#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1we1 s VAL 3 N 0.00 1.12 -1.42 -3.33 -7.23 -1.26 -5.00 120.40 103.28 1we1 s VAL 3 Ca 0.00 -1.94 -0.12 0.00 -1.81 0.00 0.00 61.98 58.11 1we1 s VAL 3 Cb 0.00 -2.06 0.07 0.00 0.56 0.00 0.00 36.38 34.94 1we1 s VAL 3 CO 0.00 0.00 2.21 -0.46 -0.31 0.00 0.00 175.10 176.54 1we1 n ASN 4 N -1.36 4.86 0.03 4.85 2.04 -1.26 -4.52 115.26 119.90 1we1 n ASN 4 Ca -0.19 -2.90 -0.11 0.00 -0.44 0.00 0.00 54.58 50.94 1we1 n ASN 4 Cb 0.67 -1.59 -0.05 0.00 -2.53 0.00 0.00 39.78 36.28 1we1 n ASN 4 CO 0.00 0.00 0.00 0.25 -0.44 0.00 0.00 177.26 177.07 1we1 h LEU 5 N 8.92 -0.30 -0.72 -4.53 6.46 -1.87 -1.66 115.31 121.62 1we1 h LEU 5 Ca 0.56 0.05 0.11 0.00 -0.12 0.00 0.00 57.88 58.47 1we1 h LEU 5 Cb 0.59 0.13 -0.12 0.00 -0.73 0.00 0.00 40.66 40.53 1we1 h LEU 5 CO 1.79 -0.14 -0.42 0.00 -0.62 0.00 0.00 178.44 179.05 1we1 h ALA 6 N 0.85 -0.18 -0.16 1.25 0.00 -1.83 0.31 119.26 119.51 1we1 h ALA 6 Ca 0.05 0.16 -0.12 0.00 0.00 0.00 0.00 54.91 55.01 1we1 h ALA 6 Cb 0.22 0.98 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1we1 h ALA 6 CO -0.13 -0.76 -0.40 1.03 0.00 0.00 0.00 179.25 178.98 1we1 h SER 7 N -0.14 0.38 0.30 0.00 0.87 -1.93 -2.08 113.55 110.95 1we1 h SER 7 Ca 0.23 -0.16 -0.10 0.00 -1.23 0.00 0.00 61.79 60.52 1we1 h SER 7 Cb 0.56 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 1we1 h SER 7 CO -0.78 0.75 -0.42 1.56 -0.53 0.00 0.00 176.83 177.40 1we1 h GLN 8 N 0.30 0.17 -0.07 2.24 4.20 0.06 -1.00 115.11 121.01 1we1 h GLN 8 Ca 0.03 -0.08 -0.08 0.00 0.06 0.00 0.00 58.65 58.57 1we1 h GLN 8 Cb 0.84 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.63 1we1 h GLN 8 CO 0.07 0.57 -0.28 -0.07 -0.67 0.00 0.00 178.83 178.45 1we1 h LEU 9 N 0.14 0.36 0.17 1.46 3.38 -0.30 0.18 115.31 120.70 1we1 h LEU 9 Ca 0.01 -0.64 0.01 0.00 0.09 0.00 0.00 57.88 57.35 1we1 h LEU 9 Cb 0.81 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.43 1we1 h LEU 9 CO 0.06 0.94 -0.22 -0.09 0.09 0.00 0.00 178.44 179.23 1we1 h ARG 10 N -0.19 -0.42 -0.63 1.13 2.43 -1.26 -0.63 114.38 114.81 1we1 h ARG 10 Ca -0.02 0.03 -0.09 0.00 -0.81 0.00 0.00 59.98 59.09 1we1 h ARG 10 Cb 0.92 0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.55 1we1 h ARG 10 CO 0.06 -0.28 0.05 0.93 -1.51 0.00 0.00 179.97 179.21 1we1 h GLU 11 N -0.44 1.08 0.00 0.20 4.39 -1.25 -1.77 114.58 116.79 1we1 h GLU 11 Ca 0.01 -0.32 0.00 0.00 0.34 0.00 0.00 59.36 59.39 1we1 h GLU 11 Cb 0.43 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1we1 h GLU 11 CO -0.08 1.03 0.00 0.78 -1.16 0.00 0.00 179.01 179.58 1we1 h GLY 12 N 0.99 0.00 -0.17 -3.84 0.00 -0.28 -3.18 103.07 96.60 1we1 h GLY 12 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1we1 h GLY 12 CO 0.02 0.00 -0.17 -1.30 0.00 0.00 0.00 176.54 175.10 1we1 n THR 13 N -2.69 0.00 -0.26 4.70 -2.24 -0.27 -4.72 114.28 108.79 1we1 n THR 13 Ca 0.01 -0.42 0.04 0.00 -2.27 0.00 0.00 64.05 61.41 1we1 n THR 13 Cb 0.24 1.04 0.14 0.00 -2.10 0.00 0.00 70.33 69.65 1we1 n THR 13 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 1we1 h LYS 14 N 0.41 0.06 0.00 -0.78 3.11 -1.30 0.39 116.57 118.46 1we1 h LYS 14 Ca 0.00 -0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.83 1we1 h LYS 14 Cb 0.17 -0.01 -0.00 0.00 -1.00 0.00 0.00 32.23 31.39 1we1 h LYS 14 CO 0.00 0.04 -0.05 -0.22 -2.81 0.00 0.00 179.45 176.40 1we1 h LYS 15 N 0.06 0.00 0.00 1.90 3.64 -1.85 -2.36 116.57 117.96 1we1 h LYS 15 Ca 0.40 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.60 1we1 h LYS 15 Cb 0.69 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.48 1we1 h LYS 15 CO -0.72 0.05 -1.32 0.77 -2.27 0.00 0.00 179.45 175.96 1we1 h SER 16 N 0.00 0.00 0.15 4.20 0.02 -0.65 -2.85 113.55 114.42 1we1 h SER 16 Ca -0.00 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.76 1we1 h SER 16 Cb 0.47 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.01 1we1 h SER 16 CO 0.01 0.65 -0.70 -0.74 -1.14 0.00 0.00 176.83 174.91 1we1 h HIS 17 N 0.00 0.65 -0.42 3.45 -0.00 -0.69 -1.99 115.15 116.16 1we1 h HIS 17 Ca -0.15 -0.28 -0.10 0.00 -0.00 0.00 0.00 60.37 59.83 1we1 h HIS 17 Cb 1.63 -0.11 -0.02 0.00 -0.00 0.00 0.00 27.41 28.92 1we1 h HIS 17 CO 0.00 1.04 -0.16 1.03 -0.00 0.00 0.00 177.93 179.84 1we1 h SER 18 N 0.34 0.79 -0.48 3.26 0.87 -1.50 -1.42 113.55 115.42 1we1 h SER 18 Ca -0.03 -0.26 -0.11 0.00 -1.23 0.00 0.00 61.79 60.16 1we1 h SER 18 Cb 1.28 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 63.01 1we1 h SER 18 CO 0.13 0.95 -0.13 0.24 -0.53 0.00 0.00 176.83 177.49 1we1 h MET 19 N 0.70 0.96 -0.62 2.24 2.86 -1.34 -2.73 114.93 117.01 1we1 h MET 19 Ca 0.11 -0.35 -0.04 0.00 -2.06 0.00 0.00 59.70 57.35 1we1 h MET 19 Cb 0.66 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.24 1we1 h MET 19 CO 0.05 1.02 0.23 0.00 1.06 0.00 0.00 176.91 179.27 1we1 h ALA 20 N 0.99 0.80 0.00 6.32 0.00 -1.05 -1.59 119.26 124.73 1we1 h ALA 20 Ca 0.13 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1we1 h ALA 20 Cb 0.67 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1we1 h ALA 20 CO 0.05 0.43 -0.01 0.93 0.00 0.00 0.00 179.25 180.65 1we1 h GLU 21 N 0.86 0.00 -0.52 0.00 5.08 -1.09 -2.29 114.58 116.63 1we1 h GLU 21 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1we1 h GLU 21 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1we1 h GLU 21 CO -0.01 0.01 0.00 0.09 -1.00 0.00 0.00 179.01 178.09 1we1 n ASN 22 N -3.16 4.97 -4.73 1.42 3.02 -0.61 -4.15 115.26 112.03 1we1 n ASN 22 Ca -0.02 -2.78 -0.41 0.00 -0.03 0.00 0.00 54.58 51.34 1we1 n ASN 22 Cb 0.15 -0.61 -0.04 0.00 -0.61 0.00 0.00 39.78 38.66 1we1 n ASN 22 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1we1 s VAL 23 N -2.46 4.59 0.26 2.41 1.01 -0.86 -4.89 120.40 120.46 1we1 s VAL 23 Ca 0.50 1.99 -0.12 0.00 0.00 0.00 0.00 61.98 64.35 1we1 s VAL 23 Cb 0.37 -4.28 0.36 0.00 0.00 0.00 0.00 36.38 32.82 1we1 s VAL 23 CO 0.17 0.30 1.55 0.61 0.00 0.00 0.00 175.10 177.73 1we1 n GLY 24 N 2.37 -1.83 0.28 4.51 0.00 -1.26 -0.03 105.19 109.22 1we1 n GLY 24 Ca 0.02 1.09 0.05 0.00 0.00 0.00 0.00 46.02 47.17 1we1 n GLY 24 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1we1 h PHE 25 N 0.00 0.32 0.21 1.61 3.57 -1.92 -2.56 116.94 118.17 1we1 h PHE 25 Ca 0.42 -0.00 -0.28 0.00 3.53 0.00 0.00 57.97 61.64 1we1 h PHE 25 Cb 0.67 -0.11 0.03 0.00 2.79 0.00 0.00 35.95 39.33 1we1 h PHE 25 CO -0.81 0.26 -1.26 0.28 -2.23 0.00 0.00 178.31 174.55 1we1 h VAL 26 N 0.34 1.34 -0.98 1.41 2.07 -0.75 -2.40 116.25 117.28 1we1 h VAL 26 Ca 0.09 -2.62 0.07 0.00 0.82 0.00 0.00 66.70 65.06 1we1 h VAL 26 Cb 0.06 3.08 -0.07 0.00 -1.52 0.00 0.00 31.29 32.84 1we1 h VAL 26 CO -0.01 0.78 0.63 0.11 0.02 0.00 0.00 177.57 179.09 1we1 h LYS 27 N -0.06 1.09 -0.33 1.57 1.57 -1.10 0.25 116.57 119.56 1we1 h LYS 27 Ca -0.22 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.45 1we1 h LYS 27 Cb 1.96 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 34.01 1we1 h LYS 27 CO 0.22 0.72 0.06 0.00 -0.57 0.00 0.00 179.45 179.88 1we1 h PHE 29 N 0.37 -0.52 -0.63 0.00 3.57 -0.74 0.13 116.94 119.14 1we1 h PHE 29 Ca 0.10 0.02 0.13 0.00 3.53 0.00 0.00 57.97 61.75 1we1 h PHE 29 Cb 0.34 0.23 -0.04 0.00 2.79 0.00 0.00 35.95 39.27 1we1 h PHE 29 CO 0.02 -0.28 0.43 -0.07 -2.23 0.00 0.00 178.31 176.18 1we1 h LEU 30 N -0.30 0.29 -1.71 0.59 4.07 -0.45 -1.52 115.31 116.28 1we1 h LEU 30 Ca 0.07 0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.04 1we1 h LEU 30 Cb 0.39 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.08 1we1 h LEU 30 CO -0.20 0.16 0.00 0.29 -1.08 0.00 0.00 178.44 177.61 1we1 n LYS 31 N -4.45 2.27 -0.70 1.13 5.02 -0.85 -4.88 118.16 115.70 1we1 n LYS 31 Ca 0.11 -1.42 0.00 0.00 -2.02 0.00 0.00 58.31 54.98 1we1 n LYS 31 Cb 0.47 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 33.97 1we1 n LYS 31 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1we1 n GLY 32 N 0.79 0.75 3.29 0.72 0.00 -0.57 -5.00 105.19 105.16 1we1 n GLY 32 Ca 0.13 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.70 1we1 n GLY 32 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1we1 s VAL 33 N -2.71 5.21 -0.02 1.61 1.01 0.41 -4.67 120.40 121.25 1we1 s VAL 33 Ca 0.00 -2.42 0.04 0.00 0.00 0.00 0.00 61.98 59.61 1we1 s VAL 33 Cb 0.00 -4.26 -0.01 0.00 0.00 0.00 0.00 36.38 32.11 1we1 s VAL 33 CO 0.00 -0.98 -0.15 0.54 0.00 0.00 0.00 175.10 174.51 1we1 s VAL 34 N 0.33 1.21 -0.28 2.92 0.11 -1.26 -3.11 120.40 120.32 1we1 s VAL 34 Ca 0.16 -0.64 -0.08 0.00 -2.93 0.00 0.00 61.98 58.49 1we1 s VAL 34 Cb -0.15 -1.02 -0.01 0.00 -1.53 0.00 0.00 36.38 33.67 1we1 s VAL 34 CO -0.06 0.35 0.09 -0.70 -3.33 0.00 0.00 175.10 171.44 1we1 s GLU 35 N -0.22 3.41 0.38 1.54 -6.30 -1.26 -4.75 118.70 111.49 1we1 s GLU 35 Ca 0.03 -0.65 0.16 0.00 -2.50 0.00 0.00 54.97 52.01 1we1 s GLU 35 Cb -0.07 -3.39 1.04 0.00 0.00 0.00 0.00 34.13 31.71 1we1 s GLU 35 CO 0.00 -0.32 1.78 -0.22 0.02 0.00 0.00 175.26 176.52 1we1 h LYS 36 N 8.26 0.44 -0.30 4.30 3.11 -1.97 0.11 116.57 130.52 1we1 h LYS 36 Ca -0.35 -0.03 -0.12 0.00 -2.81 0.00 0.00 60.65 57.34 1we1 h LYS 36 Cb 1.15 -0.10 -0.01 0.00 -1.00 0.00 0.00 32.23 32.28 1we1 h LYS 36 CO 0.60 0.29 -0.28 -0.91 -2.81 0.00 0.00 179.45 176.34 1we1 h ASN 37 N 0.46 0.77 -0.11 4.20 -0.26 -1.99 -0.88 115.58 117.77 1we1 h ASN 37 Ca 0.58 -0.46 -0.06 0.00 -0.56 0.00 0.00 56.30 55.80 1we1 h ASN 37 Cb 1.37 -0.22 -0.00 0.00 -1.06 0.00 0.00 38.32 38.42 1we1 h ASN 37 CO -0.31 1.07 -0.18 0.28 -1.06 0.00 0.00 177.43 177.23 1we1 h SER 38 N 0.48 0.34 -0.18 5.81 0.02 -1.70 -2.96 113.55 115.36 1we1 h SER 38 Ca 0.05 -0.54 -0.01 0.00 -0.84 0.00 0.00 61.79 60.45 1we1 h SER 38 Cb 0.84 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 63.27 1we1 h SER 38 CO 0.07 0.81 0.08 0.22 -1.14 0.00 0.00 176.83 176.87 1we1 h TYR 39 N -0.12 0.31 -0.42 3.45 5.03 -0.86 -0.91 116.97 123.46 1we1 h TYR 39 Ca 0.01 -0.01 -0.06 0.00 2.58 0.00 0.00 58.73 61.25 1we1 h TYR 39 Cb 0.75 -0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.91 1we1 h TYR 39 CO 0.10 0.26 0.01 -0.09 -1.32 0.00 0.00 178.16 177.13 1we1 h ARG 40 N 0.32 0.68 -0.26 1.82 2.43 -1.10 -2.04 114.38 116.22 1we1 h ARG 40 Ca 0.08 -0.16 -0.12 0.00 -0.81 0.00 0.00 59.98 58.96 1we1 h ARG 40 Cb 0.09 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1we1 h ARG 40 CO -0.01 0.69 -0.35 0.87 -1.51 0.00 0.00 179.97 179.66 1we1 h LYS 41 N 0.64 0.58 0.41 0.20 1.57 -1.01 -2.35 116.57 116.61 1we1 h LYS 41 Ca 0.13 -0.27 -0.02 0.00 -1.87 0.00 0.00 60.65 58.62 1we1 h LYS 41 Cb 0.39 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1we1 h LYS 41 CO 0.01 0.85 -0.20 1.25 -0.57 0.00 0.00 179.45 180.80 1we1 h LEU 42 N 0.49 -0.46 -1.99 2.94 5.85 -1.01 -0.99 115.31 120.13 1we1 h LEU 42 Ca 0.05 -0.03 0.22 0.00 0.84 0.00 0.00 57.88 58.95 1we1 h LEU 42 Cb 0.84 0.12 -0.03 0.00 0.37 0.00 0.00 40.66 41.96 1we1 h LEU 42 CO 0.07 -0.26 0.54 0.58 -0.34 0.00 0.00 178.44 179.03 1we1 h VAL 43 N -0.64 0.63 0.30 1.05 2.07 -1.34 0.71 116.25 119.04 1we1 h VAL 43 Ca -0.06 -0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 1we1 h VAL 43 Cb 0.47 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1we1 h VAL 43 CO 0.09 0.00 -0.15 1.23 0.02 0.00 0.00 177.57 178.77 1we1 h GLY 44 N 0.01 -0.43 0.98 2.17 0.00 -0.77 -2.37 103.07 102.66 1we1 h GLY 44 Ca 0.36 0.16 0.01 0.00 0.00 0.00 0.00 47.33 47.85 1we1 h GLY 44 CO -0.01 -0.16 0.34 3.43 0.00 0.00 0.00 176.54 180.15 1we1 h ASN 45 N -0.83 0.59 -0.65 0.19 2.35 0.19 -1.93 115.58 115.50 1we1 h ASN 45 Ca -0.04 -0.01 0.11 0.00 -0.55 0.00 0.00 56.30 55.80 1we1 h ASN 45 Cb 0.52 -0.14 -0.04 0.00 0.05 0.00 0.00 38.32 38.70 1we1 h ASN 45 CO 0.07 0.42 0.43 -0.07 -1.65 0.00 0.00 177.43 176.64 1we1 h LEU 46 N 0.70 0.40 0.05 1.61 3.38 -0.98 -1.63 115.31 118.83 1we1 h LEU 46 Ca 0.20 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.20 1we1 h LEU 46 Cb -0.06 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 1we1 h LEU 46 CO -0.05 0.23 -0.21 0.22 0.09 0.00 0.00 178.44 178.72 1we1 h TYR 47 N 0.44 -0.56 -0.55 1.13 3.20 -0.79 0.41 116.97 120.26 1we1 h TYR 47 Ca 0.30 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 62.10 1we1 h TYR 47 Cb 0.59 0.24 -0.02 0.00 1.54 0.00 0.00 36.73 39.08 1we1 h TYR 47 CO -0.00 -0.30 0.01 0.74 -1.64 0.00 0.00 178.16 176.97 1we1 h PHE 48 N -0.36 1.00 0.10 -3.82 -1.00 -1.28 -1.10 116.94 110.48 1we1 h PHE 48 Ca 0.05 -0.15 -0.00 0.00 2.81 0.00 0.00 57.97 60.67 1we1 h PHE 48 Cb 0.42 -0.27 0.00 0.00 3.61 0.00 0.00 35.95 39.71 1we1 h PHE 48 CO -0.23 0.90 -0.05 0.28 -1.61 0.00 0.00 178.31 177.60 1we1 h VAL 49 N 0.87 1.01 -0.64 -0.55 2.07 -0.96 -1.88 116.25 116.17 1we1 h VAL 49 Ca 0.16 -0.39 -0.07 0.00 0.82 0.00 0.00 66.70 67.22 1we1 h VAL 49 Cb 0.49 1.27 -0.03 0.00 -1.52 0.00 0.00 31.29 31.50 1we1 h VAL 49 CO 0.02 0.10 0.13 1.88 0.02 0.00 0.00 177.57 179.72 1we1 h TYR 50 N -0.31 1.08 -0.51 1.57 0.05 -0.91 -2.08 116.97 115.87 1we1 h TYR 50 Ca -0.01 -0.13 0.08 0.00 0.05 0.00 0.00 58.73 58.72 1we1 h TYR 50 Cb 0.26 -0.31 -0.07 0.00 1.01 0.00 0.00 36.73 37.62 1we1 h TYR 50 CO -0.01 0.90 0.11 0.77 -1.05 0.00 0.00 178.16 178.88 1we1 h SER 51 N 0.98 0.03 -0.41 3.88 0.02 -1.05 -0.17 113.55 116.83 1we1 h SER 51 Ca 0.20 0.09 -0.05 0.00 -0.84 0.00 0.00 61.79 61.18 1we1 h SER 51 Cb 0.38 0.11 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 1we1 h SER 51 CO 0.01 0.04 0.08 0.00 -1.14 0.00 0.00 176.83 175.82 1we1 h ALA 52 N 1.39 1.24 0.30 3.77 0.00 -0.96 -2.41 119.26 122.59 1we1 h ALA 52 Ca 0.25 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1we1 h ALA 52 Cb 0.33 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1we1 h ALA 52 CO -0.32 0.52 -0.15 0.52 0.00 0.00 0.00 179.25 179.82 1we1 h MET 53 N 0.72 -0.39 0.00 0.00 2.07 -0.52 -2.19 114.93 114.62 1we1 h MET 53 Ca 0.15 0.03 -0.03 0.00 -2.07 0.00 0.00 59.70 57.79 1we1 h MET 53 Cb 0.32 0.09 -0.00 0.00 -1.87 0.00 0.00 31.60 30.14 1we1 h MET 53 CO 0.00 -0.06 -0.12 0.93 1.07 0.00 0.00 176.91 178.74 1we1 h GLU 54 N -0.87 0.00 0.40 1.72 5.08 -1.12 0.40 114.58 120.18 1we1 h GLU 54 Ca -0.04 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1we1 h GLU 54 Cb 0.52 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1we1 h GLU 54 CO 0.07 0.12 -0.19 1.49 -1.00 0.00 0.00 179.01 179.50 1we1 h GLU 55 N 0.00 -0.51 -0.97 2.33 4.81 -1.46 -2.38 114.58 116.40 1we1 h GLU 55 Ca -0.00 0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.30 1we1 h GLU 55 Cb 0.26 0.12 -0.06 0.00 0.63 0.00 0.00 28.75 29.70 1we1 h GLU 55 CO 0.02 -0.27 0.63 0.93 -0.73 0.00 0.00 179.01 179.59 1we1 h GLU 56 N -1.09 1.18 0.00 1.92 4.39 -1.15 -0.79 114.58 119.04 1we1 h GLU 56 Ca -0.05 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.56 1we1 h GLU 56 Cb 0.48 -0.27 -0.00 0.00 -0.10 0.00 0.00 28.75 28.86 1we1 h GLU 56 CO 0.09 0.78 -0.05 1.98 -1.16 0.00 0.00 179.01 180.65 1we1 h MET 57 N 1.22 0.00 0.06 2.33 4.05 -0.26 -2.91 114.93 119.41 1we1 h MET 57 Ca 0.39 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.81 1we1 h MET 57 Cb 0.02 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 30.82 1we1 h MET 57 CO -0.13 0.05 -0.03 0.00 0.23 0.00 0.00 176.91 177.04 1we1 h ALA 58 N 1.95 -0.08 0.00 0.39 0.00 -0.58 -2.90 119.26 118.04 1we1 h ALA 58 Ca -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1we1 h ALA 58 Cb 0.32 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1we1 h ALA 58 CO 0.01 -0.37 0.00 0.36 0.00 0.00 0.00 179.25 179.25 1we1 n LYS 59 N -4.96 0.19 -0.45 0.00 2.85 -1.10 -1.94 118.16 112.73 1we1 n LYS 59 Ca -0.08 0.44 0.09 0.00 -1.05 0.00 0.00 58.31 57.71 1we1 n LYS 59 Cb 0.20 -1.87 0.30 0.00 -0.65 0.00 0.00 35.03 33.01 1we1 n LYS 59 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1we1 n PHE 60 N -2.23 1.12 0.19 5.58 3.01 -1.18 -4.51 117.46 119.45 1we1 n PHE 60 Ca 0.02 -0.58 0.11 0.00 1.01 0.00 0.00 57.45 58.01 1we1 n PHE 60 Cb 0.21 -0.14 0.60 0.00 -0.01 0.00 0.00 39.48 40.13 1we1 n PHE 60 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 1we1 h LYS 61 N 3.56 0.00 -0.00 -1.08 2.10 -1.18 0.10 116.57 120.07 1we1 h LYS 61 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1we1 h LYS 61 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 1we1 h LYS 61 CO 0.13 0.00 -0.20 -0.25 -2.00 0.00 0.00 179.45 177.13 1we1 n ASP 62 N -2.32 0.90 -4.56 7.07 10.43 -1.26 -4.27 116.55 122.55 1we1 n ASP 62 Ca -0.01 -0.95 -0.41 0.00 2.57 0.00 0.00 54.79 55.98 1we1 n ASP 62 Cb 0.15 0.58 0.01 0.00 1.84 0.00 0.00 41.12 43.71 1we1 n ASP 62 CO 0.00 0.00 0.00 1.57 -1.07 0.00 0.00 177.20 177.70 1we1 n HIS 63 N -0.49 0.58 -0.33 1.24 -0.00 0.36 -4.75 115.22 111.82 1we1 n HIS 63 Ca 0.03 0.57 0.14 0.00 0.46 0.00 0.00 57.72 58.92 1we1 n HIS 63 Cb 0.15 -2.14 0.34 0.00 -0.12 0.00 0.00 29.99 28.22 1we1 n HIS 63 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1we1 h PRO 64 N 1.22 0.59 0.00 1.57 0.11 -1.96 -1.98 132.00 131.54 1we1 h PRO 64 Ca -0.43 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.57 1we1 h PRO 64 Cb 1.36 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1we1 h PRO 64 CO 0.55 0.39 -1.26 -0.89 -0.21 0.00 0.00 178.00 176.58 1we1 n ILE 65 N -4.88 1.50 -0.34 4.15 5.41 -1.26 -4.61 119.36 119.33 1we1 n ILE 65 Ca 0.24 0.05 0.15 0.00 1.00 0.00 0.00 62.75 64.19 1we1 n ILE 65 Cb 0.65 -2.27 0.36 0.00 -0.71 0.00 0.00 39.64 37.67 1we1 n ILE 65 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1we1 h LEU 66 N -1.00 0.72 -1.92 1.39 -0.00 -1.82 -1.27 115.31 111.42 1we1 h LEU 66 Ca -0.12 0.10 0.29 0.00 -0.00 0.00 0.00 57.88 58.16 1we1 h LEU 66 Cb 1.10 -0.02 -0.05 0.00 -0.00 0.00 0.00 40.66 41.69 1we1 h LEU 66 CO -0.07 0.22 0.73 0.77 -0.00 0.00 0.00 178.44 180.09 1we1 h SER 67 N 0.67 0.06 0.16 -0.43 4.64 -1.36 0.17 113.55 117.46 1we1 h SER 67 Ca 0.59 0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.84 1we1 h SER 67 Cb 1.04 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.12 1we1 h SER 67 CO -0.39 0.01 -0.28 0.45 -0.87 0.00 0.00 176.83 175.75 1we1 h HIS 68 N 0.06 0.24 -0.69 4.77 3.86 -1.47 -3.10 115.15 118.82 1we1 h HIS 68 Ca 0.50 -0.05 -0.46 0.00 -1.16 0.00 0.00 60.37 59.21 1we1 h HIS 68 Cb 1.91 -0.06 -0.29 0.00 1.06 0.00 0.00 27.41 30.03 1we1 h HIS 68 CO -0.00 0.48 -0.13 0.44 0.86 0.00 0.00 177.93 179.59 1we1 n ILE 69 N -4.14 2.83 -3.28 2.45 -5.35 0.04 -4.89 119.36 107.03 1we1 n ILE 69 Ca -0.01 -3.38 -0.45 0.00 -0.27 0.00 0.00 62.75 58.64 1we1 n ILE 69 Cb 0.38 -0.87 -0.06 0.00 -1.74 0.00 0.00 39.64 37.35 1we1 n ILE 69 CO 0.00 0.00 0.00 -0.47 -1.76 0.00 0.00 176.55 174.32 1we1 s TYR 70 N -3.54 3.16 -0.53 4.28 5.04 -1.15 -4.97 117.35 119.64 1we1 s TYR 70 Ca 0.53 -0.92 0.04 0.00 -2.44 0.00 0.00 57.07 54.28 1we1 s TYR 70 Cb 0.44 -3.52 0.16 0.00 0.35 0.00 0.00 41.96 39.39 1we1 s TYR 70 CO 0.01 -0.97 0.36 -0.06 -1.34 0.00 0.00 175.55 173.55 1we1 s PHE 71 N 2.03 2.30 0.60 4.97 0.08 -1.26 -4.97 117.98 121.73 1we1 s PHE 71 Ca 0.08 -2.73 0.29 0.00 0.12 0.00 0.00 56.93 54.68 1we1 s PHE 71 Cb -0.24 -1.91 1.47 0.00 -0.57 0.00 0.00 43.02 41.77 1we1 s PHE 71 CO 0.07 -0.71 1.88 -1.00 -0.10 0.00 0.00 175.22 175.36 1we1 h PRO 72 N 5.94 0.00 0.00 0.24 0.13 -2.00 0.23 132.00 136.54 1we1 h PRO 72 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1we1 h PRO 72 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1we1 h PRO 72 CO 0.54 0.00 0.09 0.39 -0.23 0.00 0.00 178.00 178.78 1we1 n GLU 73 N -3.56 0.11 0.04 0.86 4.71 -1.26 -0.33 120.64 121.20 1we1 n GLU 73 Ca 0.07 0.60 0.09 0.00 -0.01 0.00 0.00 57.16 57.91 1we1 n GLU 73 Cb 0.64 -1.95 -0.09 0.00 -1.01 0.00 0.00 31.44 29.03 1we1 n GLU 73 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 1we1 n LEU 74 N -2.11 0.44 -4.60 -4.62 4.77 0.80 -4.68 117.00 107.01 1we1 n LEU 74 Ca -0.01 0.17 -0.58 0.00 -0.03 0.00 0.00 56.01 55.57 1we1 n LEU 74 Cb 0.11 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.13 1we1 n LEU 74 CO 0.07 -0.05 0.87 0.59 -1.33 0.00 0.00 177.39 177.55 1we1 n ASN 75 N -2.51 1.06 -0.52 -1.43 5.03 0.55 -4.89 115.26 112.55 1we1 n ASN 75 Ca -0.04 1.14 0.06 0.00 0.87 0.00 0.00 54.58 56.61 1we1 n ASN 75 Cb 0.61 -1.04 0.08 0.00 -1.02 0.00 0.00 39.78 38.42 1we1 n ASN 75 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1we1 n ARG 76 N 2.75 1.37 0.05 3.52 5.12 -1.26 -4.70 116.66 123.52 1we1 n ARG 76 Ca 0.22 -1.48 -0.12 0.00 -1.93 0.00 0.00 57.85 54.53 1we1 n ARG 76 Cb 0.10 -1.23 -0.07 0.00 -1.16 0.00 0.00 32.46 30.10 1we1 n ARG 76 CO 0.00 0.00 0.00 -0.22 -1.93 0.00 0.00 177.63 175.48 1we1 h LYS 77 N 2.14 -0.04 0.00 5.56 3.64 -1.90 -1.31 116.57 124.67 1we1 h LYS 77 Ca 0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1we1 h LYS 77 Cb 0.56 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.39 1we1 h LYS 77 CO 0.00 0.01 -0.04 0.37 -2.27 0.00 0.00 179.45 177.52 1we1 h GLN 78 N -0.08 0.00 0.04 1.90 4.15 -2.00 -1.49 115.11 117.63 1we1 h GLN 78 Ca -0.00 0.00 -0.22 0.00 0.77 0.00 0.00 58.65 59.19 1we1 h GLN 78 Cb 0.07 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.75 1we1 h GLN 78 CO 0.01 0.04 -1.03 0.66 -1.93 0.00 0.00 178.83 176.57 1we1 h SER 79 N 0.00 0.20 0.60 -0.69 4.64 -1.78 -2.89 113.55 113.64 1we1 h SER 79 Ca -0.00 -0.20 -0.09 0.00 -0.47 0.00 0.00 61.79 61.04 1we1 h SER 79 Cb 0.07 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1we1 h SER 79 CO 0.00 1.10 -0.41 -0.07 -0.87 0.00 0.00 176.83 176.59 1we1 h LEU 80 N 0.05 0.00 -0.22 5.97 4.07 -0.47 -2.67 115.31 122.04 1we1 h LEU 80 Ca -0.06 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 57.77 1we1 h LEU 80 Cb 1.74 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.48 1we1 h LEU 80 CO 0.15 0.41 -0.38 -0.33 -1.08 0.00 0.00 178.44 177.21 1we1 h GLU 81 N 0.00 0.65 -0.53 1.13 5.08 -1.22 0.27 114.58 119.96 1we1 h GLU 81 Ca -0.00 -0.40 -0.01 0.00 -1.00 0.00 0.00 59.36 57.94 1we1 h GLU 81 Cb 0.82 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.09 1we1 h GLU 81 CO 0.05 1.02 0.29 1.96 -1.00 0.00 0.00 179.01 181.33 1we1 h GLN 82 N 0.35 0.73 -0.03 2.33 4.20 -1.33 0.80 115.11 122.15 1we1 h GLN 82 Ca 0.01 -0.07 -0.24 0.00 0.06 0.00 0.00 58.65 58.41 1we1 h GLN 82 Cb 0.98 -0.15 0.01 0.00 0.30 0.00 0.00 27.48 28.62 1we1 h GLN 82 CO 0.09 0.54 -0.94 -0.44 -0.67 0.00 0.00 178.83 177.41 1we1 h ASP 83 N 0.74 0.76 -0.75 1.46 3.45 -1.35 -2.45 116.42 118.28 1we1 h ASP 83 Ca 0.19 -0.58 -0.05 0.00 0.43 0.00 0.00 57.03 57.02 1we1 h ASP 83 Cb 0.03 -0.23 -0.03 0.00 -0.56 0.00 0.00 39.33 38.53 1we1 h ASP 83 CO -0.03 1.37 0.26 -0.07 -1.57 0.00 0.00 179.24 179.20 1we1 h LEU 84 N 0.36 1.06 -1.73 1.55 3.38 -0.34 -0.58 115.31 119.01 1we1 h LEU 84 Ca -0.09 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.66 1we1 h LEU 84 Cb 1.58 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 42.04 1we1 h LEU 84 CO 0.18 0.97 -0.16 -0.61 0.09 0.00 0.00 178.44 178.90 1we1 h GLN 85 N 1.11 0.00 0.10 1.13 4.15 -0.81 -1.00 115.11 119.78 1we1 h GLN 85 Ca 0.25 0.00 -0.27 0.00 0.77 0.00 0.00 58.65 59.39 1we1 h GLN 85 Cb 0.26 0.00 0.01 0.00 0.21 0.00 0.00 27.48 27.97 1we1 h GLN 85 CO -0.01 0.16 -1.18 0.35 -1.93 0.00 0.00 178.83 176.22 1we1 h PHE 86 N 0.00 0.74 0.00 3.99 3.57 -0.66 -0.98 116.94 123.60 1we1 h PHE 86 Ca -0.00 -0.47 0.00 0.00 3.53 0.00 0.00 57.97 61.03 1we1 h PHE 86 Cb 0.32 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.01 1we1 h PHE 86 CO 0.00 1.33 -0.84 0.66 -2.23 0.00 0.00 178.31 177.23 1we1 n TYR 87 N -3.69 0.35 0.00 0.41 4.02 -0.42 -4.49 117.16 113.34 1we1 n TYR 87 Ca -0.10 0.10 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1we1 n TYR 87 Cb 0.96 -0.50 0.00 0.00 -0.02 0.00 0.00 39.34 39.79 1we1 n TYR 87 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1we1 n TYR 88 N -1.98 0.00 0.00 -0.72 4.01 -0.40 -5.08 117.16 113.00 1we1 n TYR 88 Ca 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.77 1we1 n TYR 88 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.46 1we1 n TYR 88 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1we1 n GLY 89 N 2.29 0.96 0.00 2.72 0.00 -0.37 -4.36 105.19 106.42 1we1 n GLY 89 Ca 0.00 -2.13 0.04 0.00 0.00 0.00 0.00 46.02 43.93 1we1 n GLY 89 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1we1 n SER 90 N 0.00 0.00 -1.18 1.61 3.41 -1.26 -0.70 113.62 115.50 1we1 n SER 90 Ca 0.00 0.01 0.11 0.00 -0.26 0.00 0.00 58.87 58.73 1we1 n SER 90 Cb 0.00 -0.17 0.27 0.00 -0.26 0.00 0.00 64.21 64.04 1we1 n SER 90 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1we1 n ASN 91 N -1.17 3.65 -0.20 4.04 5.15 -1.26 -4.64 115.26 120.83 1we1 n ASN 91 Ca 0.04 -1.99 -0.00 0.00 -0.60 0.00 0.00 54.58 52.04 1we1 n ASN 91 Cb 0.05 -0.39 0.08 0.00 -0.53 0.00 0.00 39.78 38.98 1we1 n ASN 91 CO 0.00 0.00 0.00 4.11 1.40 0.00 0.00 177.26 182.77 1we1 h TRP 92 N 3.90 -0.20 -0.79 1.20 5.08 -1.11 -0.89 115.95 123.13 1we1 h TRP 92 Ca 0.00 0.05 0.23 0.00 1.08 0.00 0.00 58.89 60.25 1we1 h TRP 92 Cb 0.94 0.18 -0.03 0.00 -3.00 0.00 0.00 29.16 27.25 1we1 h TRP 92 CO 0.39 -0.22 0.99 -0.09 -1.28 0.00 0.00 178.44 178.23 1we1 h ARG 93 N 0.05 0.00 0.00 0.12 9.65 -1.84 0.71 114.38 123.06 1we1 h ARG 93 Ca 0.30 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.18 1we1 h ARG 93 Cb 0.48 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.06 1we1 h ARG 93 CO -0.58 0.00 -1.90 1.04 2.80 0.00 0.00 179.97 181.33 1we1 n GLN 94 N -3.30 0.60 0.06 0.20 6.02 -0.35 -4.45 117.38 116.16 1we1 n GLN 94 Ca 0.17 -0.18 0.11 0.00 -0.01 0.00 0.00 57.00 57.10 1we1 n GLN 94 Cb 1.24 -1.47 -0.03 0.00 1.02 0.00 0.00 30.24 31.00 1we1 n GLN 94 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1we1 n GLU 95 N -2.18 0.54 -1.62 -1.09 1.02 0.23 -4.92 120.64 112.62 1we1 n GLU 95 Ca -0.04 0.01 -0.47 0.00 -0.02 0.00 0.00 57.16 56.65 1we1 n GLU 95 Cb 0.52 -1.69 -0.04 0.00 -0.02 0.00 0.00 31.44 30.20 1we1 n GLU 95 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1we1 n VAL 96 N -2.39 0.48 -2.95 2.62 0.31 -0.17 -4.98 118.33 111.25 1we1 n VAL 96 Ca -0.00 -0.23 -0.21 0.00 -0.01 0.00 0.00 64.34 63.89 1we1 n VAL 96 Cb 0.53 -2.07 0.07 0.00 -0.91 0.00 0.00 33.84 31.46 1we1 n VAL 96 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 1we1 s LYS 97 N 5.09 2.14 -0.17 5.55 0.00 -1.26 -5.06 119.74 126.02 1we1 s LYS 97 Ca 0.97 -1.57 -0.08 0.00 0.00 0.00 0.00 55.97 55.30 1we1 s LYS 97 Cb -0.60 -2.58 0.07 0.00 0.00 0.00 0.00 37.83 34.72 1we1 s LYS 97 CO 0.46 -1.02 0.38 -1.50 0.00 0.00 0.00 175.35 173.67 1we1 s ILE 98 N -2.78 -0.26 0.66 3.79 -1.16 -1.26 -4.46 121.20 115.73 1we1 s ILE 98 Ca 0.63 0.14 -0.04 0.00 -0.51 0.00 0.00 60.65 60.88 1we1 s ILE 98 Cb -0.05 -0.59 0.06 0.00 0.61 0.00 0.00 42.46 42.49 1we1 s ILE 98 CO 0.40 0.06 0.94 -0.94 -2.81 0.00 0.00 174.94 172.59 1we1 s SER 99 N 1.87 4.89 0.18 4.50 1.04 -1.26 -4.87 113.70 120.05 1we1 s SER 99 Ca -0.06 0.21 -0.14 0.00 0.48 0.00 0.00 55.95 56.45 1we1 s SER 99 Cb -0.10 -0.91 0.16 0.00 0.10 0.00 0.00 66.02 65.27 1we1 s SER 99 CO -0.12 -1.49 1.72 0.00 0.98 0.00 0.00 173.24 174.33 1we1 h ALA 100 N -0.38 0.51 -0.65 5.32 0.00 -2.01 0.27 119.26 122.32 1we1 h ALA 100 Ca -0.43 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.52 1we1 h ALA 100 Cb 1.30 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 1we1 h ALA 100 CO 0.55 -0.31 0.20 0.00 0.00 0.00 0.00 179.25 179.68 1we1 h ALA 101 N 1.36 0.85 -0.26 0.00 0.00 -1.94 0.13 119.26 119.39 1we1 h ALA 101 Ca 0.23 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1we1 h ALA 101 Cb 0.30 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1we1 h ALA 101 CO -0.30 0.53 0.04 0.78 0.00 0.00 0.00 179.25 180.29 1we1 h GLY 102 N 0.94 0.41 1.50 0.00 0.00 -1.55 -1.27 103.07 103.10 1we1 h GLY 102 Ca 0.21 -0.21 -0.25 0.00 0.00 0.00 0.00 47.33 47.08 1we1 h GLY 102 CO -0.01 0.20 -1.06 -1.61 0.00 0.00 0.00 176.54 174.07 1we1 h GLN 103 N 0.38 0.43 -0.56 4.80 5.75 0.15 -2.51 115.11 123.55 1we1 h GLN 103 Ca 0.09 -0.52 0.01 0.00 -0.15 0.00 0.00 58.65 58.08 1we1 h GLN 103 Cb 0.20 0.16 -0.03 0.00 1.07 0.00 0.00 27.48 28.88 1we1 h GLN 103 CO 0.00 1.18 0.36 0.00 -2.65 0.00 0.00 178.83 177.73 1we1 h ALA 104 N 0.62 0.72 0.41 3.38 0.00 -0.29 -0.37 119.26 123.73 1we1 h ALA 104 Ca -0.11 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1we1 h ALA 104 Cb 1.72 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.29 1we1 h ALA 104 CO 0.19 0.12 -0.27 -0.92 0.00 0.00 0.00 179.25 178.36 1we1 h TYR 105 N 0.73 -0.72 -0.67 0.00 5.03 -1.21 -1.98 116.97 118.14 1we1 h TYR 105 Ca 0.21 -0.00 0.03 0.00 2.58 0.00 0.00 58.73 61.55 1we1 h TYR 105 Cb -0.05 0.26 -0.04 0.00 1.55 0.00 0.00 36.73 38.45 1we1 h TYR 105 CO -0.04 -0.42 0.42 0.28 -1.32 0.00 0.00 178.16 177.08 1we1 h VAL 106 N -0.66 1.09 -0.90 1.81 2.07 -1.24 -2.33 116.25 116.08 1we1 h VAL 106 Ca -0.04 -0.28 0.05 0.00 0.82 0.00 0.00 66.70 67.25 1we1 h VAL 106 Cb 0.56 0.19 -0.06 0.00 -1.52 0.00 0.00 31.29 30.46 1we1 h VAL 106 CO 0.03 0.15 0.57 0.44 0.02 0.00 0.00 177.57 178.78 1we1 h ASP 107 N 0.82 0.92 -0.56 0.57 3.45 -0.92 -0.97 116.42 119.74 1we1 h ASP 107 Ca 0.27 0.01 -0.05 0.00 0.43 0.00 0.00 57.03 57.69 1we1 h ASP 107 Cb 0.02 -0.19 -0.02 0.00 -0.56 0.00 0.00 39.33 38.58 1we1 h ASP 107 CO -0.11 0.60 0.15 -0.09 -1.57 0.00 0.00 179.24 178.23 1we1 h ARG 108 N 1.07 0.88 -0.32 3.56 9.65 -0.85 0.17 114.38 128.54 1we1 h ARG 108 Ca 0.38 -0.20 -0.00 0.00 -1.10 0.00 0.00 59.98 59.06 1we1 h ARG 108 Cb 0.11 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.55 1we1 h ARG 108 CO -0.15 0.81 0.20 0.28 2.80 0.00 0.00 179.97 183.90 1we1 h VAL 109 N 0.79 1.10 -0.49 0.20 2.07 -0.94 -0.85 116.25 118.12 1we1 h VAL 109 Ca 0.18 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.44 1we1 h VAL 109 Cb 0.31 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 1we1 h VAL 109 CO -0.00 0.10 0.19 0.03 0.02 0.00 0.00 177.57 177.91 1we1 h ARG 110 N 0.41 0.74 -0.62 1.57 2.47 -0.95 -2.12 114.38 115.89 1we1 h ARG 110 Ca 0.11 -0.14 0.02 0.00 -1.26 0.00 0.00 59.98 58.72 1we1 h ARG 110 Cb -0.00 -0.12 -0.04 0.00 -1.65 0.00 0.00 29.97 28.16 1we1 h ARG 110 CO -0.02 0.66 0.39 0.37 0.56 0.00 0.00 179.97 181.93 1we1 h GLN 111 N 0.66 0.75 0.00 0.04 4.15 -0.39 -2.24 115.11 118.07 1we1 h GLN 111 Ca 0.16 -0.04 -0.08 0.00 0.77 0.00 0.00 58.65 59.46 1we1 h GLN 111 Cb 0.20 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 27.71 1we1 h GLN 111 CO -0.01 0.49 -0.37 0.28 -1.93 0.00 0.00 178.83 177.30 1we1 h VAL 112 N 0.77 0.85 -0.08 2.39 2.07 -1.07 -2.18 116.25 119.00 1we1 h VAL 112 Ca 0.24 -1.51 -0.16 0.00 0.82 0.00 0.00 66.70 66.09 1we1 h VAL 112 Cb -0.01 1.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 1we1 h VAL 112 CO -0.09 0.36 -0.65 0.00 0.02 0.00 0.00 177.57 177.21 1we1 h ALA 113 N 1.63 0.74 0.05 1.67 0.00 -0.91 -1.35 119.26 121.10 1we1 h ALA 113 Ca -0.00 -0.57 -0.17 0.00 0.00 0.00 0.00 54.91 54.16 1we1 h ALA 113 Cb 0.91 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.64 1we1 h ALA 113 CO 0.05 0.75 -0.69 0.00 0.00 0.00 0.00 179.25 179.35 1we1 h ALA 114 N 1.09 0.02 0.00 0.00 0.00 -1.18 -3.38 119.26 115.80 1we1 h ALA 114 Ca -0.01 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1we1 h ALA 114 Cb 1.19 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1we1 h ALA 114 CO 0.11 0.37 -1.34 0.25 0.00 0.00 0.00 179.25 178.64 1we1 n THR 115 N -4.17 0.00 -2.73 0.00 -2.24 -0.84 -4.87 114.28 99.43 1we1 n THR 115 Ca -0.12 -0.28 -0.07 0.00 -2.27 0.00 0.00 64.05 61.32 1we1 n THR 115 Cb 0.73 0.45 0.05 0.00 -2.10 0.00 0.00 70.33 69.47 1we1 n THR 115 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1we1 n ALA 116 N -1.79 -2.03 0.22 6.98 0.00 -0.72 -5.02 120.51 118.14 1we1 n ALA 116 Ca -0.01 -1.07 0.10 0.00 0.00 0.00 0.00 53.44 52.47 1we1 n ALA 116 Cb 0.34 -1.85 0.54 0.00 0.00 0.00 0.00 19.45 18.48 1we1 n ALA 116 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1we1 h PRO 117 N 3.91 0.00 0.00 0.00 0.13 -1.46 -1.39 132.00 133.19 1we1 h PRO 117 Ca -0.14 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.89 1we1 h PRO 117 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1we1 h PRO 117 CO 0.17 0.00 -0.46 1.05 -0.23 0.00 0.00 178.00 178.53 1we1 h GLU 118 N 0.00 0.00 0.00 0.86 9.09 -1.96 -1.83 114.58 120.74 1we1 h GLU 118 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1we1 h GLU 118 Cb 0.52 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.62 1we1 h GLU 118 CO 0.00 0.46 0.00 1.28 0.05 0.00 0.00 179.01 180.80 1we1 n LEU 119 N -3.78 0.00 0.23 3.06 4.77 -0.52 -1.84 117.00 118.91 1we1 n LEU 119 Ca -0.01 0.25 0.15 0.00 -0.03 0.00 0.00 56.01 56.38 1we1 n LEU 119 Cb 0.51 -0.25 0.59 0.00 -2.33 0.00 0.00 43.42 41.94 1we1 n LEU 119 CO 0.39 -0.13 0.94 0.25 -1.33 0.00 0.00 177.39 177.51 1we1 h LEU 120 N 0.00 0.00 -1.30 2.23 5.85 -1.50 -1.88 115.31 118.70 1we1 h LEU 120 Ca 0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1we1 h LEU 120 Cb 0.12 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 1we1 h LEU 120 CO 0.00 0.00 -0.11 -0.37 -0.34 0.00 0.00 178.44 177.62 1we1 h VAL 121 N 0.00 0.28 -0.11 1.05 -1.51 -1.56 -1.31 116.25 113.09 1we1 h VAL 121 Ca 0.00 -0.80 -0.21 0.00 -1.23 0.00 0.00 66.70 64.46 1we1 h VAL 121 Cb 0.50 1.63 0.01 0.00 -2.13 0.00 0.00 31.29 31.29 1we1 h VAL 121 CO 0.00 0.11 -0.79 0.00 -1.23 0.00 0.00 177.57 175.66 1we1 h ALA 122 N 1.89 0.40 -0.02 5.19 0.00 -1.55 -2.11 119.26 123.06 1we1 h ALA 122 Ca -0.00 -0.62 -0.16 0.00 0.00 0.00 0.00 54.91 54.14 1we1 h ALA 122 Cb 0.62 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1we1 h ALA 122 CO 0.01 0.72 -0.70 0.45 0.00 0.00 0.00 179.25 179.73 1we1 h HIS 123 N 0.42 0.18 -0.07 0.00 -0.00 -1.49 -1.23 115.15 112.95 1we1 h HIS 123 Ca -0.05 -0.08 -0.16 0.00 -0.00 0.00 0.00 60.37 60.08 1we1 h HIS 123 Cb 1.40 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 28.78 1we1 h HIS 123 CO 0.07 0.79 -0.65 1.03 -0.00 0.00 0.00 177.93 179.17 1we1 h SER 124 N 0.09 0.32 0.06 2.45 0.87 -1.22 -2.88 113.55 113.25 1we1 h SER 124 Ca -0.02 -0.20 -0.00 0.00 -1.23 0.00 0.00 61.79 60.35 1we1 h SER 124 Cb 1.24 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 1we1 h SER 124 CO 0.10 0.88 -0.03 0.22 -0.53 0.00 0.00 176.83 177.47 1we1 h TYR 125 N 0.20 -0.08 -0.35 2.24 3.20 -1.24 -2.26 116.97 118.68 1we1 h TYR 125 Ca -0.01 -0.00 0.07 0.00 3.14 0.00 0.00 58.73 61.92 1we1 h TYR 125 Cb 1.18 0.03 -0.06 0.00 1.54 0.00 0.00 36.73 39.41 1we1 h TYR 125 CO 0.03 0.48 -0.05 1.15 -1.64 0.00 0.00 178.16 178.13 1we1 h THR 126 N -0.71 0.68 0.01 1.81 2.02 -1.28 -2.64 112.91 112.80 1we1 h THR 126 Ca -0.01 -0.01 -0.00 0.00 0.77 0.00 0.00 66.41 67.16 1we1 h THR 126 Cb 0.59 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 1we1 h THR 126 CO 0.01 0.01 -0.00 0.03 0.37 0.00 0.00 175.52 175.94 1we1 h ARG 127 N 0.04 -0.01 0.00 6.66 2.47 -1.62 -3.32 114.38 118.60 1we1 h ARG 127 Ca 0.17 0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.90 1we1 h ARG 127 Cb 0.25 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.57 1we1 h ARG 127 CO -0.33 -0.01 -0.03 1.88 0.56 0.00 0.00 179.97 182.04 1we1 h TYR 128 N -0.20 -0.08 0.00 3.04 0.05 -1.53 0.20 116.97 118.45 1we1 h TYR 128 Ca -0.00 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 58.72 1we1 h TYR 128 Cb 0.01 0.04 -0.01 0.00 1.01 0.00 0.00 36.73 37.78 1we1 h TYR 128 CO 0.01 -0.05 -0.28 1.25 -1.05 0.00 0.00 178.16 178.03 1we1 h LEU 129 N -0.06 0.00 -0.35 3.88 5.85 -1.51 -0.72 115.31 122.41 1we1 h LEU 129 Ca 0.01 0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.56 1we1 h LEU 129 Cb 0.08 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 1we1 h LEU 129 CO -0.04 0.28 -0.48 1.23 -0.34 0.00 0.00 178.44 179.09 1we1 h GLY 130 N 0.84 0.98 1.16 3.75 0.00 -1.45 -2.60 103.07 105.76 1we1 h GLY 130 Ca -0.00 -1.08 -0.09 0.00 0.00 0.00 0.00 47.33 46.15 1we1 h GLY 130 CO 0.04 0.97 0.02 -0.55 0.00 0.00 0.00 176.54 177.02 1we1 h ASP 131 N 0.71 0.99 0.95 0.19 3.32 -0.01 -1.26 116.42 121.30 1we1 h ASP 131 Ca 0.03 -0.26 -0.04 0.00 0.02 0.00 0.00 57.03 56.78 1we1 h ASP 131 Cb 1.08 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.36 1we1 h ASP 131 CO 0.11 1.03 -0.20 0.25 -1.72 0.00 0.00 179.24 178.70 1we1 h LEU 132 N 0.94 0.00 0.00 1.55 5.85 -1.11 -1.37 115.31 121.17 1we1 h LEU 132 Ca 0.17 0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.69 1we1 h LEU 132 Cb 0.51 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 1we1 h LEU 132 CO 0.02 0.20 -1.27 -1.20 -0.34 0.00 0.00 178.44 175.86 1we1 n SER 133 N -3.36 1.87 0.10 1.25 7.64 -0.98 -4.35 113.62 115.78 1we1 n SER 133 Ca 0.00 0.46 0.13 0.00 1.01 0.00 0.00 58.87 60.47 1we1 n SER 133 Cb 0.42 -0.90 0.38 0.00 -1.01 0.00 0.00 64.21 63.10 1we1 n SER 133 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1we1 n GLY 134 N 1.45 -1.67 0.00 0.23 0.00 -0.50 -4.61 105.19 100.09 1we1 n GLY 134 Ca -0.29 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.68 1we1 n GLY 134 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1we1 n GLY 135 N 1.32 -0.03 0.32 -0.02 0.00 -0.51 -1.30 105.19 104.96 1we1 n GLY 135 Ca 0.05 0.01 0.15 0.00 0.00 0.00 0.00 46.02 46.23 1we1 n GLY 135 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1we1 h GLN 136 N 0.00 0.00 -0.03 1.61 1.08 -1.82 -2.00 115.11 113.94 1we1 h GLN 136 Ca 0.00 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 1we1 h GLN 136 Cb 0.00 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.43 1we1 h GLN 136 CO 0.00 0.00 -0.05 0.82 -0.95 0.00 0.00 178.83 178.65 1we1 h ILE 137 N 0.00 1.42 -0.59 2.54 2.04 -1.50 -2.67 117.51 118.75 1we1 h ILE 137 Ca 0.08 -1.32 -0.03 0.00 1.00 0.00 0.00 64.86 64.59 1we1 h ILE 137 Cb 0.37 2.22 -0.03 0.00 -0.74 0.00 0.00 36.82 38.65 1we1 h ILE 137 CO -0.00 0.35 0.23 -0.07 0.00 0.00 0.00 178.15 178.66 1we1 h LEU 138 N -0.41 0.78 0.39 1.44 3.38 -1.04 -2.11 115.31 117.74 1we1 h LEU 138 Ca 0.00 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1we1 h LEU 138 Cb 0.60 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1we1 h LEU 138 CO 0.01 0.71 -0.36 0.50 0.09 0.00 0.00 178.44 179.39 1we1 h LYS 139 N 0.84 -0.74 -0.48 1.13 3.64 -1.36 -1.03 116.57 118.58 1we1 h LYS 139 Ca 0.20 0.05 0.06 0.00 -1.27 0.00 0.00 60.65 59.69 1we1 h LYS 139 Cb 0.18 0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 32.11 1we1 h LYS 139 CO -0.02 -0.50 0.18 0.87 -2.27 0.00 0.00 179.45 177.72 1we1 h LYS 140 N -0.77 0.35 -0.39 1.90 1.57 -1.24 0.16 116.57 118.15 1we1 h LYS 140 Ca -0.03 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1we1 h LYS 140 Cb 0.68 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.89 1we1 h LYS 140 CO -0.05 0.23 0.23 0.82 -0.57 0.00 0.00 179.45 180.12 1we1 h ILE 141 N 0.36 1.04 -0.06 1.86 2.04 -1.28 -1.39 117.51 120.08 1we1 h ILE 141 Ca 0.23 -0.16 0.01 0.00 1.00 0.00 0.00 64.86 65.93 1we1 h ILE 141 Cb 0.22 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1we1 h ILE 141 CO -0.22 0.09 -0.00 0.00 0.00 0.00 0.00 178.15 178.01 1we1 h ALA 142 N 1.17 0.05 -0.97 1.87 0.00 -0.37 -0.70 119.26 120.31 1we1 h ALA 142 Ca 0.15 0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.15 1we1 h ALA 142 Cb 0.00 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.75 1we1 h ALA 142 CO -0.07 -0.48 0.62 1.96 0.00 0.00 0.00 179.25 181.28 1we1 h GLN 143 N 0.02 1.07 0.16 0.00 4.20 -0.41 -1.27 115.11 118.88 1we1 h GLN 143 Ca 0.03 -0.06 -0.31 0.00 0.06 0.00 0.00 58.65 58.36 1we1 h GLN 143 Cb 0.03 -0.24 0.03 0.00 0.30 0.00 0.00 27.48 27.60 1we1 h GLN 143 CO -0.05 0.70 -1.32 -0.91 -0.67 0.00 0.00 178.83 176.58 1we1 h ASN 144 N 1.10 0.86 -0.28 1.46 4.21 -1.09 0.42 115.58 122.27 1we1 h ASN 144 Ca 0.43 -0.84 -0.15 0.00 1.21 0.00 0.00 56.30 56.95 1we1 h ASN 144 Cb 0.21 -0.27 -0.01 0.00 -1.12 0.00 0.00 38.32 37.13 1we1 h ASN 144 CO -0.19 1.64 -0.40 0.00 -1.29 0.00 0.00 177.43 177.19 1we1 h ALA 145 N 0.26 0.65 -0.69 -0.83 0.00 -0.97 -3.15 119.26 114.53 1we1 h ALA 145 Ca -0.21 -0.45 -0.22 0.00 0.00 0.00 0.00 54.91 54.02 1we1 h ALA 145 Cb 2.00 -0.12 -0.13 0.00 0.00 0.00 0.00 17.79 19.54 1we1 h ALA 145 CO 0.25 0.67 0.26 -1.33 0.00 0.00 0.00 179.25 179.10 1we1 n MET 146 N -4.05 3.37 -4.30 0.00 2.81 -0.49 -4.77 117.12 109.69 1we1 n MET 146 Ca -0.02 -3.08 -0.34 0.00 -1.81 0.00 0.00 57.70 52.45 1we1 n MET 146 Cb 0.54 -2.15 -0.07 0.00 -0.71 0.00 0.00 33.22 30.83 1we1 n MET 146 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1we1 n ASN 147 N -0.36 -0.70 -4.54 7.83 4.05 -1.14 -4.88 115.26 115.51 1we1 n ASN 147 Ca 0.41 -1.18 -0.36 0.00 0.45 0.00 0.00 54.58 53.90 1we1 n ASN 147 Cb 1.35 -2.05 -0.11 0.00 1.23 0.00 0.00 39.78 40.20 1we1 n ASN 147 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 177.26 173.99 1we1 s LEU 148 N -7.26 3.65 0.00 1.20 2.96 0.15 -5.03 118.68 114.35 1we1 s LEU 148 Ca 0.34 -0.06 0.00 0.00 -0.22 0.00 0.00 54.13 54.19 1we1 s LEU 148 Cb -0.20 -1.95 0.00 0.00 0.50 0.00 0.00 46.19 44.54 1we1 s LEU 148 CO 0.98 0.07 0.00 0.00 -1.32 0.00 0.00 176.35 176.07 1we1 n HIS 149 N 4.24 0.00 -2.82 5.38 1.44 -1.26 -4.43 115.22 117.77 1we1 n HIS 149 Ca -0.16 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.13 1we1 n HIS 149 Cb 0.52 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.59 1we1 n HIS 149 CO 0.00 0.00 0.00 0.16 -2.81 0.00 0.00 176.34 173.69 1we1 s ASP 150 N -0.87 7.15 0.00 4.39 -4.77 -1.26 -4.85 116.67 116.47 1we1 s ASP 150 Ca 0.00 1.41 0.00 0.00 -3.30 0.00 0.00 52.55 50.66 1we1 s ASP 150 Cb 0.00 -2.50 0.00 0.00 -1.09 0.00 0.00 42.92 39.33 1we1 s ASP 150 CO 0.00 -0.31 0.00 0.61 0.70 0.00 0.00 175.17 176.17 1we1 n GLY 151 N 3.13 3.93 2.13 2.12 0.00 -1.26 -4.99 105.19 110.25 1we1 n GLY 151 Ca 0.05 -1.27 -0.06 0.00 0.00 0.00 0.00 46.02 44.74 1we1 n GLY 151 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1we1 n GLY 152 N 0.00 0.32 0.00 -0.02 0.00 -1.26 -4.88 105.19 99.35 1we1 n GLY 152 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.34 1we1 n GLY 152 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1we1 n THR 153 N -3.68 0.00 -0.34 2.61 -1.04 -1.26 -4.90 114.28 105.67 1we1 n THR 153 Ca -0.07 -0.01 0.18 0.00 -2.04 0.00 0.00 64.05 62.12 1we1 n THR 153 Cb 0.45 1.56 0.40 0.00 -1.82 0.00 0.00 70.33 70.92 1we1 n THR 153 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1we1 h ALA 154 N 0.00 1.82 -1.24 2.41 0.00 -1.90 -1.89 119.26 118.46 1we1 h ALA 154 Ca 0.00 0.13 0.37 0.00 0.00 0.00 0.00 54.91 55.41 1we1 h ALA 154 Cb 0.28 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.00 1we1 h ALA 154 CO 0.00 -0.31 0.82 0.35 0.00 0.00 0.00 179.25 180.11 1we1 h PHE 155 N 0.55 0.47 -0.00 0.00 -0.00 -1.91 0.56 116.94 116.61 1we1 h PHE 155 Ca 0.65 0.02 0.00 0.00 -0.00 0.00 0.00 57.97 58.64 1we1 h PHE 155 Cb 1.28 -0.13 0.00 0.00 -0.00 0.00 0.00 35.95 37.10 1we1 h PHE 155 CO -0.01 -0.07 -0.42 0.66 -0.00 0.00 0.00 178.31 178.46 1we1 n TYR 156 N -4.56 0.00 -3.75 0.41 4.01 -0.71 -4.85 117.16 107.71 1we1 n TYR 156 Ca 0.32 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.71 1we1 n TYR 156 Cb 1.25 -0.27 -0.09 0.00 -0.31 0.00 0.00 39.34 39.92 1we1 n TYR 156 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1we1 s GLU 157 N -2.97 4.13 -0.58 -0.72 2.02 0.19 -4.65 118.70 116.12 1we1 s GLU 157 Ca 0.12 -0.25 -0.07 0.00 0.02 0.00 0.00 54.97 54.79 1we1 s GLU 157 Cb 0.18 -3.42 0.15 0.00 0.10 0.00 0.00 34.13 31.14 1we1 s GLU 157 CO 0.67 0.24 0.44 -0.06 0.02 0.00 0.00 175.26 176.57 1we1 s PHE 158 N 0.52 3.49 0.08 1.61 0.40 -1.26 -4.97 117.98 117.85 1we1 s PHE 158 Ca 0.07 -2.21 -0.35 0.00 -0.60 0.00 0.00 56.93 53.83 1we1 s PHE 158 Cb -0.12 -3.44 -0.17 0.00 0.51 0.00 0.00 43.02 39.80 1we1 s PHE 158 CO -0.00 -0.94 1.55 0.00 0.70 0.00 0.00 175.22 176.52 1we1 h ALA 159 N 7.84 -1.18 0.00 5.36 0.00 -1.94 -2.92 119.26 126.41 1we1 h ALA 159 Ca -0.09 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1we1 h ALA 159 Cb 1.03 0.69 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1we1 h ALA 159 CO 0.78 -1.19 0.00 -0.25 0.00 0.00 0.00 179.25 178.59 1we1 n ASP 160 N -5.48 0.00 -4.07 0.00 9.92 -1.26 -4.46 116.55 111.20 1we1 n ASP 160 Ca -0.13 -0.99 -0.33 0.00 -0.53 0.00 0.00 54.79 52.81 1we1 n ASP 160 Cb 0.47 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.81 1we1 n ASP 160 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1we1 s ILE 161 N -2.00 2.75 0.00 0.53 1.01 -1.11 -4.99 121.20 117.39 1we1 s ILE 161 Ca 0.04 -2.21 0.00 0.00 0.00 0.00 0.00 60.65 58.48 1we1 s ILE 161 Cb 0.02 -2.95 0.00 0.00 0.01 0.00 0.00 42.46 39.54 1we1 s ILE 161 CO 0.03 -0.64 0.87 0.47 0.00 0.00 0.00 174.94 175.67 1we1 n ASP 162 N 4.41 0.00 -4.38 3.58 10.43 -1.26 -4.40 116.55 124.93 1we1 n ASP 162 Ca 0.01 0.89 -0.45 0.00 2.57 0.00 0.00 54.79 57.82 1we1 n ASP 162 Cb 0.42 -0.42 -0.07 0.00 1.84 0.00 0.00 41.12 42.89 1we1 n ASP 162 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1we1 s ASP 163 N -2.04 6.17 0.46 -2.24 -1.08 -1.26 -4.92 116.67 111.76 1we1 s ASP 163 Ca 0.00 -1.39 0.26 0.00 -0.52 0.00 0.00 52.55 50.90 1we1 s ASP 163 Cb 0.00 -2.22 0.91 0.00 -1.46 0.00 0.00 42.92 40.16 1we1 s ASP 163 CO 0.00 -0.77 1.82 -0.33 0.52 0.00 0.00 175.17 176.40 1we1 h GLU 164 N 8.86 0.00 0.07 4.34 5.08 -1.99 -2.51 114.58 128.43 1we1 h GLU 164 Ca -0.29 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 57.79 1we1 h GLU 164 Cb 1.10 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.38 1we1 h GLU 164 CO 0.95 0.17 -1.15 0.87 -1.00 0.00 0.00 179.01 178.85 1we1 h LYS 165 N 0.00 0.63 -0.37 2.33 1.79 -1.96 -2.02 116.57 116.97 1we1 h LYS 165 Ca -0.00 -0.77 -0.15 0.00 -2.18 0.00 0.00 60.65 57.55 1we1 h LYS 165 Cb 0.76 0.24 -0.01 0.00 -1.58 0.00 0.00 32.23 31.64 1we1 h LYS 165 CO 0.02 1.34 -0.36 0.00 -1.08 0.00 0.00 179.45 179.37 1we1 h ALA 166 N 0.38 0.66 -0.94 3.86 0.00 -1.98 -2.91 119.26 118.32 1we1 h ALA 166 Ca -0.16 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 1we1 h ALA 166 Cb 1.81 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 19.43 1we1 h ALA 166 CO 0.22 0.67 0.56 0.35 0.00 0.00 0.00 179.25 181.05 1we1 h PHE 167 N 0.71 1.24 -0.84 0.00 3.57 -1.43 -0.55 116.94 119.65 1we1 h PHE 167 Ca 0.06 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.59 1we1 h PHE 167 Cb 0.93 -0.41 -0.05 0.00 2.79 0.00 0.00 35.95 39.22 1we1 h PHE 167 CO 0.05 0.83 0.55 0.87 -2.23 0.00 0.00 178.31 178.39 1we1 h LYS 168 N 1.30 1.02 -0.46 1.11 1.57 -1.18 0.16 116.57 120.09 1we1 h LYS 168 Ca 0.34 -0.06 -0.12 0.00 -1.87 0.00 0.00 60.65 58.93 1we1 h LYS 168 Cb -0.04 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.02 1we1 h LYS 168 CO -0.06 0.68 -0.18 -0.91 -0.57 0.00 0.00 179.45 178.41 1we1 h ASN 169 N 1.05 0.96 -0.49 0.86 2.35 -1.10 0.28 115.58 119.49 1we1 h ASN 169 Ca 0.33 -0.39 -0.01 0.00 -0.55 0.00 0.00 56.30 55.68 1we1 h ASN 169 Cb 0.01 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.09 1we1 h ASN 169 CO -0.09 1.13 0.27 0.74 -1.65 0.00 0.00 177.43 177.83 1we1 h THR 170 N 0.78 1.17 -0.47 2.81 2.02 -0.09 -1.83 112.91 117.30 1we1 h THR 170 Ca 0.11 -0.44 -0.08 0.00 0.77 0.00 0.00 66.41 66.77 1we1 h THR 170 Cb 0.75 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 1we1 h THR 170 CO 0.06 0.18 -0.01 0.22 0.37 0.00 0.00 175.52 176.35 1we1 h TYR 171 N 0.65 0.92 -0.54 3.16 5.03 -0.50 -0.19 116.97 125.51 1we1 h TYR 171 Ca 0.17 -0.16 -0.10 0.00 2.58 0.00 0.00 58.73 61.22 1we1 h TYR 171 Cb 0.05 -0.24 -0.02 0.00 1.55 0.00 0.00 36.73 38.08 1we1 h TYR 171 CO -0.02 0.88 -0.07 0.00 -1.32 0.00 0.00 178.16 177.64 1we1 h ARG 172 N 0.70 0.98 -0.65 1.82 3.08 -0.87 -2.34 114.38 117.09 1we1 h ARG 172 Ca 0.13 -0.33 -0.07 0.00 0.07 0.00 0.00 59.98 59.79 1we1 h ARG 172 Cb 0.52 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 1we1 h ARG 172 CO 0.03 1.00 0.15 0.37 -1.07 0.00 0.00 179.97 180.45 1we1 h GLN 173 N 0.88 1.06 -0.98 0.04 5.75 -1.17 -0.53 115.11 120.17 1we1 h GLN 173 Ca 0.15 -0.26 0.11 0.00 -0.15 0.00 0.00 58.65 58.50 1we1 h GLN 173 Cb 0.61 -0.14 -0.08 0.00 1.07 0.00 0.00 27.48 28.94 1we1 h GLN 173 CO 0.04 0.95 0.62 0.00 -2.65 0.00 0.00 178.83 177.79 1we1 h ALA 174 N 1.06 1.56 -0.38 3.38 0.00 -0.74 -0.24 119.26 123.89 1we1 h ALA 174 Ca 0.20 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.99 1we1 h ALA 174 Cb 0.38 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1we1 h ALA 174 CO 0.00 0.21 -0.28 0.52 0.00 0.00 0.00 179.25 179.71 1we1 h MET 175 N 0.97 0.87 0.00 0.00 2.86 -0.75 -2.87 114.93 116.01 1we1 h MET 175 Ca 0.47 -0.42 -0.03 0.00 -2.06 0.00 0.00 59.70 57.66 1we1 h MET 175 Cb 0.47 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.12 1we1 h MET 175 CO -0.24 1.07 -0.13 -0.91 1.06 0.00 0.00 176.91 177.76 1we1 h ASN 176 N 0.68 0.00 -0.28 1.22 2.35 0.20 -2.48 115.58 117.26 1we1 h ASN 176 Ca 0.07 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1we1 h ASN 176 Cb 0.86 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.23 1we1 h ASN 176 CO 0.08 0.13 0.00 0.47 -1.65 0.00 0.00 177.43 176.46 1we1 n ASP 177 N -3.46 2.66 -4.73 5.81 8.00 -0.23 -4.19 116.55 120.41 1we1 n ASP 177 Ca -0.01 -1.87 -0.42 0.00 0.71 0.00 0.00 54.79 53.20 1we1 n ASP 177 Cb 0.29 -0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 41.19 1we1 n ASP 177 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1we1 s LEU 178 N -1.54 4.36 -1.30 0.64 1.02 -0.94 -4.88 118.68 116.05 1we1 s LEU 178 Ca 0.35 2.86 -0.17 0.00 0.02 0.00 0.00 54.13 57.20 1we1 s LEU 178 Cb 0.20 -3.61 0.09 0.00 0.02 0.00 0.00 46.19 42.89 1we1 s LEU 178 CO 0.29 -0.94 1.74 -0.81 0.02 0.00 0.00 176.35 176.66 1we1 n PRO 179 N 3.41 3.21 -4.13 1.29 -0.04 -1.26 -4.31 135.00 133.16 1we1 n PRO 179 Ca 0.13 -3.32 -0.09 0.00 -0.04 0.00 0.00 63.50 60.19 1we1 n PRO 179 Cb 0.36 -3.38 -0.10 0.00 -0.04 0.00 0.00 33.50 30.35 1we1 n PRO 179 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1we1 s ILE 180 N 3.51 0.23 0.36 0.52 -4.36 -1.26 -4.99 121.20 115.21 1we1 s ILE 180 Ca 0.51 -1.87 0.02 0.00 -0.26 0.00 0.00 60.65 59.05 1we1 s ILE 180 Cb 0.04 -1.77 -0.02 0.00 1.25 0.00 0.00 42.46 41.96 1we1 s ILE 180 CO 0.05 -0.76 0.54 1.51 0.24 0.00 0.00 174.94 176.52 1we1 s ASP 181 N -2.99 6.11 0.41 4.36 1.47 -1.26 -4.07 116.67 120.70 1we1 s ASP 181 Ca 0.15 0.23 0.18 0.00 1.18 0.00 0.00 52.55 54.29 1we1 s ASP 181 Cb 0.07 -1.72 1.10 0.00 -0.34 0.00 0.00 42.92 42.03 1we1 s ASP 181 CO -0.04 -0.40 1.82 -0.61 0.68 0.00 0.00 175.17 176.62 1we1 h GLN 182 N 0.74 0.39 -0.86 2.11 5.75 -1.98 -1.23 115.11 120.02 1we1 h GLN 182 Ca -0.48 -0.02 0.01 0.00 -0.15 0.00 0.00 58.65 58.01 1we1 h GLN 182 Cb 1.24 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 29.66 1we1 h GLN 182 CO 0.59 0.26 0.57 0.00 -2.65 0.00 0.00 178.83 177.59 1we1 h ALA 183 N 1.60 1.10 0.00 3.38 0.00 -2.00 -0.64 119.26 122.70 1we1 h ALA 183 Ca 0.52 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 55.24 1we1 h ALA 183 Cb 1.32 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 1we1 h ALA 183 CO -0.22 0.48 -0.64 1.79 0.00 0.00 0.00 179.25 180.66 1we1 h THR 184 N 1.15 1.08 -0.72 0.00 1.35 -1.65 -3.02 112.91 111.11 1we1 h THR 184 Ca 0.32 -2.53 -0.00 0.00 -0.55 0.00 0.00 66.41 63.64 1we1 h THR 184 Cb -0.11 2.53 -0.03 0.00 -1.73 0.00 0.00 68.15 68.80 1we1 h THR 184 CO -0.08 0.62 0.44 0.00 -0.25 0.00 0.00 175.52 176.25 1we1 h ALA 185 N 1.37 0.92 0.00 6.62 0.00 -0.49 -0.56 119.26 127.11 1we1 h ALA 185 Ca -0.01 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 1we1 h ALA 185 Cb 1.49 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1we1 h ALA 185 CO 0.08 0.38 -0.31 0.93 0.00 0.00 0.00 179.25 180.34 1we1 h GLU 186 N 0.98 0.00 -0.03 0.00 5.08 -1.10 -1.45 114.58 118.06 1we1 h GLU 186 Ca 0.26 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.43 1we1 h GLU 186 Cb -0.04 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1we1 h GLU 186 CO -0.05 0.31 -0.79 0.00 -1.00 0.00 0.00 179.01 177.48 1we1 h ARG 187 N 0.00 0.27 -0.22 2.33 3.08 -1.20 -2.42 114.38 116.23 1we1 h ARG 187 Ca -0.00 -0.25 -0.17 0.00 0.07 0.00 0.00 59.98 59.62 1we1 h ARG 187 Cb 0.71 0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.82 1we1 h ARG 187 CO 0.04 0.93 -0.56 0.82 -1.07 0.00 0.00 179.97 180.12 1we1 h ILE 188 N 0.17 1.30 -0.53 2.04 2.04 -0.55 -2.18 117.51 119.81 1we1 h ILE 188 Ca -0.04 -1.79 -0.09 0.00 1.00 0.00 0.00 64.86 63.94 1we1 h ILE 188 Cb 1.38 1.74 -0.02 0.00 -0.74 0.00 0.00 36.82 39.18 1we1 h ILE 188 CO 0.13 0.57 -0.03 0.58 0.00 0.00 0.00 178.15 179.39 1we1 h VAL 189 N 0.51 1.27 -0.68 1.67 2.07 -1.25 -0.89 116.25 118.94 1we1 h VAL 189 Ca 0.01 -1.15 -0.05 0.00 0.82 0.00 0.00 66.70 66.33 1we1 h VAL 189 Cb 1.14 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 31.82 1we1 h VAL 189 CO 0.11 0.41 0.25 -0.78 0.02 0.00 0.00 177.57 177.58 1we1 h ASP 190 N 0.83 0.97 -0.60 0.57 3.58 -1.38 -1.86 116.42 118.53 1we1 h ASP 190 Ca 0.15 -0.19 -0.05 0.00 0.42 0.00 0.00 57.03 57.36 1we1 h ASP 190 Cb 0.57 -0.25 -0.03 0.00 1.72 0.00 0.00 39.33 41.34 1we1 h ASP 190 CO 0.03 0.89 0.18 -0.08 -2.88 0.00 0.00 179.24 177.39 1we1 h GLU 191 N 0.98 0.98 -0.74 0.28 4.57 -1.18 -1.95 114.58 117.52 1we1 h GLU 191 Ca 0.22 -0.20 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 1we1 h GLU 191 Cb 0.25 -0.15 -0.04 0.00 -0.16 0.00 0.00 28.75 28.66 1we1 h GLU 191 CO -0.01 0.85 0.43 0.00 -1.18 0.00 0.00 179.01 179.09 1we1 h ALA 192 N 1.26 0.94 0.00 2.92 0.00 -0.63 -1.38 119.26 122.36 1we1 h ALA 192 Ca 0.21 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1we1 h ALA 192 Cb 0.29 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1we1 h ALA 192 CO -0.01 0.43 -0.13 -0.91 0.00 0.00 0.00 179.25 178.64 1we1 h ASN 193 N 1.01 0.00 0.57 0.00 2.35 -0.61 -1.85 115.58 117.05 1we1 h ASN 193 Ca 0.26 0.00 -0.27 0.00 -0.55 0.00 0.00 56.30 55.74 1we1 h ASN 193 Cb -0.00 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.37 1we1 h ASN 193 CO -0.05 0.13 -1.22 0.44 -1.65 0.00 0.00 177.43 175.08 1we1 h ASP 194 N 0.00 0.47 -0.50 5.81 3.32 -0.84 -2.84 116.42 121.83 1we1 h ASP 194 Ca -0.00 -0.48 -0.00 0.00 0.02 0.00 0.00 57.03 56.57 1we1 h ASP 194 Cb 0.36 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 1we1 h ASP 194 CO 0.02 1.36 0.31 0.00 -1.72 0.00 0.00 179.24 179.21 1we1 h ALA 195 N 0.57 0.64 -0.71 3.45 0.00 -0.50 0.59 119.26 123.30 1we1 h ALA 195 Ca -0.14 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1we1 h ALA 195 Cb 1.94 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 19.49 1we1 h ALA 195 CO 0.20 0.12 0.46 0.74 0.00 0.00 0.00 179.25 180.78 1we1 h PHE 196 N 0.67 0.91 -0.18 0.00 -1.00 -1.44 -0.86 116.94 115.04 1we1 h PHE 196 Ca 0.18 0.02 -0.10 0.00 2.81 0.00 0.00 57.97 60.87 1we1 h PHE 196 Cb -0.02 -0.31 -0.01 0.00 3.61 0.00 0.00 35.95 39.22 1we1 h PHE 196 CO -0.03 0.58 -0.34 0.00 -1.61 0.00 0.00 178.31 176.92 1we1 h ALA 197 N 1.54 1.09 -0.14 2.45 0.00 -1.02 -1.79 119.26 121.39 1we1 h ALA 197 Ca 0.26 -0.38 -0.17 0.00 0.00 0.00 0.00 54.91 54.62 1we1 h ALA 197 Cb -0.09 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1we1 h ALA 197 CO -0.05 0.57 -0.63 0.52 0.00 0.00 0.00 179.25 179.66 1we1 h MET 198 N 0.32 0.50 -0.53 0.00 2.86 0.37 -1.91 114.93 116.54 1we1 h MET 198 Ca 0.04 -0.35 -0.08 0.00 -2.06 0.00 0.00 59.70 57.24 1we1 h MET 198 Cb 0.75 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.45 1we1 h MET 198 CO 0.06 0.97 0.02 -0.91 1.06 0.00 0.00 176.91 178.11 1we1 h ASN 199 N 0.37 0.90 -0.78 1.22 2.35 -1.02 -2.76 115.58 115.86 1we1 h ASN 199 Ca -0.01 -0.30 -0.01 0.00 -0.55 0.00 0.00 56.30 55.43 1we1 h ASN 199 Cb 1.19 -0.24 -0.04 0.00 0.05 0.00 0.00 38.32 39.28 1we1 h ASN 199 CO 0.11 0.98 0.45 0.24 -1.65 0.00 0.00 177.43 177.56 1we1 h MET 200 N 0.80 1.09 -0.14 0.81 2.86 -1.16 -1.06 114.93 118.13 1we1 h MET 200 Ca 0.15 -0.11 -0.04 0.00 -2.06 0.00 0.00 59.70 57.64 1we1 h MET 200 Cb 0.50 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 1we1 h MET 200 CO 0.02 0.78 -0.09 0.87 1.06 0.00 0.00 176.91 179.55 1we1 h LYS 201 N 1.10 0.22 -0.02 1.72 1.57 -1.15 -1.48 116.57 118.53 1we1 h LYS 201 Ca 0.28 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 59.01 1we1 h LYS 201 Cb -0.00 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.27 1we1 h LYS 201 CO -0.05 0.33 -0.01 0.52 -0.57 0.00 0.00 179.45 179.67 1we1 h MET 202 N 0.21 0.05 -0.08 3.15 2.86 -0.93 -2.90 114.93 117.29 1we1 h MET 202 Ca 0.05 -0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.70 1we1 h MET 202 Cb 0.31 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.92 1we1 h MET 202 CO 0.02 0.42 -0.15 0.74 1.06 0.00 0.00 176.91 179.00 1we1 h PHE 203 N -0.33 -0.37 0.00 -0.22 0.04 -1.01 -1.35 116.94 113.70 1we1 h PHE 203 Ca 0.01 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.79 1we1 h PHE 203 Cb 0.41 0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.73 1we1 h PHE 203 CO 0.06 -0.21 0.02 -0.91 -0.60 0.00 0.00 178.31 176.66 1we1 h ASN 204 N -0.20 0.00 0.79 2.17 2.35 -1.31 0.27 115.58 119.64 1we1 h ASN 204 Ca 0.08 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.68 1we1 h ASN 204 Cb 0.31 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.66 1we1 h ASN 204 CO -0.20 0.00 -0.67 -0.33 -1.65 0.00 0.00 177.43 174.58 1we1 h GLU 205 N 0.00 0.00 -0.00 0.81 5.08 -1.02 -3.10 114.58 116.35 1we1 h GLU 205 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1we1 h GLU 205 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1we1 h GLU 205 CO 0.00 0.67 -0.12 1.28 -1.00 0.00 0.00 179.01 179.84 1we1 n LEU 206 N -3.63 0.26 -0.27 1.33 7.99 0.08 -4.20 117.00 118.56 1we1 n LEU 206 Ca -0.01 0.19 0.01 0.00 -0.01 0.00 0.00 56.01 56.19 1we1 n LEU 206 Cb 0.69 -0.29 0.14 0.00 -0.11 0.00 0.00 43.42 43.84 1we1 n LEU 206 CO 0.42 0.05 1.12 -0.08 -1.51 0.00 0.00 177.39 177.39 1we1 h GLU 207 N 0.23 0.72 0.15 3.23 4.81 -1.48 -2.38 114.58 119.85 1we1 h GLU 207 Ca 0.00 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1we1 h GLU 207 Cb 0.40 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.62 1we1 h GLU 207 CO 0.00 0.47 -0.07 0.78 -0.73 0.00 0.00 179.01 179.46 1we1 h GLY 208 N 0.74 -0.21 0.58 1.92 0.00 -1.81 -1.62 103.07 102.66 1we1 h GLY 208 Ca 0.36 0.08 0.07 0.00 0.00 0.00 0.00 47.33 47.84 1we1 h GLY 208 CO -0.23 -0.08 0.24 3.43 0.00 0.00 0.00 176.54 179.90 1we1 h ASN 209 N -0.20 0.30 -0.43 0.19 2.35 -1.78 -2.16 115.58 113.85 1we1 h ASN 209 Ca -0.02 0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.77 1we1 h ASN 209 Cb 0.16 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.51 1we1 h ASN 209 CO 0.03 0.20 0.23 0.25 -1.65 0.00 0.00 177.43 176.49 1we1 h LEU 210 N 0.46 0.54 -0.20 1.61 5.85 -1.30 0.48 115.31 122.75 1we1 h LEU 210 Ca 0.26 -0.09 0.06 0.00 0.84 0.00 0.00 57.88 58.94 1we1 h LEU 210 Cb 0.24 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.07 1we1 h LEU 210 CO -0.22 0.48 -0.21 0.40 -0.34 0.00 0.00 178.44 178.55 1we1 h ILE 211 N 0.56 0.45 -0.36 4.05 1.08 -0.81 0.41 117.51 122.90 1we1 h ILE 211 Ca 0.15 0.00 -0.00 0.00 -0.39 0.00 0.00 64.86 64.62 1we1 h ILE 211 Cb 0.06 0.45 -0.02 0.00 -3.07 0.00 0.00 36.82 34.25 1we1 h ILE 211 CO -0.02 0.00 0.21 0.50 -0.69 0.00 0.00 178.15 178.15 1we1 h LYS 212 N -0.24 0.49 -0.12 2.37 3.11 -1.20 0.70 116.57 121.69 1we1 h LYS 212 Ca 0.12 -0.05 -0.03 0.00 -2.81 0.00 0.00 60.65 57.88 1we1 h LYS 212 Cb 0.42 -0.10 -0.01 0.00 -1.00 0.00 0.00 32.23 31.54 1we1 h LYS 212 CO -0.34 0.38 -0.07 0.00 -2.81 0.00 0.00 179.45 176.61 1we1 h ALA 213 N 1.08 1.67 -0.10 5.00 0.00 -0.20 0.37 119.26 127.08 1we1 h ALA 213 Ca 0.13 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 1we1 h ALA 213 Cb 0.02 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.75 1we1 h ALA 213 CO -0.02 0.25 -0.47 0.82 0.00 0.00 0.00 179.25 179.82 1we1 h ILE 214 N 0.17 1.37 -0.75 0.00 2.04 0.30 -2.80 117.51 117.84 1we1 h ILE 214 Ca 0.04 -1.81 0.12 0.00 1.00 0.00 0.00 64.86 64.21 1we1 h ILE 214 Cb 0.24 2.21 -0.08 0.00 -0.74 0.00 0.00 36.82 38.45 1we1 h ILE 214 CO 0.01 0.54 0.36 1.23 0.00 0.00 0.00 178.15 180.29 1we1 h GLY 215 N 0.08 1.15 0.89 5.37 0.00 0.03 -2.20 103.07 108.39 1we1 h GLY 215 Ca -0.03 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.07 1we1 h GLY 215 CO 0.10 0.00 0.08 -2.22 0.00 0.00 0.00 176.54 174.50 1we1 h ILE 216 N 0.57 1.18 -0.59 2.60 2.04 -0.87 -1.77 117.51 120.66 1we1 h ILE 216 Ca 0.39 -0.55 -0.03 0.00 1.00 0.00 0.00 64.86 65.68 1we1 h ILE 216 Cb 0.49 1.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 1we1 h ILE 216 CO -0.32 0.18 0.26 0.24 0.00 0.00 0.00 178.15 178.50 1we1 h MET 217 N 0.20 0.86 -0.05 2.37 2.07 -1.22 -1.02 114.93 118.15 1we1 h MET 217 Ca 0.07 -0.14 -0.05 0.00 -2.07 0.00 0.00 59.70 57.51 1we1 h MET 217 Cb 0.20 -0.15 -0.01 0.00 -1.87 0.00 0.00 31.60 29.77 1we1 h MET 217 CO -0.00 0.72 -0.22 0.28 1.07 0.00 0.00 176.91 178.75 1we1 h VAL 218 N 0.81 1.18 -0.10 -2.22 2.07 -1.33 -1.60 116.25 115.06 1we1 h VAL 218 Ca 0.20 -0.86 -0.07 0.00 0.82 0.00 0.00 66.70 66.79 1we1 h VAL 218 Cb 0.16 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 1we1 h VAL 218 CO -0.02 0.25 -0.22 0.15 0.02 0.00 0.00 177.57 177.75 1we1 h PHE 219 N 0.07 0.42 0.00 1.57 3.57 -0.90 -2.32 116.94 119.34 1we1 h PHE 219 Ca 0.01 -0.15 -0.04 0.00 3.53 0.00 0.00 57.97 61.32 1we1 h PHE 219 Cb 0.44 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.09 1we1 h PHE 219 CO 0.00 0.83 -0.18 -0.91 -2.23 0.00 0.00 178.31 175.82 1we1 h ASN 220 N -0.12 0.00 0.01 0.41 2.35 -0.91 0.68 115.58 118.01 1we1 h ASN 220 Ca 0.00 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.54 1we1 h ASN 220 Cb 0.82 0.00 0.02 0.00 0.05 0.00 0.00 38.32 39.20 1we1 h ASN 220 CO 0.05 0.18 -0.84 0.77 -1.65 0.00 0.00 177.43 175.94 1we1 h SER 221 N 0.00 0.72 0.58 5.81 4.64 -1.27 -3.21 113.55 120.82 1we1 h SER 221 Ca -0.00 -0.76 -0.06 0.00 -0.47 0.00 0.00 61.79 60.50 1we1 h SER 221 Cb 0.36 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 1we1 h SER 221 CO 0.02 1.39 -0.27 -0.07 -0.87 0.00 0.00 176.83 177.03 1we1 h LEU 222 N 0.12 0.00 -1.35 5.97 3.38 -0.96 -3.52 115.31 118.96 1we1 h LEU 222 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1we1 h LEU 222 Cb 1.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.28 1we1 h LEU 222 CO 0.17 0.27 0.00 0.41 0.09 0.00 0.00 178.44 179.38