n LYS 269 N -4.33 0.27 -3.07 3.15 5.02 -1.26 -4.39 118.16 113.54 2wbd n LYS 269 Ca 0.04 0.18 -0.20 0.00 -2.02 0.00 0.00 58.31 56.32 2wbd n LYS 269 Cb 0.16 -1.77 -0.04 0.00 -0.02 0.00 0.00 35.03 33.36 2wbd n LYS 269 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2wbd n SER 270 N -2.22 -0.63 0.00 4.39 7.64 -0.97 -5.01 113.62 116.82 2wbd n SER 270 Ca 0.05 -2.86 0.02 0.00 1.01 0.00 0.00 58.87 57.09 2wbd n SER 270 Cb 0.43 0.02 0.10 0.00 -1.01 0.00 0.00 64.21 63.75 2wbd n SER 270 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2wbd n PRO 271 N 1.44 0.03 -0.09 1.43 -0.04 -0.86 -0.52 135.00 136.39 2wbd n PRO 271 Ca 0.18 0.34 0.06 0.00 -0.04 0.00 0.00 63.50 64.04 2wbd n PRO 271 Cb 0.56 -1.50 0.08 0.00 -0.04 0.00 0.00 33.50 32.60 2wbd n PRO 271 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2wbd n ASN 272 N -1.40 1.92 0.00 3.54 4.13 -1.26 -4.80 115.26 117.40 2wbd n ASN 272 Ca 0.02 -2.62 0.00 0.00 1.68 0.00 0.00 54.58 53.66 2wbd n ASN 272 Cb 0.04 -0.28 0.00 0.00 -1.54 0.00 0.00 39.78 38.00 2wbd n ASN 272 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2wbd n GLY 273 N -1.00 -0.32 0.00 7.41 0.00 0.32 -1.71 105.19 109.90 2wbd n GLY 273 Ca 0.10 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 45.05 2wbd n GLY 273 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2wbd n LYS 274 N 0.00 0.19 -2.18 1.61 4.76 -1.26 -4.79 118.16 116.49 2wbd n LYS 274 Ca 0.00 0.00 -0.36 0.00 -2.87 0.00 0.00 58.31 55.08 2wbd n LYS 274 Cb 0.00 -0.84 0.01 0.00 -1.84 0.00 0.00 35.03 32.36 2wbd n LYS 274 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2wbd s LEU 275 N -4.26 3.79 -0.18 -0.35 1.43 -1.26 -4.81 118.68 113.03 2wbd s LEU 275 Ca 0.00 2.28 -0.15 0.00 -1.03 0.00 0.00 54.13 55.23 2wbd s LEU 275 Cb 0.00 -4.50 -0.04 0.00 0.03 0.00 0.00 46.19 41.67 2wbd s LEU 275 CO 0.00 -1.26 0.36 -0.13 0.23 0.00 0.00 176.35 175.55 2wbd s ARG 276 N -3.16 4.21 0.18 1.70 1.81 -1.26 -1.02 118.95 121.41 2wbd s ARG 276 Ca 0.72 0.17 -0.13 0.00 -1.72 0.00 0.00 55.73 54.77 2wbd s ARG 276 Cb -0.27 -3.49 0.12 0.00 -0.45 0.00 0.00 34.95 30.86 2wbd s ARG 276 CO 0.31 0.07 1.80 1.25 -0.68 0.00 0.00 175.30 178.05 2wbd h LEU 277 N 7.23 0.41 -0.24 2.53 5.85 -1.07 -0.50 115.31 129.53 2wbd h LEU 277 Ca -0.38 0.02 -0.19 0.00 0.84 0.00 0.00 57.88 58.17 2wbd h LEU 277 Cb 1.16 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.14 2wbd h LEU 277 CO 0.73 0.29 -0.58 -0.07 -0.34 0.00 0.00 178.44 178.47 2wbd h LEU 278 N 0.54 0.92 -1.26 2.25 4.07 -1.80 -0.53 115.31 119.50 2wbd h LEU 278 Ca 0.22 -0.56 0.00 0.00 0.08 0.00 0.00 57.88 57.61 2wbd h LEU 278 Cb 0.09 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 41.57 2wbd h LEU 278 CO -0.13 1.32 0.00 0.00 -1.08 0.00 0.00 178.44 178.54 2wbd n TYR 279 N -4.04 0.00 0.02 1.13 0.18 -1.23 -4.46 117.16 108.76 2wbd n TYR 279 Ca -0.06 -0.10 -0.00 0.00 1.88 0.00 0.00 57.90 59.63 2wbd n TYR 279 Cb 0.64 -0.01 -0.00 0.00 -0.38 0.00 0.00 39.34 39.59 2wbd n TYR 279 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 2wbd n GLU 280 N -0.10 0.02 -0.18 -3.48 1.02 -0.28 -4.09 120.64 113.55 2wbd n GLU 280 Ca 0.00 0.01 -0.09 0.00 -0.02 0.00 0.00 57.16 57.06 2wbd n GLU 280 Cb 0.10 -0.26 0.01 0.00 -0.02 0.00 0.00 31.44 31.26 2wbd n GLU 280 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2wbd h ASN 282 N 0.70 -0.10 -0.05 0.00 -0.26 -1.33 0.19 115.58 114.73 2wbd h ASN 282 Ca 0.16 -0.35 -0.02 0.00 -0.56 0.00 0.00 56.30 55.53 2wbd h ASN 282 Cb 0.33 0.03 -0.01 0.00 -1.06 0.00 0.00 38.32 37.60 2wbd h ASN 282 CO 0.00 0.31 -0.02 -0.65 -1.06 0.00 0.00 177.43 176.01 2wbd h PRO 283 N -0.52 0.19 -0.11 0.81 0.11 -1.78 -0.04 132.00 130.66 2wbd h PRO 283 Ca -0.01 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.03 2wbd h PRO 283 Cb 0.44 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.51 2wbd h PRO 283 CO 0.02 0.23 -0.10 0.52 -0.21 0.00 0.00 178.00 178.46 2wbd h MET 284 N 0.19 0.25 -0.97 1.05 2.86 -1.41 -2.10 114.93 114.80 2wbd h MET 284 Ca 0.05 -0.13 0.13 0.00 -2.06 0.00 0.00 59.70 57.69 2wbd h MET 284 Cb 0.17 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 31.75 2wbd h MET 284 CO 0.00 0.66 0.61 0.00 1.06 0.00 0.00 176.91 179.25 2wbd h ALA 285 N 0.59 1.62 0.12 6.32 0.00 -0.34 -0.09 119.26 127.47 2wbd h ALA 285 Ca 0.02 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2wbd h ALA 285 Cb 0.61 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2wbd h ALA 285 CO 0.02 0.13 -0.06 -0.92 0.00 0.00 0.00 179.25 178.42 2wbd h TYR 286 N 0.89 -0.15 -0.24 0.00 5.03 -0.86 -1.33 116.97 120.32 2wbd h TYR 286 Ca 0.49 -0.00 0.05 0.00 2.58 0.00 0.00 58.73 61.84 2wbd h TYR 286 Cb 0.58 0.05 -0.05 0.00 1.55 0.00 0.00 36.73 38.86 2wbd h TYR 286 CO -0.00 0.08 -0.08 0.28 -1.32 0.00 0.00 178.16 177.12 2wbd h VAL 287 N -0.36 0.71 -0.12 1.81 2.07 -0.99 -1.56 116.25 117.82 2wbd h VAL 287 Ca -0.02 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.55 2wbd h VAL 287 Cb 0.30 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 2wbd h VAL 287 CO 0.03 0.00 -0.26 0.24 0.02 0.00 0.00 177.57 177.59 2wbd h MET 288 N -0.03 -0.33 0.00 1.57 2.86 -0.97 -1.07 114.93 116.96 2wbd h MET 288 Ca 0.12 0.02 -0.07 0.00 -2.06 0.00 0.00 59.70 57.71 2wbd h MET 288 Cb 0.22 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 2wbd h MET 288 CO -0.26 -0.22 -0.34 0.93 1.06 0.00 0.00 176.91 178.08 2wbd h GLU 289 N -0.34 0.00 0.00 1.72 5.08 -1.06 0.96 114.58 120.94 2wbd h GLU 289 Ca 0.10 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.35 2wbd h GLU 289 Cb 0.48 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 2wbd h GLU 289 CO -0.31 0.34 -0.49 0.87 -1.00 0.00 0.00 179.01 178.42 2wbd h LYS 290 N 0.00 0.00 -0.00 2.33 1.79 -0.98 -2.95 116.57 116.76 2wbd h LYS 290 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2wbd h LYS 290 Cb 0.63 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.28 2wbd h LYS 290 CO 0.04 0.49 -0.30 0.00 -1.08 0.00 0.00 179.45 178.61 2wbd n ALA 291 N -2.34 3.12 -0.13 3.86 0.00 -0.43 -4.51 120.51 120.08 2wbd n ALA 291 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.12 2wbd n ALA 291 Cb 0.58 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.81 2wbd n ALA 291 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2wbd n GLY 292 N 1.42 0.93 0.00 0.00 0.00 -0.70 -0.92 105.19 105.91 2wbd n GLY 292 Ca 0.09 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2wbd n GLY 292 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wbd n GLY 293 N -2.13 1.01 3.09 -0.02 0.00 0.32 -4.51 105.19 102.95 2wbd n GLY 293 Ca 0.00 -1.98 -0.11 0.00 0.00 0.00 0.00 46.02 43.93 2wbd n GLY 293 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2wbd s MET 294 N -1.68 0.62 -0.24 1.61 1.00 0.27 -4.03 119.30 116.84 2wbd s MET 294 Ca 0.00 -0.99 -0.03 0.00 0.00 0.00 0.00 55.69 54.68 2wbd s MET 294 Cb 0.00 -0.16 0.13 0.00 0.00 0.00 0.00 34.83 34.80 2wbd s MET 294 CO 0.00 -0.00 0.36 0.00 0.00 0.00 0.00 175.02 175.38 2wbd s ALA 295 N -2.42 -1.00 0.18 3.03 0.00 -1.26 -1.59 121.76 118.71 2wbd s ALA 295 Ca -0.01 0.83 0.09 0.00 0.00 0.00 0.00 51.96 52.86 2wbd s ALA 295 Cb -0.03 -1.64 -0.04 0.00 0.00 0.00 0.00 23.12 21.41 2wbd s ALA 295 CO -0.03 -1.26 -0.18 -0.08 0.00 0.00 0.00 175.76 174.21 2wbd s THR 296 N 2.52 1.91 -1.59 0.00 -1.32 0.37 -1.18 115.64 116.35 2wbd s THR 296 Ca 0.12 -2.02 0.23 0.00 -1.21 0.00 0.00 61.69 58.81 2wbd s THR 296 Cb -0.15 -1.94 -0.03 0.00 -1.51 0.00 0.00 72.50 68.86 2wbd s THR 296 CO -0.15 -0.36 1.14 0.35 -2.21 0.00 0.00 174.62 173.39 2wbd n THR 297 N 0.09 0.00 0.00 5.08 -2.24 0.49 0.14 114.28 117.84 2wbd n THR 297 Ca -0.11 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 2wbd n THR 297 Cb 0.58 0.95 0.00 0.00 -2.10 0.00 0.00 70.33 69.76 2wbd n THR 297 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wbd n GLY 298 N 1.44 2.99 0.07 3.38 0.00 -1.26 -4.76 105.19 107.04 2wbd n GLY 298 Ca 0.08 -0.80 -0.08 0.00 0.00 0.00 0.00 46.02 45.22 2wbd n GLY 298 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wbd h LYS 299 N 0.00 0.01 -2.79 1.61 1.57 -1.99 -3.49 116.57 111.49 2wbd h LYS 299 Ca 0.00 -0.02 0.09 0.00 -1.87 0.00 0.00 60.65 58.85 2wbd h LYS 299 Cb 0.00 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.27 2wbd h LYS 299 CO 0.00 0.82 0.34 -1.83 -0.57 0.00 0.00 179.45 178.21 2wbd s GLU 300 N -2.67 1.69 0.27 3.15 -1.05 -1.26 -5.13 118.70 113.70 2wbd s GLU 300 Ca -0.01 -0.99 -0.30 0.00 -0.15 0.00 0.00 54.97 53.52 2wbd s GLU 300 Cb 0.09 0.54 -0.11 0.00 -0.44 0.00 0.00 34.13 34.21 2wbd s GLU 300 CO 0.82 -0.78 1.55 0.00 0.95 0.00 0.00 175.26 177.80 2wbd s ALA 301 N -3.27 3.71 0.26 -0.84 0.00 -1.26 -0.38 121.76 119.98 2wbd s ALA 301 Ca 0.13 1.49 -0.01 0.00 0.00 0.00 0.00 51.96 53.57 2wbd s ALA 301 Cb -0.04 -3.62 0.52 0.00 0.00 0.00 0.00 23.12 19.97 2wbd s ALA 301 CO 0.07 -0.90 1.77 0.28 0.00 0.00 0.00 175.76 176.98 2wbd h VAL 302 N 3.47 0.76 0.00 0.00 2.07 -1.44 -1.83 116.25 119.28 2wbd h VAL 302 Ca -0.46 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 2wbd h VAL 302 Cb 1.22 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 31.03 2wbd h VAL 302 CO 0.80 0.12 -0.01 -0.07 0.02 0.00 0.00 177.57 178.43 2wbd h LEU 303 N 0.66 0.00 0.00 2.57 3.38 -1.91 -2.90 115.31 117.11 2wbd h LEU 303 Ca 0.46 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.42 2wbd h LEU 303 Cb 0.61 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.36 2wbd h LEU 303 CO -0.34 0.01 -0.75 0.44 0.09 0.00 0.00 178.44 177.89 2wbd h ASP 304 N 0.00 0.00 -2.17 -0.43 3.32 -1.71 -1.51 116.42 113.92 2wbd h ASP 304 Ca -0.00 0.00 -0.60 0.00 0.02 0.00 0.00 57.03 56.45 2wbd h ASP 304 Cb 0.04 0.00 0.05 0.00 0.22 0.00 0.00 39.33 39.64 2wbd h ASP 304 CO 0.00 0.01 0.81 0.52 -1.72 0.00 0.00 179.24 178.86 2wbd n VAL 305 N -2.79 0.10 -3.02 -1.35 0.31 -1.10 -4.91 118.33 105.57 2wbd n VAL 305 Ca 0.01 -0.02 -0.41 0.00 -0.01 0.00 0.00 64.34 63.91 2wbd n VAL 305 Cb 0.55 -1.52 -0.05 0.00 -0.91 0.00 0.00 33.84 31.91 2wbd n VAL 305 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2wbd s ILE 306 N 1.40 4.92 0.19 2.52 -1.09 -1.26 -4.31 121.20 123.56 2wbd s ILE 306 Ca 0.82 1.32 -0.27 0.00 -2.23 0.00 0.00 60.65 60.29 2wbd s ILE 306 Cb -0.71 -4.01 -0.08 0.00 -1.58 0.00 0.00 42.46 36.07 2wbd s ILE 306 CO 0.41 -0.01 0.83 -2.16 -1.23 0.00 0.00 174.94 172.78 2wbd s PRO 307 N 2.64 4.66 -0.02 2.79 0.04 -1.26 -4.97 135.00 138.87 2wbd s PRO 307 Ca 0.30 1.26 0.14 0.00 0.04 0.00 0.00 61.00 62.75 2wbd s PRO 307 Cb -0.15 -3.27 -0.22 0.00 0.04 0.00 0.00 34.50 30.90 2wbd s PRO 307 CO 0.08 0.54 0.32 0.25 0.04 0.00 0.00 177.00 178.23 2wbd n THR 308 N 1.60 0.00 -4.27 1.26 -2.24 -1.26 -4.80 114.28 104.58 2wbd n THR 308 Ca -0.04 -0.32 -0.22 0.00 -2.27 0.00 0.00 64.05 61.20 2wbd n THR 308 Cb 0.48 0.20 -0.12 0.00 -2.10 0.00 0.00 70.33 68.79 2wbd n THR 308 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2wbd s ASP 309 N -3.60 2.20 0.42 3.42 -1.08 -1.26 -5.06 116.67 111.71 2wbd s ASP 309 Ca -0.05 -0.64 0.23 0.00 -0.52 0.00 0.00 52.55 51.57 2wbd s ASP 309 Cb 0.09 -0.11 0.80 0.00 -1.46 0.00 0.00 42.92 42.24 2wbd s ASP 309 CO 0.59 0.02 1.77 0.16 0.52 0.00 0.00 175.17 178.23 2wbd h ILE 310 N 4.18 0.58 -0.38 4.11 3.07 -1.95 -2.93 117.51 124.20 2wbd h ILE 310 Ca -0.44 -1.25 -0.01 0.00 1.55 0.00 0.00 64.86 64.71 2wbd h ILE 310 Cb 1.18 1.85 -0.01 0.00 -0.27 0.00 0.00 36.82 39.58 2wbd h ILE 310 CO 0.40 0.25 0.01 1.41 -1.05 0.00 0.00 178.15 179.17 2wbd n HIS 311 N -3.37 1.36 -2.33 0.16 8.25 -1.26 -4.55 115.22 113.48 2wbd n HIS 311 Ca 0.00 -0.86 -0.36 0.00 -0.26 0.00 0.00 57.72 56.25 2wbd n HIS 311 Cb 0.47 -0.40 -0.01 0.00 1.12 0.00 0.00 29.99 31.17 2wbd n HIS 311 CO 0.00 0.00 0.00 1.14 0.64 0.00 0.00 176.34 178.12 2wbd s GLN 312 N -2.83 3.65 0.08 -0.41 -2.07 -1.11 -4.82 119.66 112.15 2wbd s GLN 312 Ca 0.47 1.62 -0.02 0.00 -1.82 0.00 0.00 55.36 55.61 2wbd s GLN 312 Cb 0.37 -2.21 -0.04 0.00 -1.09 0.00 0.00 33.01 30.03 2wbd s GLN 312 CO 0.11 -0.61 0.25 1.03 -1.32 0.00 0.00 175.29 174.76 2wbd s ARG 313 N -2.99 3.49 -0.00 9.60 0.52 -1.26 -0.47 118.95 127.84 2wbd s ARG 313 Ca 0.67 -0.33 0.01 0.00 -0.52 0.00 0.00 55.73 55.56 2wbd s ARG 313 Cb -0.24 -2.99 -0.00 0.00 0.52 0.00 0.00 34.95 32.23 2wbd s ARG 313 CO 0.29 0.58 -0.03 0.00 0.02 0.00 0.00 175.30 176.15 2wbd s ALA 314 N -1.53 0.24 0.68 2.13 0.00 -0.19 -4.77 121.76 118.32 2wbd s ALA 314 Ca 0.36 -0.15 -0.17 0.00 0.00 0.00 0.00 51.96 52.00 2wbd s ALA 314 Cb -0.13 -0.05 0.01 0.00 0.00 0.00 0.00 23.12 22.95 2wbd s ALA 314 CO 0.26 0.05 1.23 -2.30 0.00 0.00 0.00 175.76 175.01 2wbd n PRO 315 N 2.93 0.89 -3.74 0.00 -0.02 -0.83 -4.15 135.00 130.08 2wbd n PRO 315 Ca -0.13 0.36 -0.13 0.00 -2.02 0.00 0.00 63.50 61.58 2wbd n PRO 315 Cb 0.59 -2.47 -0.13 0.00 -0.02 0.00 0.00 33.50 31.46 2wbd n PRO 315 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2wbd s VAL 316 N -1.56 -0.04 -0.09 -1.45 0.11 -0.62 -4.33 120.40 112.42 2wbd s VAL 316 Ca 0.80 0.15 0.00 0.00 -2.93 0.00 0.00 61.98 60.01 2wbd s VAL 316 Cb -0.36 -0.33 0.02 0.00 -1.53 0.00 0.00 36.38 34.18 2wbd s VAL 316 CO 0.43 0.06 -0.07 -0.63 -3.33 0.00 0.00 175.10 171.56 2wbd s ILE 317 N 1.17 0.93 0.19 7.04 1.09 0.12 -0.81 121.20 130.94 2wbd s ILE 317 Ca -0.09 -0.27 -0.10 0.00 -1.10 0.00 0.00 60.65 59.09 2wbd s ILE 317 Cb -0.10 -0.94 -0.01 0.00 -1.06 0.00 0.00 42.46 40.35 2wbd s ILE 317 CO -0.07 0.34 0.35 -1.48 -0.10 0.00 0.00 174.94 173.98 2wbd s LEU 318 N 1.43 0.70 0.00 2.97 0.05 0.09 -0.48 118.68 123.44 2wbd s LEU 318 Ca -0.01 -0.89 0.00 0.00 0.05 0.00 0.00 54.13 53.29 2wbd s LEU 318 Cb -0.13 1.39 0.00 0.00 -2.05 0.00 0.00 46.19 45.40 2wbd s LEU 318 CO -0.05 -0.98 0.00 0.61 -0.55 0.00 0.00 176.35 175.39 2wbd n GLY 319 N -0.28 0.33 3.64 -3.48 0.00 -0.62 -0.18 105.19 104.60 2wbd n GLY 319 Ca -0.05 -1.77 -0.50 0.00 0.00 0.00 0.00 46.02 43.70 2wbd n GLY 319 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2wbd n SER 320 N 0.00 2.45 -0.22 1.61 7.64 -0.04 -0.57 113.62 124.49 2wbd n SER 320 Ca 0.00 1.09 0.00 0.00 1.01 0.00 0.00 58.87 60.97 2wbd n SER 320 Cb 0.00 -1.30 0.12 0.00 -1.01 0.00 0.00 64.21 62.02 2wbd n SER 320 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2wbd h PRO 321 N 5.74 0.50 -0.81 1.43 0.13 -1.78 -0.56 132.00 136.65 2wbd h PRO 321 Ca -0.47 -0.03 0.04 0.00 -0.87 0.00 0.00 66.00 64.67 2wbd h PRO 321 Cb 1.30 -0.11 -0.05 0.00 0.13 0.00 0.00 31.00 32.26 2wbd h PRO 321 CO 0.85 0.33 0.52 -0.44 -0.23 0.00 0.00 178.00 179.03 2wbd h ASP 322 N 0.51 0.85 0.14 1.44 3.32 -1.78 0.21 116.42 121.12 2wbd h ASP 322 Ca 0.32 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.36 2wbd h ASP 322 Cb 0.35 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.72 2wbd h ASP 322 CO -0.27 0.58 -0.07 0.44 -1.72 0.00 0.00 179.24 178.20 2wbd h ASP 323 N 1.00 -0.16 -0.84 6.45 3.32 -1.60 -1.28 116.42 123.31 2wbd h ASP 323 Ca 0.33 -0.35 0.08 0.00 0.02 0.00 0.00 57.03 57.11 2wbd h ASP 323 Cb 0.04 0.04 -0.07 0.00 0.22 0.00 0.00 39.33 39.56 2wbd h ASP 323 CO -0.12 0.31 0.49 0.58 -1.72 0.00 0.00 179.24 178.78 2wbd h VAL 324 N -0.69 0.96 -0.52 -1.35 2.07 -1.00 0.18 116.25 115.89 2wbd h VAL 324 Ca -0.02 -0.29 -0.05 0.00 0.82 0.00 0.00 66.70 67.16 2wbd h VAL 324 Cb 0.51 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 2wbd h VAL 324 CO 0.03 0.16 0.12 -0.07 0.02 0.00 0.00 177.57 177.83 2wbd h LEU 325 N 0.85 0.75 -0.27 2.57 3.38 -0.57 -0.67 115.31 121.35 2wbd h LEU 325 Ca 0.39 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 58.15 2wbd h LEU 325 Cb 0.30 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2wbd h LEU 325 CO -0.22 0.74 -0.12 -0.08 0.09 0.00 0.00 178.44 178.85 2wbd h GLU 326 N 0.77 0.56 -0.39 1.13 4.81 0.02 0.78 114.58 122.27 2wbd h GLU 326 Ca 0.17 -0.24 0.08 0.00 -0.13 0.00 0.00 59.36 59.24 2wbd h GLU 326 Cb 0.30 -0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.58 2wbd h GLU 326 CO -0.00 0.80 -0.11 0.35 -0.73 0.00 0.00 179.01 179.32 2wbd h PHE 327 N 0.30 -0.24 -0.68 0.92 3.57 -0.36 -1.25 116.94 119.19 2wbd h PHE 327 Ca 0.06 0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.67 2wbd h PHE 327 Cb 0.62 0.17 -0.04 0.00 2.79 0.00 0.00 35.95 39.49 2wbd h PHE 327 CO 0.06 -0.18 0.45 -0.07 -2.23 0.00 0.00 178.31 176.34 2wbd h LEU 328 N -0.02 0.60 -0.07 0.59 3.38 -0.71 0.17 115.31 119.25 2wbd h LEU 328 Ca 0.19 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.20 2wbd h LEU 328 Cb 0.31 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.89 2wbd h LEU 328 CO -0.41 0.38 -0.21 0.50 0.09 0.00 0.00 178.44 178.79 2wbd h LYS 329 N 0.68 -0.29 -0.35 1.13 3.64 0.32 0.04 116.57 121.74 2wbd h LYS 329 Ca 0.30 0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.58 2wbd h LYS 329 Cb 0.30 0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 2wbd h LYS 329 CO -0.10 -0.19 -0.28 0.28 -2.27 0.00 0.00 179.45 176.89 2wbd h VAL 330 N -0.30 1.28 0.07 2.00 2.07 -0.74 -1.92 116.25 118.71 2wbd h VAL 330 Ca 0.08 -1.41 0.02 0.00 0.82 0.00 0.00 66.70 66.22 2wbd h VAL 330 Cb 0.41 1.31 -0.05 0.00 -1.52 0.00 0.00 31.29 31.45 2wbd h VAL 330 CO -0.24 0.46 -0.38 0.22 0.02 0.00 0.00 177.57 177.65 2wbd h TYR 331 N 0.63 -1.05 -0.69 1.57 3.20 -0.41 -1.83 116.97 118.39 2wbd h TYR 331 Ca 0.08 0.03 0.13 0.00 3.14 0.00 0.00 58.73 62.11 2wbd h TYR 331 Cb 0.79 0.45 -0.04 0.00 1.54 0.00 0.00 36.73 39.47 2wbd h TYR 331 CO 0.04 -0.47 0.46 0.93 -1.64 0.00 0.00 178.16 177.48 2wbd h GLU 332 N -0.58 0.36 0.00 1.82 4.39 -0.84 0.94 114.58 120.68 2wbd h GLU 332 Ca 0.04 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.70 2wbd h GLU 332 Cb 0.63 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 29.19 2wbd h GLU 332 CO -0.25 0.24 -0.06 -0.22 -1.16 0.00 0.00 179.01 177.56 2wbd h LYS 333 N 0.38 0.00 -0.19 2.33 3.64 -0.52 -2.66 116.57 119.55 2wbd h LYS 333 Ca 0.33 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.71 2wbd h LYS 333 Cb 0.78 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 2wbd h LYS 333 CO -0.10 0.06 0.00 0.72 -2.27 0.00 0.00 179.45 177.87 2wbd n HIS 334 N -4.10 0.24 -3.09 1.91 8.25 0.28 -4.92 115.22 113.79 2wbd n HIS 334 Ca -0.03 -0.16 -0.40 0.00 -0.26 0.00 0.00 57.72 56.87 2wbd n HIS 334 Cb 0.15 -0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.19 2wbd n HIS 334 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2wbd s SER 335 N -1.32 6.68 0.00 0.41 0.01 -0.89 -5.03 113.70 113.56 2wbd s SER 335 Ca 0.26 0.83 0.00 0.00 1.31 0.00 0.00 55.95 58.35 2wbd s SER 335 Cb 0.16 -2.36 0.00 0.00 0.21 0.00 0.00 66.02 64.03 2wbd s SER 335 CO 0.23 -0.32 0.00 0.00 0.41 0.00 0.00 173.24 173.56