#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3i4x s ALA 4 N 0.00 3.12 -0.12 0.00 0.00 -1.26 -5.02 121.76 118.48 3i4x s ALA 4 Ca 0.00 1.28 -0.04 0.00 0.00 0.00 0.00 51.96 53.20 3i4x s ALA 4 Cb 0.00 -3.52 0.06 0.00 0.00 0.00 0.00 23.12 19.66 3i4x s ALA 4 CO 0.00 -1.02 0.16 1.21 0.00 0.00 0.00 175.76 176.10 3i4x s ASN 5 N -0.81 1.11 0.53 0.00 3.84 -1.26 -4.30 114.94 114.05 3i4x s ASN 5 Ca 0.62 0.08 0.28 0.00 0.21 0.00 0.00 52.86 54.05 3i4x s ASN 5 Cb -0.39 0.21 1.43 0.00 -0.55 0.00 0.00 41.25 41.95 3i4x s ASN 5 CO 0.49 -0.28 1.94 0.00 -2.79 0.00 0.00 177.10 176.46 3i4x h ALA 6 N 8.36 2.67 0.00 1.71 0.00 -0.76 0.37 119.26 131.62 3i4x h ALA 6 Ca -0.14 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3i4x h ALA 6 Cb 1.13 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3i4x h ALA 6 CO 0.19 -0.88 0.00 0.43 0.00 0.00 0.00 179.25 178.99 3i4x n SER 7 N -4.33 0.43 0.06 0.00 7.64 -1.26 -1.14 113.62 115.02 3i4x n SER 7 Ca 0.15 0.65 0.13 0.00 1.01 0.00 0.00 58.87 60.81 3i4x n SER 7 Cb 0.79 -0.72 0.42 0.00 -1.01 0.00 0.00 64.21 63.69 3i4x n SER 7 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3i4x n SER 8 N -2.02 0.52 -4.72 6.43 3.41 0.12 -4.64 113.62 112.72 3i4x n SER 8 Ca 0.01 0.41 -0.61 0.00 -0.26 0.00 0.00 58.87 58.41 3i4x n SER 8 Cb 0.12 -0.46 -0.08 0.00 -0.26 0.00 0.00 64.21 63.52 3i4x n SER 8 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i4x n ALA 9 N -1.68 -0.61 -0.06 7.33 0.00 -0.29 -4.82 120.51 120.38 3i4x n ALA 9 Ca 0.06 0.43 -0.08 0.00 0.00 0.00 0.00 53.44 53.84 3i4x n ALA 9 Cb 0.40 -2.12 -0.01 0.00 0.00 0.00 0.00 19.45 17.71 3i4x n ALA 9 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3i4x h GLU 10 N 6.44 0.18 -0.89 0.00 4.81 -1.90 -1.55 114.58 121.67 3i4x h GLU 10 Ca -0.46 -0.01 0.07 0.00 -0.13 0.00 0.00 59.36 58.84 3i4x h GLU 10 Cb 1.34 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 30.62 3i4x h GLU 10 CO 0.96 0.12 0.58 0.00 -0.73 0.00 0.00 179.01 179.94 3i4x h ALA 11 N 1.17 1.56 -0.34 2.92 0.00 -1.94 0.63 119.26 123.25 3i4x h ALA 11 Ca 0.11 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 3i4x h ALA 11 Cb 0.09 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3i4x h ALA 11 CO -0.13 0.29 0.09 -0.92 0.00 0.00 0.00 179.25 178.58 3i4x h TYR 12 N 0.97 0.56 -0.44 0.00 3.20 -1.71 -0.61 116.97 118.94 3i4x h TYR 12 Ca 0.39 -0.07 -0.10 0.00 3.14 0.00 0.00 58.73 62.10 3i4x h TYR 12 Cb 0.26 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 3i4x h TYR 12 CO -0.00 0.57 -0.11 0.00 -1.64 0.00 0.00 178.16 176.98 3i4x h ARG 13 N 0.39 0.86 -0.10 1.82 3.08 -0.62 -1.26 114.38 118.54 3i4x h ARG 13 Ca 0.11 -0.33 -0.03 0.00 0.07 0.00 0.00 59.98 59.79 3i4x h ARG 13 Cb 0.29 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.29 3i4x h ARG 13 CO 0.00 0.97 -0.06 0.28 -1.07 0.00 0.00 179.97 180.09 3i4x h VAL 14 N 0.69 1.33 -0.44 2.04 2.07 -0.91 -2.44 116.25 118.57 3i4x h VAL 14 Ca 0.11 -1.11 -0.01 0.00 0.82 0.00 0.00 66.70 66.51 3i4x h VAL 14 Cb 0.66 1.84 -0.02 0.00 -1.52 0.00 0.00 31.29 32.24 3i4x h VAL 14 CO 0.05 0.31 0.23 -0.07 0.02 0.00 0.00 177.57 178.11 3i4x h LEU 15 N -0.14 0.54 -1.61 2.57 3.38 -1.08 -0.77 115.31 118.19 3i4x h LEU 15 Ca 0.02 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 3i4x h LEU 15 Cb 0.52 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 3i4x h LEU 15 CO 0.02 0.46 -0.03 0.28 0.09 0.00 0.00 178.44 179.25 3i4x h SER 16 N 0.62 0.19 1.14 -0.43 0.02 -1.09 -0.92 113.55 113.07 3i4x h SER 16 Ca 0.16 -0.02 -0.07 0.00 -0.84 0.00 0.00 61.79 61.02 3i4x h SER 16 Cb 0.05 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 3i4x h SER 16 CO -0.02 0.26 -0.33 0.03 -1.14 0.00 0.00 176.83 175.62 3i4x h ARG 17 N 0.20 0.00 0.03 3.45 3.08 -0.66 -3.35 114.38 117.13 3i4x h ARG 17 Ca 0.05 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.78 3i4x h ARG 17 Cb 0.20 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.20 3i4x h ARG 17 CO 0.01 0.33 -1.88 0.00 -1.07 0.00 0.00 179.97 177.36 3i4x n ALA 18 N -2.23 1.37 -1.87 0.04 0.00 -0.47 -5.01 120.51 112.33 3i4x n ALA 18 Ca 0.01 -0.82 -0.40 0.00 0.00 0.00 0.00 53.44 52.23 3i4x n ALA 18 Cb 0.55 -0.70 -0.06 0.00 0.00 0.00 0.00 19.45 19.23 3i4x n ALA 18 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3i4x s PHE 19 N -2.57 3.95 -0.03 0.00 0.08 -0.49 -5.04 117.98 113.86 3i4x s PHE 19 Ca -0.10 1.83 -0.18 0.00 0.12 0.00 0.00 56.93 58.60 3i4x s PHE 19 Cb 0.07 -2.94 -0.05 0.00 -0.57 0.00 0.00 43.02 39.54 3i4x s PHE 19 CO 0.81 0.44 0.51 0.50 -0.10 0.00 0.00 175.22 177.38 3i4x s ARG 20 N -1.03 4.22 -0.07 0.44 3.52 -1.26 -5.02 118.95 119.75 3i4x s ARG 20 Ca 0.40 0.56 0.05 0.00 -0.13 0.00 0.00 55.73 56.61 3i4x s ARG 20 Cb -0.25 -3.34 -0.00 0.00 -1.56 0.00 0.00 34.95 29.80 3i4x s ARG 20 CO 0.30 0.40 -0.22 -0.06 -0.81 0.00 0.00 175.30 174.92 3i4x s PHE 21 N -0.21 2.21 -0.46 5.12 0.08 -1.26 -5.02 117.98 118.44 3i4x s PHE 21 Ca 0.27 -0.75 0.23 0.00 0.12 0.00 0.00 56.93 56.80 3i4x s PHE 21 Cb -0.17 -1.48 0.12 0.00 -0.57 0.00 0.00 43.02 40.92 3i4x s PHE 21 CO 0.14 -0.28 1.11 -0.25 -0.10 0.00 0.00 175.22 175.85 3i4x n ASP 22 N 3.26 0.71 -4.15 1.36 8.00 -1.26 -4.92 116.55 119.55 3i4x n ASP 22 Ca -0.19 0.11 -0.11 0.00 0.71 0.00 0.00 54.79 55.32 3i4x n ASP 22 Cb 0.52 0.49 -0.09 0.00 -0.02 0.00 0.00 41.12 42.02 3i4x n ASP 22 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3i4x s ASN 23 N -4.59 0.18 0.29 -2.24 2.20 -1.26 -5.05 114.94 104.47 3i4x s ASN 23 Ca 0.03 -1.25 -0.03 0.00 -0.94 0.00 0.00 52.86 50.67 3i4x s ASN 23 Cb 0.12 0.37 0.40 0.00 -2.00 0.00 0.00 41.25 40.14 3i4x s ASN 23 CO 0.77 -0.82 1.93 -0.33 -2.94 0.00 0.00 177.10 175.71 3i4x h GLU 24 N 2.68 1.06 -0.27 3.55 4.39 -2.00 -2.90 114.58 121.11 3i4x h GLU 24 Ca -0.35 -0.10 -0.01 0.00 0.34 0.00 0.00 59.36 59.25 3i4x h GLU 24 Cb 1.23 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 29.64 3i4x h GLU 24 CO 0.54 0.75 0.14 -0.44 -1.16 0.00 0.00 179.01 178.84 3i4x h ASP 25 N 1.08 0.34 -0.57 1.42 3.32 -1.96 0.90 116.42 120.95 3i4x h ASP 25 Ca 0.28 -0.10 -0.08 0.00 0.02 0.00 0.00 57.03 57.15 3i4x h ASP 25 Cb -0.03 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 3i4x h ASP 25 CO -0.05 0.34 0.04 1.56 -1.72 0.00 0.00 179.24 179.41 3i4x h GLN 26 N 0.31 0.98 -0.26 3.56 4.20 -1.87 -0.56 115.11 121.47 3i4x h GLN 26 Ca 0.09 -0.29 0.00 0.00 0.06 0.00 0.00 58.65 58.51 3i4x h GLN 26 Cb 0.09 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 3i4x h GLN 26 CO -0.01 0.96 0.16 -0.22 -0.67 0.00 0.00 178.83 179.05 3i4x h LYS 27 N 0.87 0.34 -0.49 1.46 3.64 -1.27 -0.08 116.57 121.04 3i4x h LYS 27 Ca 0.17 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.53 3i4x h LYS 27 Cb 0.49 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.21 3i4x h LYS 27 CO 0.02 0.25 0.32 -0.07 -2.27 0.00 0.00 179.45 177.70 3i4x h LEU 28 N 0.33 0.56 -0.64 5.20 3.38 -0.65 -1.38 115.31 122.11 3i4x h LEU 28 Ca 0.09 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.10 3i4x h LEU 28 Cb -0.01 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.55 3i4x h LEU 28 CO -0.02 0.40 0.35 -0.50 0.09 0.00 0.00 178.44 178.77 3i4x h TRP 29 N 0.66 0.65 0.32 1.13 -0.00 -0.89 0.37 115.95 118.19 3i4x h TRP 29 Ca 0.18 0.02 -0.02 0.00 -0.00 0.00 0.00 58.89 59.08 3i4x h TRP 29 Cb -0.07 -0.20 0.00 0.00 -0.00 0.00 0.00 29.16 28.89 3i4x h TRP 29 CO -0.04 0.32 -0.15 2.35 -0.00 0.00 0.00 178.44 180.92 3i4x h TRP 30 N 0.67 -0.39 0.00 0.49 2.91 -0.73 -1.66 115.95 117.23 3i4x h TRP 30 Ca 0.28 -0.01 -0.06 0.00 1.13 0.00 0.00 58.89 60.23 3i4x h TRP 30 Cb 0.15 0.13 -0.01 0.00 -0.51 0.00 0.00 29.16 28.92 3i4x h TRP 30 CO -0.08 -0.15 -0.28 0.45 -1.03 0.00 0.00 178.44 177.36 3i4x h HIS 31 N -0.57 0.00 -0.44 2.65 3.86 -0.99 0.23 115.15 119.89 3i4x h HIS 31 Ca -0.04 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.07 3i4x h HIS 31 Cb 0.42 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.87 3i4x h HIS 31 CO -0.02 0.28 -0.10 1.03 0.86 0.00 0.00 177.93 179.98 3i4x h SER 32 N 0.00 0.85 0.00 2.45 0.87 -0.07 -3.39 113.55 114.26 3i4x h SER 32 Ca -0.00 -0.36 -0.24 0.00 -1.23 0.00 0.00 61.79 59.96 3i4x h SER 32 Cb 0.50 -0.23 -0.05 0.00 -0.44 0.00 0.00 62.40 62.19 3i4x h SER 32 CO 0.04 1.01 -1.91 0.35 -0.53 0.00 0.00 176.83 175.79 3i4x n THR 33 N -4.29 0.91 -0.08 2.23 -2.24 -0.64 -0.10 114.28 110.06 3i4x n THR 33 Ca -0.01 -0.52 -0.02 0.00 -2.27 0.00 0.00 64.05 61.24 3i4x n THR 33 Cb 0.37 -0.73 0.23 0.00 -2.10 0.00 0.00 70.33 68.10 3i4x n THR 33 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3i4x h ALA 34 N 0.52 1.28 -0.65 6.98 0.00 -0.72 -2.20 119.26 124.48 3i4x h ALA 34 Ca -0.36 -0.20 0.03 0.00 0.00 0.00 0.00 54.91 54.39 3i4x h ALA 34 Cb 1.77 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 19.32 3i4x h ALA 34 CO 0.00 0.50 0.40 -1.35 0.00 0.00 0.00 179.25 178.80 3i4x h PRO 35 N 0.70 0.75 -0.39 0.00 0.11 -1.77 0.27 132.00 131.68 3i4x h PRO 35 Ca 0.15 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.12 3i4x h PRO 35 Cb 0.29 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.22 3i4x h PRO 35 CO 0.00 0.50 -0.16 1.98 -0.21 0.00 0.00 178.00 180.11 3i4x h MET 36 N 0.78 0.79 -0.07 1.05 1.85 -1.79 -1.02 114.93 116.52 3i4x h MET 36 Ca 0.27 -0.33 0.00 0.00 -0.61 0.00 0.00 59.70 59.02 3i4x h MET 36 Cb 0.04 -0.03 -0.00 0.00 0.43 0.00 0.00 31.60 32.04 3i4x h MET 36 CO -0.12 0.95 0.04 0.35 -0.40 0.00 0.00 176.91 177.74 3i4x h PHE 37 N 0.59 0.08 -0.46 1.39 -0.00 -0.99 0.32 116.94 117.87 3i4x h PHE 37 Ca 0.09 0.00 -0.04 0.00 -0.00 0.00 0.00 57.97 58.02 3i4x h PHE 37 Cb 0.70 -0.03 -0.02 0.00 -0.00 0.00 0.00 35.95 36.61 3i4x h PHE 37 CO 0.06 0.07 0.12 0.00 -0.00 0.00 0.00 178.31 178.56 3i4x h ALA 38 N 1.01 0.60 -0.58 2.41 0.00 -0.48 -1.37 119.26 120.85 3i4x h ALA 38 Ca 0.02 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 3i4x h ALA 38 Cb 0.01 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 3i4x h ALA 38 CO -0.00 0.28 0.13 -0.22 0.00 0.00 0.00 179.25 179.44 3i4x h LYS 39 N 0.61 0.90 -0.53 0.00 1.63 -1.00 0.31 116.57 118.49 3i4x h LYS 39 Ca 0.14 -0.20 -0.05 0.00 -0.85 0.00 0.00 60.65 59.70 3i4x h LYS 39 Cb 0.31 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.79 3i4x h LYS 39 CO 0.00 0.81 0.15 1.98 -3.45 0.00 0.00 179.45 178.94 3i4x h MET 40 N 0.86 0.83 -0.50 1.90 4.05 -0.11 -0.85 114.93 121.11 3i4x h MET 40 Ca 0.19 -0.19 -0.03 0.00 -0.28 0.00 0.00 59.70 59.39 3i4x h MET 40 Cb 0.32 -0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 30.99 3i4x h MET 40 CO 0.00 0.78 0.20 -0.07 0.23 0.00 0.00 176.91 178.05 3i4x h LEU 41 N 0.73 0.69 -0.28 3.39 3.38 -0.91 -0.45 115.31 121.86 3i4x h LEU 41 Ca 0.17 -0.17 0.05 0.00 0.09 0.00 0.00 57.88 58.02 3i4x h LEU 41 Cb 0.31 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 3i4x h LEU 41 CO -0.00 0.67 -0.02 -0.33 0.09 0.00 0.00 178.44 178.85 3i4x h GLU 42 N 0.67 0.06 0.00 1.13 5.08 -0.70 -1.87 114.58 118.95 3i4x h GLU 42 Ca 0.17 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.49 3i4x h GLU 42 Cb 0.19 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 3i4x h GLU 42 CO -0.01 0.04 -0.17 1.79 -1.00 0.00 0.00 179.01 179.66 3i4x h THR 43 N 0.06 0.29 -0.03 1.13 1.35 -0.92 -2.32 112.91 112.47 3i4x h THR 43 Ca 0.14 -1.40 0.00 0.00 -0.55 0.00 0.00 66.41 64.60 3i4x h THR 43 Cb 0.19 2.14 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 3i4x h THR 43 CO -0.24 0.16 0.00 0.00 -0.25 0.00 0.00 175.52 175.19 3i4x n ALA 44 N -2.14 2.53 -2.84 6.62 0.00 -0.20 -4.91 120.51 119.57 3i4x n ALA 44 Ca 0.03 -0.10 -0.22 0.00 0.00 0.00 0.00 53.44 53.16 3i4x n ALA 44 Cb 0.60 -1.09 0.02 0.00 0.00 0.00 0.00 19.45 18.98 3i4x n ALA 44 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3i4x n ASN 45 N -0.49 -6.08 -4.76 0.00 3.02 -0.87 -4.87 115.26 101.20 3i4x n ASN 45 Ca 0.06 -0.21 -0.39 0.00 -0.03 0.00 0.00 54.58 54.00 3i4x n ASN 45 Cb 0.05 -4.95 0.00 0.00 -0.61 0.00 0.00 39.78 34.28 3i4x n ASN 45 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3i4x s TYR 46 N -3.14 2.70 0.68 3.10 2.02 -0.72 -4.98 117.35 117.00 3i4x s TYR 46 Ca 0.22 1.40 -0.16 0.00 -0.37 0.00 0.00 57.07 58.16 3i4x s TYR 46 Cb -0.10 -3.68 0.01 0.00 -0.40 0.00 0.00 41.96 37.79 3i4x s TYR 46 CO 0.27 -2.25 1.19 0.95 -1.57 0.00 0.00 175.55 174.15 3i4x s THR 47 N -1.30 2.57 0.21 -0.71 -4.23 -1.26 -4.75 115.64 106.17 3i4x s THR 47 Ca 0.60 0.30 -0.14 0.00 -1.18 0.00 0.00 61.69 61.27 3i4x s THR 47 Cb -0.38 -2.92 0.24 0.00 1.34 0.00 0.00 72.50 70.78 3i4x s THR 47 CO 0.48 -0.13 1.62 0.74 -0.54 0.00 0.00 174.62 176.79 3i4x h THR 48 N 0.13 0.32 -0.52 3.99 2.02 -1.98 -0.04 112.91 116.82 3i4x h THR 48 Ca -0.48 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.70 3i4x h THR 48 Cb 1.29 0.32 -0.03 0.00 -1.74 0.00 0.00 68.15 67.99 3i4x h THR 48 CO 0.52 0.00 0.33 -0.65 0.37 0.00 0.00 175.52 176.10 3i4x h PRO 49 N -0.02 0.70 -0.24 6.66 0.11 -2.00 -2.37 132.00 134.83 3i4x h PRO 49 Ca 0.31 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 66.27 3i4x h PRO 49 Cb 0.49 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.44 3i4x h PRO 49 CO -0.68 0.47 -0.24 0.00 -0.21 0.00 0.00 178.00 177.34 3i4x h GLN 51 N 0.29 -0.20 -0.18 0.00 4.20 -0.81 0.22 115.11 118.64 3i4x h GLN 51 Ca 0.04 0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 3i4x h GLN 51 Cb 0.80 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.62 3i4x h GLN 51 CO 0.06 -0.13 0.04 1.88 -0.67 0.00 0.00 178.83 180.01 3i4x h TYR 52 N -0.20 0.31 -0.37 2.96 -1.99 -1.36 -2.20 116.97 114.11 3i4x h TYR 52 Ca 0.18 -0.04 0.06 0.00 2.00 0.00 0.00 58.73 60.93 3i4x h TYR 52 Cb 0.50 -0.09 -0.05 0.00 2.00 0.00 0.00 36.73 39.09 3i4x h TYR 52 CO -0.49 0.43 0.06 0.37 -0.00 0.00 0.00 178.16 178.52 3i4x h GLN 53 N 0.11 0.17 -0.33 4.88 4.15 -0.67 0.66 115.11 124.08 3i4x h GLN 53 Ca 0.06 -0.01 -0.17 0.00 0.77 0.00 0.00 58.65 59.30 3i4x h GLN 53 Cb 0.27 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 27.92 3i4x h GLN 53 CO 0.00 0.11 -0.45 1.88 -1.93 0.00 0.00 178.83 178.45 3i4x h TYR 54 N 0.18 1.08 -0.41 3.99 0.05 -0.54 -2.17 116.97 119.15 3i4x h TYR 54 Ca 0.18 -0.36 -0.06 0.00 0.05 0.00 0.00 58.73 58.55 3i4x h TYR 54 Cb 0.22 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 37.72 3i4x h TYR 54 CO -0.20 1.18 0.02 -0.07 -1.05 0.00 0.00 178.16 178.04 3i4x h LEU 55 N 0.68 0.61 -0.09 3.88 3.38 -1.08 -0.96 115.31 121.73 3i4x h LEU 55 Ca 0.04 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 3i4x h LEU 55 Cb 1.05 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.64 3i4x h LEU 55 CO 0.11 0.67 -0.24 0.40 0.09 0.00 0.00 178.44 179.47 3i4x h ILE 56 N 0.62 1.40 -0.90 1.22 2.04 -0.75 0.77 117.51 121.92 3i4x h ILE 56 Ca 0.13 -1.57 -0.02 0.00 1.00 0.00 0.00 64.86 64.40 3i4x h ILE 56 Cb 0.36 2.19 -0.04 0.00 -0.74 0.00 0.00 36.82 38.58 3i4x h ILE 56 CO 0.01 0.45 0.49 0.74 0.00 0.00 0.00 178.15 179.84 3i4x h THR 57 N -0.14 1.26 0.17 -0.27 2.02 -1.33 0.21 112.91 114.84 3i4x h THR 57 Ca -0.00 -0.65 -0.00 0.00 0.77 0.00 0.00 66.41 66.52 3i4x h THR 57 Cb 0.85 0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 67.30 3i4x h THR 57 CO 0.05 0.30 -0.11 0.22 0.37 0.00 0.00 175.52 176.34 3i4x h TYR 58 N 1.26 -0.29 -0.49 3.16 3.20 -1.06 0.56 116.97 123.31 3i4x h TYR 58 Ca 0.32 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.18 3i4x h TYR 58 Cb 0.03 0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.39 3i4x h TYR 58 CO 0.01 -0.18 0.30 -0.22 -1.64 0.00 0.00 178.16 176.43 3i4x h LYS 59 N -0.28 0.66 0.06 1.82 3.11 -0.46 0.77 116.57 122.25 3i4x h LYS 59 Ca -0.01 -0.06 -0.27 0.00 -2.81 0.00 0.00 60.65 57.50 3i4x h LYS 59 Cb 0.24 -0.14 -0.02 0.00 -1.00 0.00 0.00 32.23 31.31 3i4x h LYS 59 CO 0.01 0.48 -1.33 0.93 -2.81 0.00 0.00 179.45 176.73 3i4x h GLU 60 N 0.65 0.13 0.00 1.90 5.08 -0.34 -3.34 114.58 118.66 3i4x h GLU 60 Ca 0.18 -0.23 -0.11 0.00 -1.00 0.00 0.00 59.36 58.20 3i4x h GLU 60 Cb -0.01 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 3i4x h GLU 60 CO -0.03 1.00 -1.70 0.00 -1.00 0.00 0.00 179.01 177.28 3i4x n VAL 62 N -2.19 1.16 -0.32 0.00 0.31 0.07 -4.59 118.33 112.77 3i4x n VAL 62 Ca -0.11 -0.04 0.13 0.00 -0.01 0.00 0.00 64.34 64.31 3i4x n VAL 62 Cb 0.60 -1.89 0.27 0.00 -0.91 0.00 0.00 33.84 31.91 3i4x n VAL 62 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 3i4x h ILE 63 N -0.64 0.12 0.00 2.52 2.04 -1.13 0.55 117.51 120.98 3i4x h ILE 63 Ca -0.26 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.58 3i4x h ILE 63 Cb 1.07 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 37.21 3i4x h ILE 63 CO -0.16 0.01 0.00 -2.65 0.00 0.00 0.00 178.15 175.35 3i4x n PRO 64 N -5.42 0.01 -0.15 2.37 -0.02 -1.26 -0.90 135.00 129.62 3i4x n PRO 64 Ca 0.21 0.38 0.09 0.00 -2.02 0.00 0.00 63.50 62.16 3i4x n PRO 64 Cb 0.70 -1.50 0.17 0.00 -0.02 0.00 0.00 33.50 32.84 3i4x n PRO 64 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3i4x n SER 65 N -1.47 3.00 -0.72 2.55 7.64 0.19 -4.46 113.62 120.36 3i4x n SER 65 Ca 0.01 -1.88 0.11 0.00 1.01 0.00 0.00 58.87 58.12 3i4x n SER 65 Cb 0.06 -0.20 0.32 0.00 -1.01 0.00 0.00 64.21 63.38 3i4x n SER 65 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3i4x n LEU 66 N 1.03 2.16 0.00 -3.43 4.77 -0.08 0.22 117.00 121.66 3i4x n LEU 66 Ca 0.15 -0.91 0.00 0.00 -0.03 0.00 0.00 56.01 55.21 3i4x n LEU 66 Cb 0.48 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 3i4x n LEU 66 CO 0.12 0.46 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 3i4x n GLY 67 N 1.23 -1.41 3.70 -0.72 0.00 -1.26 -4.83 105.19 101.91 3i4x n GLY 67 Ca 0.17 -1.18 -0.32 0.00 0.00 0.00 0.00 46.02 44.68 3i4x n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3i4x s TYR 69 N -2.42 2.84 0.02 0.00 5.04 -1.26 -4.89 117.35 116.68 3i4x s TYR 69 Ca 0.69 0.59 -0.30 0.00 -2.44 0.00 0.00 57.07 55.61 3i4x s TYR 69 Cb -0.25 -3.87 -0.07 0.00 0.35 0.00 0.00 41.96 38.13 3i4x s TYR 69 CO 0.53 -3.30 1.57 -2.14 -1.34 0.00 0.00 175.55 170.87 3i4x s PRO 70 N 1.82 4.22 0.22 4.97 0.02 -1.26 -4.99 135.00 139.99 3i4x s PRO 70 Ca 0.70 2.18 0.00 0.00 0.02 0.00 0.00 61.00 63.90 3i4x s PRO 70 Cb -0.40 -3.68 -0.05 0.00 0.02 0.00 0.00 34.50 30.40 3i4x s PRO 70 CO 0.31 -0.71 0.10 0.95 -0.33 0.00 0.00 177.00 177.32 3i4x s THR 71 N 2.89 0.28 -0.88 0.99 -4.23 -1.26 -5.05 115.64 108.38 3i4x s THR 71 Ca 0.71 -1.99 0.27 0.00 -1.18 0.00 0.00 61.69 59.50 3i4x s THR 71 Cb -0.36 -2.50 0.22 0.00 1.34 0.00 0.00 72.50 71.20 3i4x s THR 71 CO 0.30 -0.06 1.78 0.59 -0.54 0.00 0.00 174.62 176.69 3i4x n ASN 72 N -0.34 0.38 -0.93 3.99 3.02 -1.26 -4.05 115.26 116.07 3i4x n ASN 72 Ca 0.00 0.42 0.08 0.00 -0.03 0.00 0.00 54.58 55.05 3i4x n ASN 72 Cb 0.66 -0.48 0.22 0.00 -0.61 0.00 0.00 39.78 39.58 3i4x n ASN 72 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3i4x n SER 73 N -1.81 3.46 -3.88 6.41 3.41 -1.26 -4.95 113.62 115.00 3i4x n SER 73 Ca 0.06 -2.15 -0.11 0.00 -0.26 0.00 0.00 58.87 56.41 3i4x n SER 73 Cb 0.38 -0.36 -0.10 0.00 -0.26 0.00 0.00 64.21 63.87 3i4x n SER 73 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3i4x s ALA 74 N -1.27 -0.27 0.26 7.33 0.00 -1.26 -5.13 121.76 121.42 3i4x s ALA 74 Ca 0.34 -0.11 -0.31 0.00 0.00 0.00 0.00 51.96 51.88 3i4x s ALA 74 Cb 0.19 0.07 -0.13 0.00 0.00 0.00 0.00 23.12 23.25 3i4x s ALA 74 CO 0.20 -0.18 1.35 -0.35 0.00 0.00 0.00 175.76 176.78 3i4x n PRO 75 N 1.69 1.96 -3.86 0.00 -0.04 -1.26 -4.68 135.00 128.81 3i4x n PRO 75 Ca -0.21 0.69 -0.09 0.00 -0.04 0.00 0.00 63.50 63.85 3i4x n PRO 75 Cb 0.56 -2.31 -0.07 0.00 -0.04 0.00 0.00 33.50 31.64 3i4x n PRO 75 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 3i4x s ARG 76 N -0.75 1.03 0.09 0.54 1.70 -1.26 -4.93 118.95 115.37 3i4x s ARG 76 Ca 0.65 -1.00 -0.30 0.00 -0.47 0.00 0.00 55.73 54.61 3i4x s ARG 76 Cb -0.65 0.38 -0.06 0.00 -0.57 0.00 0.00 34.95 34.06 3i4x s ARG 76 CO 0.53 -0.37 1.05 -0.46 -1.08 0.00 0.00 175.30 174.98 3i4x s TRP 77 N -3.90 3.64 -0.36 5.89 -0.11 -1.26 -5.01 118.94 117.83 3i4x s TRP 77 Ca 0.10 1.62 -0.13 0.00 1.22 0.00 0.00 56.10 58.90 3i4x s TRP 77 Cb 0.04 -3.21 -0.00 0.00 -1.50 0.00 0.00 33.47 28.80 3i4x s TRP 77 CO -0.06 -0.38 0.24 -0.51 -4.62 0.00 0.00 176.95 171.62 3i4x s LEU 78 N 0.37 4.66 0.09 5.86 1.43 -1.26 -4.78 118.68 125.05 3i4x s LEU 78 Ca 0.51 -0.63 -0.18 0.00 -1.03 0.00 0.00 54.13 52.80 3i4x s LEU 78 Cb -0.26 -2.12 -0.07 0.00 0.03 0.00 0.00 46.19 43.78 3i4x s LEU 78 CO 0.31 -0.31 0.56 -0.55 0.23 0.00 0.00 176.35 176.59 3i4x s SER 79 N 1.68 7.00 0.13 2.29 0.15 0.38 -4.40 113.70 120.93 3i4x s SER 79 Ca 0.05 1.22 0.11 0.00 0.70 0.00 0.00 55.95 58.03 3i4x s SER 79 Cb -0.18 -2.34 0.55 0.00 -1.71 0.00 0.00 66.02 62.34 3i4x s SER 79 CO 0.09 0.23 1.34 0.00 1.20 0.00 0.00 173.24 176.11 3i4x n ILE 80 N 1.48 1.45 -0.19 6.45 0.13 -1.26 -3.60 119.36 123.81 3i4x n ILE 80 Ca -0.09 0.51 -0.03 0.00 -1.10 0.00 0.00 62.75 62.05 3i4x n ILE 80 Cb 0.51 -1.47 0.18 0.00 -0.84 0.00 0.00 39.64 38.01 3i4x n ILE 80 CO 0.00 0.00 0.00 0.25 2.80 0.00 0.00 176.55 179.60 3i4x h LEU 81 N 0.00 0.88 -8.68 9.51 5.85 -1.91 -3.44 115.31 117.51 3i4x h LEU 81 Ca 0.00 -0.11 -0.34 0.00 0.84 0.00 0.00 57.88 58.27 3i4x h LEU 81 Cb 0.07 -0.23 -0.15 0.00 0.37 0.00 0.00 40.66 40.73 3i4x h LEU 81 CO 0.00 0.77 -0.71 0.42 -0.34 0.00 0.00 178.44 178.58 3i4x s THR 82 N -5.46 1.21 0.16 1.05 -4.23 -1.24 -5.02 115.64 102.11 3i4x s THR 82 Ca -0.11 -2.07 0.33 0.00 -1.18 0.00 0.00 61.69 58.66 3i4x s THR 82 Cb 0.16 -1.90 0.35 0.00 1.34 0.00 0.00 72.50 72.45 3i4x s THR 82 CO 0.80 -0.71 2.01 0.03 -0.54 0.00 0.00 174.62 176.22 3i4x h ARG 83 N 2.74 0.00 -0.22 3.99 2.47 -1.87 0.19 114.38 121.68 3i4x h ARG 83 Ca -0.37 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.35 3i4x h ARG 83 Cb 1.20 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.52 3i4x h ARG 83 CO 0.63 0.00 0.00 0.66 0.56 0.00 0.00 179.97 181.82 3i4x n TYR 84 N -2.74 0.27 -0.99 3.04 4.01 -1.26 -0.58 117.16 118.91 3i4x n TYR 84 Ca -0.01 -0.14 0.00 0.00 -0.16 0.00 0.00 57.90 57.59 3i4x n TYR 84 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.16 3i4x n TYR 84 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3i4x n GLY 85 N 1.37 0.40 3.76 2.72 0.00 0.05 -4.73 105.19 108.76 3i4x n GLY 85 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 3i4x n GLY 85 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3i4x s THR 86 N -1.86 4.10 -0.34 2.61 -4.23 -1.26 -0.47 115.64 114.19 3i4x s THR 86 Ca 0.00 2.01 0.03 0.00 -1.18 0.00 0.00 61.69 62.55 3i4x s THR 86 Cb 0.00 -4.24 0.50 0.00 1.34 0.00 0.00 72.50 70.11 3i4x s THR 86 CO 0.00 0.40 1.70 -0.81 -0.54 0.00 0.00 174.62 175.37 3i4x n PRO 87 N 1.23 1.95 -3.82 3.99 -0.04 -1.26 -3.78 135.00 133.26 3i4x n PRO 87 Ca -0.01 -2.28 -0.13 0.00 -0.04 0.00 0.00 63.50 61.05 3i4x n PRO 87 Cb 0.48 -1.89 -0.14 0.00 -0.04 0.00 0.00 33.50 31.91 3i4x n PRO 87 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 3i4x s PHE 88 N -2.50 -0.07 -0.20 0.54 5.36 -1.26 -1.53 117.98 118.33 3i4x s PHE 88 Ca 0.43 0.21 -0.13 0.00 -0.96 0.00 0.00 56.93 56.49 3i4x s PHE 88 Cb 0.36 -0.03 0.06 0.00 -0.34 0.00 0.00 43.02 43.08 3i4x s PHE 88 CO 0.08 -0.06 0.49 -2.00 -1.46 0.00 0.00 175.22 172.27 3i4x s GLU 89 N 0.34 0.50 0.10 10.12 2.12 -0.06 -4.56 118.70 127.26 3i4x s GLU 89 Ca -0.03 0.85 -0.16 0.00 0.36 0.00 0.00 54.97 56.00 3i4x s GLU 89 Cb -0.04 0.08 -0.07 0.00 0.26 0.00 0.00 34.13 34.37 3i4x s GLU 89 CO -0.01 -0.13 0.52 -0.51 -0.54 0.00 0.00 175.26 174.59 3i4x s LEU 90 N 1.17 4.42 0.12 2.70 1.43 -1.26 -0.39 118.68 126.88 3i4x s LEU 90 Ca -0.07 1.10 0.08 0.00 -1.03 0.00 0.00 54.13 54.20 3i4x s LEU 90 Cb -0.06 -3.03 -0.04 0.00 0.03 0.00 0.00 46.19 43.09 3i4x s LEU 90 CO -0.11 0.19 -0.19 -0.94 0.23 0.00 0.00 176.35 175.53 3i4x s SER 91 N -1.44 2.50 -0.18 2.29 1.04 -0.39 -2.08 113.70 115.44 3i4x s SER 91 Ca 0.33 -0.76 -0.01 0.00 0.48 0.00 0.00 55.95 55.99 3i4x s SER 91 Cb -0.17 -0.14 0.00 0.00 0.10 0.00 0.00 66.02 65.82 3i4x s SER 91 CO 0.18 0.00 -0.14 -0.22 0.98 0.00 0.00 173.24 174.04 3i4x s LEU 92 N -2.22 2.47 -0.73 2.42 2.96 -0.22 -1.40 118.68 121.97 3i4x s LEU 92 Ca 0.10 -0.51 -0.27 0.00 -0.22 0.00 0.00 54.13 53.23 3i4x s LEU 92 Cb -0.08 -1.58 0.03 0.00 0.50 0.00 0.00 46.19 45.06 3i4x s LEU 92 CO 0.05 0.03 1.26 0.21 -1.32 0.00 0.00 176.35 176.58 3i4x s ASN 93 N 1.15 6.18 0.29 3.68 3.04 0.68 -1.02 114.94 128.93 3i4x s ASN 93 Ca 0.01 -0.42 0.10 0.00 0.04 0.00 0.00 52.86 52.59 3i4x s ASN 93 Cb -0.14 -2.56 0.41 0.00 -1.54 0.00 0.00 41.25 37.43 3i4x s ASN 93 CO -0.05 -1.80 1.65 0.00 -3.04 0.00 0.00 177.10 173.86 3i4x h SER 95 N 0.04 0.03 -0.01 0.00 4.64 -1.83 -3.28 113.55 113.13 3i4x h SER 95 Ca -0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3i4x h SER 95 Cb 1.00 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 3i4x h SER 95 CO 0.08 0.36 0.00 0.59 -0.87 0.00 0.00 176.83 176.98 3i4x n ASN 96 N -4.14 1.54 -3.97 4.97 3.02 -1.10 -5.01 115.26 110.57 3i4x n ASN 96 Ca -0.02 -1.28 -0.30 0.00 -0.03 0.00 0.00 54.58 52.95 3i4x n ASN 96 Cb 0.38 -0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.55 3i4x n ASN 96 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3i4x n SER 97 N 0.34 -3.72 -4.56 6.41 7.64 -0.19 -4.99 113.62 114.55 3i4x n SER 97 Ca 0.04 -0.86 -0.36 0.00 1.01 0.00 0.00 58.87 58.70 3i4x n SER 97 Cb 0.16 -3.57 -0.11 0.00 -1.01 0.00 0.00 64.21 59.68 3i4x n SER 97 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3i4x s ILE 98 N -3.39 4.69 0.02 0.44 -1.09 -1.06 -4.86 121.20 115.94 3i4x s ILE 98 Ca 0.56 -0.06 -0.19 0.00 -2.23 0.00 0.00 60.65 58.74 3i4x s ILE 98 Cb -0.29 -3.15 -0.06 0.00 -1.58 0.00 0.00 42.46 37.38 3i4x s ILE 98 CO 0.86 0.39 0.54 -0.69 -1.23 0.00 0.00 174.94 174.81 3i4x s VAL 99 N 0.98 4.89 0.13 2.92 1.01 -1.26 -0.23 120.40 128.83 3i4x s VAL 99 Ca 0.04 1.14 0.04 0.00 0.00 0.00 0.00 61.98 63.20 3i4x s VAL 99 Cb -0.14 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.33 3i4x s VAL 99 CO 0.03 0.49 -0.09 -0.13 0.00 0.00 0.00 175.10 175.40 3i4x s ARG 100 N -0.63 0.97 0.03 2.72 3.00 -0.49 -1.95 118.95 122.60 3i4x s ARG 100 Ca 0.28 -1.40 -0.07 0.00 0.00 0.00 0.00 55.73 54.55 3i4x s ARG 100 Cb -0.18 -0.48 -0.01 0.00 0.00 0.00 0.00 34.95 34.29 3i4x s ARG 100 CO 0.17 0.04 0.12 1.52 0.00 0.00 0.00 175.30 177.15 3i4x s TYR 101 N -3.38 0.13 0.03 -0.53 -0.85 -0.37 -1.26 117.35 111.12 3i4x s TYR 101 Ca 0.14 -0.36 0.09 0.00 -0.52 0.00 0.00 57.07 56.42 3i4x s TYR 101 Cb 0.03 -0.10 -0.03 0.00 0.38 0.00 0.00 41.96 42.25 3i4x s TYR 101 CO -0.01 -0.35 -0.26 0.99 -1.52 0.00 0.00 175.55 174.40 3i4x s THR 102 N -2.25 2.19 0.07 -3.49 2.01 0.48 -0.79 115.64 113.86 3i4x s THR 102 Ca -0.08 -1.32 -0.07 0.00 0.31 0.00 0.00 61.69 60.53 3i4x s THR 102 Cb -0.03 -1.84 -0.01 0.00 0.01 0.00 0.00 72.50 70.63 3i4x s THR 102 CO -0.03 0.40 0.14 0.72 -0.69 0.00 0.00 174.62 175.17 3i4x s PHE 103 N -0.78 0.20 -0.33 4.92 -0.12 -0.13 -0.88 117.98 120.87 3i4x s PHE 103 Ca 0.12 -0.60 -0.11 0.00 -0.05 0.00 0.00 56.93 56.28 3i4x s PHE 103 Cb -0.10 -0.12 -0.01 0.00 -0.63 0.00 0.00 43.02 42.16 3i4x s PHE 103 CO 0.02 -0.48 0.19 -2.00 -0.05 0.00 0.00 175.22 172.90 3i4x s GLU 104 N -3.51 3.36 0.25 1.99 2.12 -0.58 -1.46 118.70 120.88 3i4x s GLU 104 Ca 0.02 -0.71 -0.31 0.00 0.36 0.00 0.00 54.97 54.33 3i4x s GLU 104 Cb 0.04 -3.66 -0.12 0.00 0.26 0.00 0.00 34.13 30.64 3i4x s GLU 104 CO -0.09 -0.44 1.57 -2.30 -0.54 0.00 0.00 175.26 173.46 3i4x n PRO 105 N 5.03 2.49 -4.27 4.30 -0.02 -1.26 -4.71 135.00 136.55 3i4x n PRO 105 Ca -0.13 0.89 -0.19 0.00 -2.02 0.00 0.00 63.50 62.05 3i4x n PRO 105 Cb 0.49 -2.65 -0.15 0.00 -0.02 0.00 0.00 33.50 31.17 3i4x n PRO 105 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3i4x s ILE 106 N 0.28 0.60 0.05 4.25 1.01 0.13 -4.59 121.20 122.94 3i4x s ILE 106 Ca 0.69 -0.27 0.01 0.00 0.00 0.00 0.00 60.65 61.07 3i4x s ILE 106 Cb -0.56 -0.55 -0.00 0.00 0.01 0.00 0.00 42.46 41.36 3i4x s ILE 106 CO 0.45 0.20 0.02 -0.46 0.00 0.00 0.00 174.94 175.15 3i4x n ASN 107 N 3.30 0.73 0.07 3.58 0.23 -1.26 -4.22 115.26 117.68 3i4x n ASN 107 Ca -0.18 -1.26 0.18 0.00 -0.53 0.00 0.00 54.58 52.79 3i4x n ASN 107 Cb 0.55 0.14 0.70 0.00 -2.08 0.00 0.00 39.78 39.08 3i4x n ASN 107 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 3i4x h GLN 108 N 0.00 0.00 0.00 -3.83 3.07 -2.00 -2.07 115.11 110.28 3i4x h GLN 108 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.70 3i4x h GLN 108 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.70 3i4x h GLN 108 CO 0.05 0.00 -0.70 0.72 0.09 0.00 0.00 178.83 178.99 3i4x n HIS 109 N -4.33 0.16 -1.68 0.06 8.25 -1.26 -4.81 115.22 111.61 3i4x n HIS 109 Ca 0.07 0.05 -0.47 0.00 -0.26 0.00 0.00 57.72 57.10 3i4x n HIS 109 Cb 0.49 -0.34 -0.04 0.00 1.12 0.00 0.00 29.99 31.22 3i4x n HIS 109 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 3i4x n THR 110 N -1.71 0.41 -0.66 1.59 -1.04 -0.78 -0.96 114.28 111.13 3i4x n THR 110 Ca 0.04 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 3i4x n THR 110 Cb 0.38 -1.82 0.00 0.00 -1.82 0.00 0.00 70.33 67.07 3i4x n THR 110 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3i4x n GLY 111 N 4.12 0.88 4.02 3.41 0.00 0.55 -4.92 105.19 113.25 3i4x n GLY 111 Ca 0.21 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.04 3i4x n GLY 111 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3i4x s THR 112 N -3.35 2.56 -0.58 2.61 -4.23 -0.13 -4.75 115.64 107.77 3i4x s THR 112 Ca 0.00 -0.94 0.18 0.00 -1.18 0.00 0.00 61.69 59.75 3i4x s THR 112 Cb 0.00 -2.62 0.18 0.00 1.34 0.00 0.00 72.50 71.40 3i4x s THR 112 CO 0.00 0.00 1.54 -0.90 -0.54 0.00 0.00 174.62 174.72 3i4x n ASP 113 N -2.13 0.41 0.22 3.99 5.68 -1.26 -0.57 116.55 122.89 3i4x n ASP 113 Ca 0.12 0.64 0.13 0.00 -0.50 0.00 0.00 54.79 55.18 3i4x n ASP 113 Cb 0.60 -0.71 0.34 0.00 -1.14 0.00 0.00 41.12 40.21 3i4x n ASP 113 CO 0.00 0.00 0.00 0.11 -1.33 0.00 0.00 177.20 175.98 3i4x h LYS 114 N 0.00 0.00 0.00 0.11 1.57 -1.94 -3.40 116.57 112.91 3i4x h LYS 114 Ca 0.00 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.60 3i4x h LYS 114 Cb 0.18 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 32.35 3i4x h LYS 114 CO 0.00 0.00 -0.36 -3.47 -0.57 0.00 0.00 179.45 175.05 3i4x n ASP 115 N -2.98 -2.44 0.28 0.86 2.03 -0.07 -4.98 116.55 109.25 3i4x n ASP 115 Ca 0.03 -2.94 0.16 0.00 0.52 0.00 0.00 54.79 52.56 3i4x n ASP 115 Cb 0.45 1.56 0.75 0.00 -0.72 0.00 0.00 41.12 43.16 3i4x n ASP 115 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 3i4x h PRO 116 N 3.67 0.00 -0.27 -0.67 0.13 -1.05 0.17 132.00 133.97 3i4x h PRO 116 Ca -0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.96 3i4x h PRO 116 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 3i4x h PRO 116 CO 0.18 0.07 0.00 1.19 -0.23 0.00 0.00 178.00 179.21 3i4x n PHE 117 N -3.29 0.73 -3.65 1.56 3.72 -1.26 -4.30 117.46 110.97 3i4x n PHE 117 Ca -0.01 -0.75 -0.21 0.00 -0.05 0.00 0.00 57.45 56.43 3i4x n PHE 117 Cb 0.27 -0.21 0.04 0.00 -0.94 0.00 0.00 39.48 38.64 3i4x n PHE 117 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3i4x n ASN 118 N -0.23 -1.49 0.01 4.37 5.15 -0.99 -4.20 115.26 117.90 3i4x n ASN 118 Ca 0.17 -0.78 0.11 0.00 -0.60 0.00 0.00 54.58 53.49 3i4x n ASN 118 Cb 0.72 -4.27 -0.08 0.00 -0.53 0.00 0.00 39.78 35.61 3i4x n ASN 118 CO 0.00 0.00 0.00 1.07 1.40 0.00 0.00 177.26 179.73 3i4x n THR 119 N -4.26 0.11 -0.02 -0.44 5.66 -1.26 -4.43 114.28 109.63 3i4x n THR 119 Ca -0.29 -0.33 -0.03 0.00 -3.05 0.00 0.00 64.05 60.36 3i4x n THR 119 Cb 0.67 0.22 -0.13 0.00 -1.55 0.00 0.00 70.33 69.54 3i4x n THR 119 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 3i4x n HIS 120 N -2.07 0.54 0.05 1.09 8.25 -1.26 -4.58 115.22 117.24 3i4x n HIS 120 Ca -0.00 0.18 0.08 0.00 -0.26 0.00 0.00 57.72 57.72 3i4x n HIS 120 Cb 0.48 -0.99 0.51 0.00 1.12 0.00 0.00 29.99 31.11 3i4x n HIS 120 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3i4x h ALA 121 N 1.31 1.89 -0.78 -1.41 0.00 -1.86 -2.27 119.26 116.15 3i4x h ALA 121 Ca -0.28 -0.02 0.11 0.00 0.00 0.00 0.00 54.91 54.72 3i4x h ALA 121 Cb 1.77 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 19.41 3i4x h ALA 121 CO 0.04 0.06 0.51 0.97 0.00 0.00 0.00 179.25 180.83 3i4x h ILE 122 N 0.35 0.91 -0.82 0.00 2.10 -1.81 -1.65 117.51 116.59 3i4x h ILE 122 Ca 0.14 -0.22 -0.02 0.00 1.08 0.00 0.00 64.86 65.84 3i4x h ILE 122 Cb 0.14 0.20 -0.04 0.00 -1.09 0.00 0.00 36.82 36.03 3i4x h ILE 122 CO -0.03 0.12 0.43 -0.50 -1.08 0.00 0.00 178.15 177.08 3i4x h TRP 123 N 0.65 1.13 -0.50 2.19 4.06 -1.73 -1.37 115.95 120.39 3i4x h TRP 123 Ca 0.37 -0.03 -0.06 0.00 2.06 0.00 0.00 58.89 61.22 3i4x h TRP 123 Cb 0.55 -0.36 -0.02 0.00 -1.00 0.00 0.00 29.16 28.33 3i4x h TRP 123 CO -0.00 0.80 0.07 1.49 -3.56 0.00 0.00 178.44 177.24 3i4x h GLU 124 N 1.15 0.83 -0.84 0.49 4.81 -1.47 -1.73 114.58 117.82 3i4x h GLU 124 Ca 0.29 -0.23 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 3i4x h GLU 124 Cb 0.06 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.30 3i4x h GLU 124 CO -0.04 0.83 0.44 0.77 -0.73 0.00 0.00 179.01 180.28 3i4x h SER 125 N 0.70 1.07 -0.80 1.04 0.02 -1.20 -2.42 113.55 111.97 3i4x h SER 125 Ca 0.15 -0.11 -0.00 0.00 -0.84 0.00 0.00 61.79 60.98 3i4x h SER 125 Cb 0.41 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.64 3i4x h SER 125 CO 0.01 0.88 0.49 -0.07 -1.14 0.00 0.00 176.83 177.00 3i4x h LEU 126 N 1.18 0.95 -1.21 5.07 3.38 -1.09 -1.59 115.31 122.00 3i4x h LEU 126 Ca 0.29 -0.06 0.06 0.00 0.09 0.00 0.00 57.88 58.27 3i4x h LEU 126 Cb 0.06 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.52 3i4x h LEU 126 CO -0.04 0.73 0.56 -0.61 0.09 0.00 0.00 178.44 179.16 3i4x h GLN 127 N 1.09 0.93 0.00 1.13 4.15 -1.02 0.29 115.11 121.68 3i4x h GLN 127 Ca 0.29 -0.06 -0.13 0.00 0.77 0.00 0.00 58.65 59.52 3i4x h GLN 127 Cb -0.05 -0.21 -0.02 0.00 0.21 0.00 0.00 27.48 27.41 3i4x h GLN 127 CO -0.05 0.62 -0.63 0.45 -1.93 0.00 0.00 178.83 177.28 3i4x h HIS 128 N 0.96 0.00 0.08 3.99 3.86 -0.91 -3.36 115.15 119.77 3i4x h HIS 128 Ca 0.36 0.00 -0.34 0.00 -1.16 0.00 0.00 60.37 59.23 3i4x h HIS 128 Cb 0.19 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.63 3i4x h HIS 128 CO -0.00 0.63 -1.90 1.28 0.86 0.00 0.00 177.93 178.80 3i4x n LEU 129 N -3.69 1.96 -0.26 2.43 4.77 -0.56 -4.42 117.00 117.25 3i4x n LEU 129 Ca -0.01 0.28 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 3i4x n LEU 129 Cb 0.65 -0.63 0.07 0.00 -2.33 0.00 0.00 43.42 41.18 3i4x n LEU 129 CO 0.42 0.68 0.68 -0.07 -1.33 0.00 0.00 177.39 177.77 3i4x h LEU 130 N 0.04 -0.87 -2.22 2.23 4.07 -0.62 0.43 115.31 118.38 3i4x h LEU 130 Ca -0.38 0.24 0.00 0.00 0.08 0.00 0.00 57.88 57.82 3i4x h LEU 130 Cb 2.03 0.52 0.00 0.00 1.08 0.00 0.00 40.66 44.29 3i4x h LEU 130 CO 0.08 -0.27 0.00 -0.65 -1.08 0.00 0.00 178.44 176.53 3i4x h PRO 131 N -0.04 0.00 0.00 1.13 0.11 -1.77 -2.25 132.00 129.18 3i4x h PRO 131 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 3i4x h PRO 131 Cb 0.56 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.67 3i4x h PRO 131 CO -0.78 0.00 -0.44 1.28 -0.21 0.00 0.00 178.00 177.85 3i4x n LEU 132 N -2.83 0.44 -3.33 2.35 4.77 0.14 -4.78 117.00 113.76 3i4x n LEU 132 Ca -0.02 0.08 -0.11 0.00 -0.03 0.00 0.00 56.01 55.93 3i4x n LEU 132 Cb 0.11 -0.28 -0.07 0.00 -2.33 0.00 0.00 43.42 40.86 3i4x n LEU 132 CO 0.19 0.10 -0.10 -0.70 -1.33 0.00 0.00 177.39 175.55 3i4x s GLU 133 N -3.01 0.40 0.36 3.23 2.56 -0.85 -4.95 118.70 116.44 3i4x s GLU 133 Ca 0.11 0.04 0.08 0.00 0.00 0.00 0.00 54.97 55.21 3i4x s GLU 133 Cb 0.18 -0.40 0.68 0.00 2.00 0.00 0.00 34.13 36.58 3i4x s GLU 133 CO 0.68 -1.04 1.85 -0.22 -0.56 0.00 0.00 175.26 175.97 3i4x h LYS 134 N 8.17 0.26 0.00 4.30 3.64 -1.87 -1.91 116.57 129.17 3i4x h LYS 134 Ca -0.09 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.21 3i4x h LYS 134 Cb 1.11 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 3i4x h LYS 134 CO 0.28 0.46 0.00 -1.13 -2.27 0.00 0.00 179.45 176.79 3i4x n SER 135 N -4.21 0.00 -4.73 4.20 3.41 -1.26 -4.78 113.62 106.26 3i4x n SER 135 Ca -0.01 -0.24 -0.42 0.00 -0.26 0.00 0.00 58.87 57.95 3i4x n SER 135 Cb 0.32 -0.19 -0.03 0.00 -0.26 0.00 0.00 64.21 64.06 3i4x n SER 135 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3i4x s ILE 136 N -2.38 2.85 -0.02 -1.33 1.01 -0.72 -4.32 121.20 116.28 3i4x s ILE 136 Ca 0.24 0.64 0.03 0.00 0.00 0.00 0.00 60.65 61.56 3i4x s ILE 136 Cb 0.14 -3.41 0.00 0.00 0.01 0.00 0.00 42.46 39.20 3i4x s ILE 136 CO 0.29 0.07 -0.10 -0.62 0.00 0.00 0.00 174.94 174.58 3i4x s ASP 137 N 0.82 1.31 0.00 3.58 2.15 -0.52 -4.90 116.67 119.11 3i4x s ASP 137 Ca 0.64 -0.20 0.19 0.00 0.43 0.00 0.00 52.55 53.61 3i4x s ASP 137 Cb -0.41 -0.31 0.43 0.00 -0.30 0.00 0.00 42.92 42.33 3i4x s ASP 137 CO 0.35 0.09 1.36 0.18 -0.17 0.00 0.00 175.17 176.98 3i4x n LEU 138 N 3.18 3.36 0.04 -1.34 4.77 -1.26 -3.50 117.00 122.25 3i4x n LEU 138 Ca -0.17 -1.72 -0.12 0.00 -0.03 0.00 0.00 56.01 53.97 3i4x n LEU 138 Cb 0.55 -0.29 -0.08 0.00 -2.33 0.00 0.00 43.42 41.27 3i4x n LEU 138 CO 0.25 0.78 0.82 -0.08 -1.33 0.00 0.00 177.39 177.83 3i4x h GLU 139 N 3.67 -0.04 -0.05 3.23 4.81 -1.97 0.22 114.58 124.46 3i4x h GLU 139 Ca 0.00 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.03 3i4x h GLU 139 Cb 0.89 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.27 3i4x h GLU 139 CO 0.00 0.06 -0.81 -1.49 -0.73 0.00 0.00 179.01 176.04 3i4x h TRP 140 N -0.12 0.56 -0.47 0.92 4.06 -1.89 -2.75 115.95 116.26 3i4x h TRP 140 Ca -0.00 -0.27 0.06 0.00 2.06 0.00 0.00 58.89 60.73 3i4x h TRP 140 Cb 0.11 -0.08 -0.05 0.00 -1.00 0.00 0.00 29.16 28.14 3i4x h TRP 140 CO -0.05 1.06 0.18 0.35 -3.56 0.00 0.00 178.44 176.41 3i4x h PHE 141 N 0.26 0.31 -0.65 0.49 3.57 -1.76 0.06 116.94 119.21 3i4x h PHE 141 Ca -0.05 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 3i4x h PHE 141 Cb 1.41 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 40.06 3i4x h PHE 141 CO 0.05 0.11 0.28 0.00 -2.23 0.00 0.00 178.31 176.52 3i4x h ARG 142 N 0.35 0.96 0.37 1.11 3.08 -0.47 -0.17 114.38 119.61 3i4x h ARG 142 Ca 0.22 -0.16 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 3i4x h ARG 142 Cb 0.22 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 3i4x h ARG 142 CO -0.22 0.79 -0.29 1.25 -1.07 0.00 0.00 179.97 180.43 3i4x h HIS 143 N 0.91 -0.77 -0.47 3.04 2.76 -1.11 0.08 115.15 119.58 3i4x h HIS 143 Ca 0.22 -0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 58.32 3i4x h HIS 143 Cb 0.18 0.29 -0.02 0.00 1.55 0.00 0.00 27.41 29.41 3i4x h HIS 143 CO 0.01 -0.43 0.00 0.74 -1.30 0.00 0.00 177.93 176.95 3i4x h PHE 144 N -0.66 0.83 -0.22 5.26 0.04 -0.84 -1.78 116.94 119.57 3i4x h PHE 144 Ca -0.03 -0.11 -0.19 0.00 2.80 0.00 0.00 57.97 60.43 3i4x h PHE 144 Cb 0.57 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 38.50 3i4x h PHE 144 CO -0.14 0.77 -0.63 -0.22 -0.60 0.00 0.00 178.31 177.49 3i4x h LYS 145 N 0.73 0.77 -0.15 1.51 3.64 -0.90 0.21 116.57 122.37 3i4x h LYS 145 Ca 0.14 -0.54 0.04 0.00 -1.27 0.00 0.00 60.65 59.03 3i4x h LYS 145 Cb 0.44 0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.31 3i4x h LYS 145 CO 0.02 1.16 -0.09 1.25 -2.27 0.00 0.00 179.45 179.52 3i4x h HIS 146 N 0.57 -0.21 0.00 1.91 2.76 -0.78 -2.49 115.15 116.92 3i4x h HIS 146 Ca -0.01 0.02 -0.19 0.00 -2.20 0.00 0.00 60.37 57.99 3i4x h HIS 146 Cb 1.23 0.12 -0.02 0.00 1.55 0.00 0.00 27.41 30.29 3i4x h HIS 146 CO 0.07 -0.14 -0.85 -0.44 -1.30 0.00 0.00 177.93 175.27 3i4x h ASP 147 N -0.08 0.17 -0.00 3.26 3.32 -0.83 -3.38 116.42 118.87 3i4x h ASP 147 Ca 0.09 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.00 3i4x h ASP 147 Cb 0.21 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.71 3i4x h ASP 147 CO -0.20 0.94 -0.07 0.18 -1.72 0.00 0.00 179.24 178.37 3i4x n LEU 148 N -3.63 1.10 -4.42 1.55 4.77 0.68 -5.00 117.00 112.05 3i4x n LEU 148 Ca -0.03 -0.85 -0.22 0.00 -0.03 0.00 0.00 56.01 54.89 3i4x n LEU 148 Cb 0.80 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.79 3i4x n LEU 148 CO 0.47 0.23 -0.46 0.42 -1.33 0.00 0.00 177.39 176.72 3i4x s THR 149 N -0.76 2.16 0.41 -5.08 -4.23 -0.94 -3.74 115.64 103.46 3i4x s THR 149 Ca 0.05 -2.32 -0.26 0.00 -1.18 0.00 0.00 61.69 57.98 3i4x s THR 149 Cb 0.04 -2.19 -0.08 0.00 1.34 0.00 0.00 72.50 71.61 3i4x s THR 149 CO 0.11 -0.48 1.29 -0.76 -0.54 0.00 0.00 174.62 174.24 3i4x s LEU 150 N -3.43 4.19 0.00 4.79 1.43 -1.26 -4.84 118.68 119.56 3i4x s LEU 150 Ca 0.27 2.63 0.02 0.00 -1.03 0.00 0.00 54.13 56.01 3i4x s LEU 150 Cb -0.03 -3.94 0.09 0.00 0.03 0.00 0.00 46.19 42.34 3i4x s LEU 150 CO 0.11 -0.87 0.64 -0.46 0.23 0.00 0.00 176.35 176.01 3i4x n ASN 151 N 0.06 1.05 -0.17 2.29 0.23 -1.26 -4.87 115.26 112.59 3i4x n ASN 151 Ca 0.04 -1.84 -0.03 0.00 -0.53 0.00 0.00 54.58 52.22 3i4x n ASN 151 Cb 0.44 -0.40 0.18 0.00 -2.08 0.00 0.00 39.78 37.93 3i4x n ASN 151 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 3i4x h SER 152 N -0.28 0.84 -0.09 0.53 0.02 -1.98 -1.29 113.55 111.30 3i4x h SER 152 Ca -0.21 -0.12 -0.03 0.00 -0.84 0.00 0.00 61.79 60.58 3i4x h SER 152 Cb 0.83 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 63.15 3i4x h SER 152 CO 0.25 0.76 -0.08 -0.08 -1.14 0.00 0.00 176.83 176.54 3i4x h GLU 153 N 0.90 0.21 -0.44 3.45 4.81 -2.00 -2.26 114.58 119.25 3i4x h GLU 153 Ca 0.21 -0.11 -0.04 0.00 -0.13 0.00 0.00 59.36 59.29 3i4x h GLU 153 Cb 0.20 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 3i4x h GLU 153 CO -0.02 0.62 0.09 0.93 -0.73 0.00 0.00 179.01 179.91 3i4x h GLU 154 N -0.20 0.66 -0.39 1.92 5.08 -1.91 -2.00 114.58 117.75 3i4x h GLU 154 Ca 0.02 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.25 3i4x h GLU 154 Cb 0.58 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 3i4x h GLU 154 CO 0.02 0.61 0.22 0.77 -1.00 0.00 0.00 179.01 179.64 3i4x h SER 155 N 0.64 0.47 -0.49 1.42 0.02 -1.13 0.78 113.55 115.27 3i4x h SER 155 Ca 0.14 -0.07 -0.07 0.00 -0.84 0.00 0.00 61.79 60.95 3i4x h SER 155 Cb 0.26 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.66 3i4x h SER 155 CO -0.00 0.40 0.03 0.00 -1.14 0.00 0.00 176.83 176.12 3i4x h ALA 156 N 1.09 0.66 0.31 3.77 0.00 -1.17 0.13 119.26 124.05 3i4x h ALA 156 Ca 0.14 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3i4x h ALA 156 Cb 0.03 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3i4x h ALA 156 CO -0.02 0.44 -0.24 0.35 0.00 0.00 0.00 179.25 179.77 3i4x h PHE 157 N 0.71 -0.64 -0.77 0.00 3.57 -1.11 -0.71 116.94 117.99 3i4x h PHE 157 Ca 0.14 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.65 3i4x h PHE 157 Cb 0.47 0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.41 3i4x h PHE 157 CO 0.04 -0.36 0.51 -0.07 -2.23 0.00 0.00 178.31 176.19 3i4x h LEU 158 N -0.56 0.88 -0.98 0.59 3.38 -0.68 -1.06 115.31 116.90 3i4x h LEU 158 Ca -0.02 -0.02 0.06 0.00 0.09 0.00 0.00 57.88 57.98 3i4x h LEU 158 Cb 0.49 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.95 3i4x h LEU 158 CO -0.01 0.64 0.63 0.00 0.09 0.00 0.00 178.44 179.79 3i4x h ALA 159 N 1.29 1.34 0.00 1.53 0.00 -0.51 -1.46 119.26 121.44 3i4x h ALA 159 Ca 0.28 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3i4x h ALA 159 Cb -0.12 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.37 3i4x h ALA 159 CO -0.06 0.44 0.00 0.45 0.00 0.00 0.00 179.25 180.08 3i4x h HIS 160 N 1.16 0.00 -0.89 0.00 3.86 -0.47 -3.30 115.15 115.51 3i4x h HIS 160 Ca 0.41 0.00 -0.50 0.00 -1.16 0.00 0.00 60.37 59.12 3i4x h HIS 160 Cb 0.13 0.00 -0.42 0.00 1.06 0.00 0.00 27.41 28.17 3i4x h HIS 160 CO -0.01 0.00 -0.87 0.09 0.86 0.00 0.00 177.93 178.00 3i4x n ASN 161 N -2.54 4.15 0.00 2.45 3.02 -0.46 -4.91 115.26 116.96 3i4x n ASN 161 Ca 0.04 -3.41 0.10 0.00 -0.03 0.00 0.00 54.58 51.28 3i4x n ASN 161 Cb 0.41 -0.40 0.57 0.00 -0.61 0.00 0.00 39.78 39.76 3i4x n ASN 161 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 3i4x n ASP 162 N -0.60 0.00 -0.34 6.41 3.85 -0.65 -0.63 116.55 124.60 3i4x n ASP 162 Ca 0.35 -0.47 0.12 0.00 -0.71 0.00 0.00 54.79 54.07 3i4x n ASP 162 Cb 0.86 -0.07 0.32 0.00 -1.35 0.00 0.00 41.12 40.88 3i4x n ASP 162 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.20 176.27 3i4x h ARG 163 N 0.00 0.78 0.00 0.11 0.11 -1.91 0.36 114.38 113.83 3i4x h ARG 163 Ca 0.00 -0.05 -0.01 0.00 0.10 0.00 0.00 59.98 60.02 3i4x h ARG 163 Cb 0.05 -0.18 -0.00 0.00 1.11 0.00 0.00 29.97 30.95 3i4x h ARG 163 CO 0.00 0.52 -0.05 -0.07 0.10 0.00 0.00 179.97 180.47 3i4x h LEU 164 N 0.80 0.00 0.00 0.08 3.38 -1.21 -3.23 115.31 115.14 3i4x h LEU 164 Ca 0.53 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.32 3i4x h LEU 164 Cb 0.78 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.50 3i4x h LEU 164 CO -0.31 0.05 -1.24 0.52 0.09 0.00 0.00 178.44 177.55 3i4x n VAL 165 N -3.66 1.49 -0.98 1.22 0.31 0.20 -5.04 118.33 111.89 3i4x n VAL 165 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 3i4x n VAL 165 Cb 0.15 -2.15 0.00 0.00 -0.91 0.00 0.00 33.84 30.92 3i4x n VAL 165 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3i4x n GLY 166 N 1.46 2.10 0.25 2.92 0.00 0.10 -2.75 105.19 109.27 3i4x n GLY 166 Ca -0.27 -0.41 0.15 0.00 0.00 0.00 0.00 46.02 45.49 3i4x n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i4x n GLY 167 N 0.00 -0.48 3.69 -0.02 0.00 -1.26 -4.94 105.19 102.18 3i4x n GLY 167 Ca 0.00 -0.33 -0.45 0.00 0.00 0.00 0.00 46.02 45.25 3i4x n GLY 167 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3i4x n THR 168 N -0.38 0.16 -1.73 2.61 -1.04 -1.11 -4.79 114.28 108.00 3i4x n THR 168 Ca 0.21 -0.03 -0.42 0.00 -2.04 0.00 0.00 64.05 61.77 3i4x n THR 168 Cb 0.24 -1.81 -0.02 0.00 -1.82 0.00 0.00 70.33 66.91 3i4x n THR 168 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 3i4x n ILE 169 N 4.07 0.64 1.21 12.58 2.08 -1.26 -4.92 119.36 133.74 3i4x n ILE 169 Ca 0.18 -0.16 0.13 0.00 0.56 0.00 0.00 62.75 63.46 3i4x n ILE 169 Cb 0.32 -1.90 0.27 0.00 -0.75 0.00 0.00 39.64 37.58 3i4x n ILE 169 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 3i4x n ARG 170 N 2.78 1.70 -1.65 0.38 1.74 -1.26 -4.97 116.66 115.38 3i4x n ARG 170 Ca 0.12 -1.24 -0.58 0.00 -0.77 0.00 0.00 57.85 55.38 3i4x n ARG 170 Cb 0.35 -1.47 -0.07 0.00 -1.02 0.00 0.00 32.46 30.24 3i4x n ARG 170 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 3i4x n THR 171 N 0.43 0.13 -0.05 0.55 -1.04 -1.26 -4.80 114.28 108.23 3i4x n THR 171 Ca 0.15 -0.02 -0.22 0.00 -2.04 0.00 0.00 64.05 61.92 3i4x n THR 171 Cb 0.46 -0.83 -0.13 0.00 -1.82 0.00 0.00 70.33 68.01 3i4x n THR 171 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3i4x n GLN 172 N 3.79 0.68 -3.55 -2.82 1.13 -1.26 -4.57 117.38 110.78 3i4x n GLN 172 Ca 0.24 0.33 -0.16 0.00 -1.94 0.00 0.00 57.00 55.47 3i4x n GLN 172 Cb 0.11 -1.68 -0.06 0.00 0.11 0.00 0.00 30.24 28.72 3i4x n GLN 172 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 3i4x s ASN 173 N -6.96 -0.62 0.22 1.08 6.03 -1.26 -0.27 114.94 113.16 3i4x s ASN 173 Ca -0.27 0.78 0.02 0.00 -1.03 0.00 0.00 52.86 52.36 3i4x s ASN 173 Cb 0.07 0.65 -0.05 0.00 -3.03 0.00 0.00 41.25 38.89 3i4x s ASN 173 CO 0.68 -0.50 0.03 -0.54 -2.03 0.00 0.00 177.10 174.74 3i4x s LYS 174 N -0.90 1.29 0.12 3.55 1.02 -0.08 -4.44 119.74 120.30 3i4x s LYS 174 Ca -0.07 -1.66 0.08 0.00 0.02 0.00 0.00 55.97 54.33 3i4x s LYS 174 Cb -0.01 -0.40 -0.04 0.00 -0.52 0.00 0.00 37.83 36.86 3i4x s LYS 174 CO 0.07 -0.17 -0.18 -0.51 -0.92 0.00 0.00 175.35 173.63 3i4x s LEU 175 N -3.27 2.35 0.04 3.17 1.43 -0.54 -1.64 118.68 120.22 3i4x s LEU 175 Ca 0.30 -0.75 0.03 0.00 -1.03 0.00 0.00 54.13 52.68 3i4x s LEU 175 Cb 0.07 -0.79 -0.02 0.00 0.03 0.00 0.00 46.19 45.48 3i4x s LEU 175 CO 0.09 -0.01 -0.08 0.00 0.23 0.00 0.00 176.35 176.57 3i4x s ALA 176 N -1.58 0.65 -0.13 4.21 0.00 0.11 -0.96 121.76 124.07 3i4x s ALA 176 Ca 0.09 -0.71 0.02 0.00 0.00 0.00 0.00 51.96 51.36 3i4x s ALA 176 Cb -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.03 3i4x s ALA 176 CO 0.05 0.03 -0.20 -0.51 0.00 0.00 0.00 175.76 175.13 3i4x s LEU 177 N -1.34 2.23 -0.22 0.00 1.02 0.03 -1.18 118.68 119.20 3i4x s LEU 177 Ca -0.07 -0.54 -0.16 0.00 0.02 0.00 0.00 54.13 53.38 3i4x s LEU 177 Cb -0.09 -1.47 -0.04 0.00 0.02 0.00 0.00 46.19 44.62 3i4x s LEU 177 CO 0.01 0.11 0.43 -1.81 0.02 0.00 0.00 176.35 175.10 3i4x s ASP 178 N 0.64 6.42 -0.48 2.29 1.01 0.04 -1.23 116.67 125.36 3i4x s ASP 178 Ca -0.10 0.49 -0.15 0.00 0.71 0.00 0.00 52.55 53.50 3i4x s ASP 178 Cb -0.16 -2.24 0.09 0.00 1.01 0.00 0.00 42.92 41.61 3i4x s ASP 178 CO 0.02 -0.14 0.41 -0.76 0.21 0.00 0.00 175.17 174.91 3i4x s LEU 179 N 1.64 5.71 -0.04 1.23 1.43 -0.82 -0.72 118.68 127.11 3i4x s LEU 179 Ca 0.19 -1.45 -0.00 0.00 -1.03 0.00 0.00 54.13 51.84 3i4x s LEU 179 Cb -0.15 -2.17 0.03 0.00 0.03 0.00 0.00 46.19 43.92 3i4x s LEU 179 CO 0.09 -0.68 -0.00 -0.54 0.23 0.00 0.00 176.35 175.44 3i4x s LYS 180 N 1.61 0.46 -1.31 1.70 -0.14 -0.82 -4.34 119.74 116.90 3i4x s LYS 180 Ca 0.04 0.07 -0.06 0.00 -1.36 0.00 0.00 55.97 54.65 3i4x s LYS 180 Cb -0.25 -0.67 0.01 0.00 -1.68 0.00 0.00 37.83 35.23 3i4x s LYS 180 CO 0.05 -0.18 1.13 -0.25 -0.76 0.00 0.00 175.35 175.35 3i4x n ASP 181 N 4.43 -5.18 0.00 2.83 8.00 -1.26 -1.16 116.55 124.22 3i4x n ASP 181 Ca -0.20 -0.56 0.00 0.00 0.71 0.00 0.00 54.79 54.74 3i4x n ASP 181 Cb 0.50 -5.04 0.00 0.00 -0.02 0.00 0.00 41.12 36.56 3i4x n ASP 181 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3i4x n GLY 182 N -1.77 0.52 3.54 0.44 0.00 -1.26 -4.98 105.19 101.67 3i4x n GLY 182 Ca -0.07 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 3i4x n GLY 182 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3i4x s ARG 183 N -0.28 1.87 0.02 1.61 0.52 -0.31 -5.11 118.95 117.27 3i4x s ARG 183 Ca 0.00 -2.11 -0.00 0.00 -0.52 0.00 0.00 55.73 53.10 3i4x s ARG 183 Cb 0.00 -0.93 -0.02 0.00 0.52 0.00 0.00 34.95 34.53 3i4x s ARG 183 CO 0.00 -0.32 -0.02 -0.59 0.02 0.00 0.00 175.30 174.39 3i4x s PHE 184 N -3.16 0.20 -0.12 -0.53 -0.12 -1.26 -1.95 117.98 111.05 3i4x s PHE 184 Ca 0.27 -0.42 -0.04 0.00 -0.05 0.00 0.00 56.93 56.69 3i4x s PHE 184 Cb 0.05 -0.15 -0.03 0.00 -0.63 0.00 0.00 43.02 42.26 3i4x s PHE 184 CO 0.13 -0.16 0.02 0.00 -0.05 0.00 0.00 175.22 175.16 3i4x s ALA 185 N -1.18 3.31 -0.12 1.99 0.00 0.10 -4.92 121.76 120.94 3i4x s ALA 185 Ca -0.13 -0.78 -0.06 0.00 0.00 0.00 0.00 51.96 50.98 3i4x s ALA 185 Cb -0.08 -1.61 -0.04 0.00 0.00 0.00 0.00 23.12 21.39 3i4x s ALA 185 CO -0.01 0.46 0.11 -0.51 0.00 0.00 0.00 175.76 175.82 3i4x s LEU 186 N -0.48 4.23 0.13 0.00 1.43 -1.26 -0.78 118.68 121.95 3i4x s LEU 186 Ca 0.09 0.39 0.06 0.00 -1.03 0.00 0.00 54.13 53.63 3i4x s LEU 186 Cb -0.12 -2.03 -0.04 0.00 0.03 0.00 0.00 46.19 44.04 3i4x s LEU 186 CO 0.02 0.38 -0.14 -0.54 0.23 0.00 0.00 176.35 176.31 3i4x s LYS 187 N -0.86 1.03 0.18 1.70 1.02 -0.33 0.19 119.74 122.66 3i4x s LYS 187 Ca 0.14 -1.26 0.09 0.00 0.02 0.00 0.00 55.97 54.96 3i4x s LYS 187 Cb -0.12 -0.87 -0.04 0.00 -0.52 0.00 0.00 37.83 36.28 3i4x s LYS 187 CO 0.03 0.16 -0.19 -0.08 -0.92 0.00 0.00 175.35 174.35 3i4x s THR 188 N -2.27 1.96 -0.07 2.17 -1.32 -0.60 -0.71 115.64 114.81 3i4x s THR 188 Ca 0.10 -1.98 0.03 0.00 -1.21 0.00 0.00 61.69 58.63 3i4x s THR 188 Cb -0.04 -1.93 0.01 0.00 -1.51 0.00 0.00 72.50 69.02 3i4x s THR 188 CO 0.03 -0.29 -0.15 -0.31 -2.21 0.00 0.00 174.62 171.69 3i4x s TYR 189 N -2.02 1.70 -0.10 9.09 2.02 -0.65 -2.54 117.35 124.84 3i4x s TYR 189 Ca 0.18 -0.62 0.02 0.00 -0.37 0.00 0.00 57.07 56.28 3i4x s TYR 189 Cb -0.06 -1.20 0.01 0.00 -0.40 0.00 0.00 41.96 40.32 3i4x s TYR 189 CO 0.08 -0.28 -0.15 0.42 -1.57 0.00 0.00 175.55 174.05 3i4x s ILE 190 N 0.48 1.48 -0.49 2.71 1.01 0.10 -0.90 121.20 125.59 3i4x s ILE 190 Ca -0.13 -0.64 -0.10 0.00 0.00 0.00 0.00 60.65 59.78 3i4x s ILE 190 Cb -0.15 -1.35 0.12 0.00 0.01 0.00 0.00 42.46 41.09 3i4x s ILE 190 CO 0.04 0.44 0.37 -0.31 0.00 0.00 0.00 174.94 175.48 3i4x s TYR 191 N 0.94 3.41 -2.03 3.97 2.02 0.63 -1.63 117.35 124.65 3i4x s TYR 191 Ca -0.08 -1.81 0.09 0.00 -0.37 0.00 0.00 57.07 54.90 3i4x s TYR 191 Cb -0.15 -3.54 0.36 0.00 -0.40 0.00 0.00 41.96 38.23 3i4x s TYR 191 CO -0.01 -1.00 1.26 -2.30 -1.57 0.00 0.00 175.55 171.93 3i4x n PRO 192 N 4.93 1.31 -0.20 -1.71 -0.02 -1.25 -4.41 135.00 133.65 3i4x n PRO 192 Ca -0.08 -0.48 0.01 0.00 -2.02 0.00 0.00 63.50 60.93 3i4x n PRO 192 Cb 0.41 -1.17 0.12 0.00 -0.02 0.00 0.00 33.50 32.83 3i4x n PRO 192 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3i4x h ALA 193 N 3.40 0.74 0.02 3.55 0.00 -1.85 -0.47 119.26 124.65 3i4x h ALA 193 Ca 0.00 0.13 -0.22 0.00 0.00 0.00 0.00 54.91 54.82 3i4x h ALA 193 Cb 0.19 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3i4x h ALA 193 CO 0.00 -0.29 -1.02 -0.07 0.00 0.00 0.00 179.25 177.86 3i4x h LEU 194 N 0.28 0.08 -0.70 0.00 3.38 -1.92 -2.32 115.31 114.12 3i4x h LEU 194 Ca 0.32 -0.08 0.14 0.00 0.09 0.00 0.00 57.88 58.35 3i4x h LEU 194 Cb 0.48 -0.03 -0.10 0.00 0.09 0.00 0.00 40.66 41.11 3i4x h LEU 194 CO -0.40 1.05 0.21 0.50 0.09 0.00 0.00 178.44 179.89 3i4x h LYS 195 N 0.02 0.33 -0.44 1.13 1.63 -1.66 -1.38 116.57 116.19 3i4x h LYS 195 Ca -0.03 -0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 59.73 3i4x h LYS 195 Cb 1.77 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 33.31 3i4x h LYS 195 CO 0.14 0.22 0.19 0.00 -3.45 0.00 0.00 179.45 176.54 3i4x h ALA 196 N 1.54 0.57 -0.11 5.00 0.00 -0.81 0.15 119.26 125.60 3i4x h ALA 196 Ca 0.38 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.19 3i4x h ALA 196 Cb 0.59 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 3i4x h ALA 196 CO -0.43 0.17 -0.13 0.28 0.00 0.00 0.00 179.25 179.13 3i4x h VAL 197 N 0.57 0.64 -0.15 0.00 2.07 -0.82 0.11 116.25 118.67 3i4x h VAL 197 Ca 0.15 0.00 -0.18 0.00 0.82 0.00 0.00 66.70 67.49 3i4x h VAL 197 Cb 0.17 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 30.58 3i4x h VAL 197 CO -0.01 0.00 -0.64 -0.37 0.02 0.00 0.00 177.57 176.56 3i4x h VAL 198 N -0.17 1.33 0.00 2.57 -1.51 -0.95 -3.21 116.25 114.31 3i4x h VAL 198 Ca 0.09 -1.93 0.00 0.00 -1.23 0.00 0.00 66.70 63.62 3i4x h VAL 198 Cb 0.29 1.91 0.00 0.00 -2.13 0.00 0.00 31.29 31.36 3i4x h VAL 198 CO -0.22 0.60 -0.61 0.71 -1.23 0.00 0.00 177.57 176.82 3i4x h THR 199 N 0.40 0.00 0.00 7.19 1.35 -0.62 -3.47 112.91 117.76 3i4x h THR 199 Ca -0.01 -0.78 0.00 0.00 -0.55 0.00 0.00 66.41 65.07 3i4x h THR 199 Cb 1.21 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 69.07 3i4x h THR 199 CO 0.12 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.00 3i4x n GLY 200 N 1.23 1.44 3.83 5.82 0.00 0.36 -5.03 105.19 112.84 3i4x n GLY 200 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 3i4x n GLY 200 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3i4x s LYS 201 N -0.24 3.75 0.74 1.61 -0.14 -1.18 -5.01 119.74 119.26 3i4x s LYS 201 Ca 0.00 1.06 -0.11 0.00 -1.36 0.00 0.00 55.97 55.56 3i4x s LYS 201 Cb 0.00 -2.10 0.03 0.00 -1.68 0.00 0.00 37.83 34.08 3i4x s LYS 201 CO 0.00 -0.44 1.09 0.95 -0.76 0.00 0.00 175.35 176.19 3i4x s THR 202 N -2.51 3.38 0.18 2.17 -4.23 -1.26 -4.45 115.64 108.91 3i4x s THR 202 Ca 0.61 0.45 -0.11 0.00 -1.18 0.00 0.00 61.69 61.46 3i4x s THR 202 Cb -0.12 -3.34 0.09 0.00 1.34 0.00 0.00 72.50 70.47 3i4x s THR 202 CO 0.32 -0.58 1.71 0.40 -0.54 0.00 0.00 174.62 175.93 3i4x h ILE 203 N -0.82 1.25 -0.29 2.99 2.04 -1.89 -1.36 117.51 119.43 3i4x h ILE 203 Ca -0.46 -0.83 0.06 0.00 1.00 0.00 0.00 64.86 64.63 3i4x h ILE 203 Cb 1.26 0.60 -0.08 0.00 -0.74 0.00 0.00 36.82 37.85 3i4x h ILE 203 CO 0.62 0.32 -0.42 -0.74 0.00 0.00 0.00 178.15 177.92 3i4x h HIS 204 N 0.90 -1.22 -0.70 1.37 2.76 -1.93 0.10 115.15 116.43 3i4x h HIS 204 Ca 0.20 0.06 0.10 0.00 -2.20 0.00 0.00 60.37 58.53 3i4x h HIS 204 Cb 0.28 0.58 -0.07 0.00 1.55 0.00 0.00 27.41 29.74 3i4x h HIS 204 CO 0.02 -0.45 0.34 0.93 -1.30 0.00 0.00 177.93 177.46 3i4x h GLU 205 N -0.39 0.55 -0.11 5.26 5.08 -1.85 -0.06 114.58 123.06 3i4x h GLU 205 Ca 0.11 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3i4x h GLU 205 Cb 0.60 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 3i4x h GLU 205 CO -0.50 0.36 0.05 -0.07 -1.00 0.00 0.00 179.01 177.85 3i4x h LEU 206 N 0.57 0.14 0.14 1.33 3.38 -0.56 0.17 115.31 120.47 3i4x h LEU 206 Ca 0.35 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 3i4x h LEU 206 Cb 0.40 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.11 3i4x h LEU 206 CO -0.29 0.23 -0.07 0.58 0.09 0.00 0.00 178.44 178.99 3i4x h VAL 207 N 0.04 1.01 -0.66 1.22 2.07 -0.39 0.14 116.25 119.67 3i4x h VAL 207 Ca 0.04 -1.08 -0.07 0.00 0.82 0.00 0.00 66.70 66.40 3i4x h VAL 207 Cb 0.13 1.63 -0.03 0.00 -1.52 0.00 0.00 31.29 31.50 3i4x h VAL 207 CO -0.00 0.24 0.13 -0.26 0.02 0.00 0.00 177.57 177.70 3i4x h PHE 208 N -0.74 1.13 -0.17 1.57 0.04 -1.09 0.58 116.94 118.26 3i4x h PHE 208 Ca -0.02 -0.14 0.02 0.00 2.80 0.00 0.00 57.97 60.63 3i4x h PHE 208 Cb 0.53 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 38.34 3i4x h PHE 208 CO 0.08 0.93 0.02 0.78 -0.60 0.00 0.00 178.31 179.53 3i4x h GLY 209 N 1.06 0.17 1.03 -1.45 0.00 -0.64 0.25 103.07 103.50 3i4x h GLY 209 Ca 0.21 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.50 3i4x h GLY 209 CO 0.01 -0.01 0.31 0.23 0.00 0.00 0.00 176.54 177.08 3i4x h SER 210 N 0.08 1.04 -0.30 0.19 0.87 -0.48 -0.49 113.55 114.45 3i4x h SER 210 Ca 0.08 -0.17 -0.13 0.00 -1.23 0.00 0.00 61.79 60.34 3i4x h SER 210 Cb 0.08 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.76 3i4x h SER 210 CO -0.11 0.92 -0.27 0.58 -0.53 0.00 0.00 176.83 177.41 3i4x h VAL 211 N 1.09 1.28 -0.84 2.23 2.07 -0.66 -1.74 116.25 119.67 3i4x h VAL 211 Ca 0.25 -1.41 -0.02 0.00 0.82 0.00 0.00 66.70 66.34 3i4x h VAL 211 Cb 0.20 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.20 3i4x h VAL 211 CO -0.02 0.47 0.43 0.03 0.02 0.00 0.00 177.57 178.50 3i4x h ARG 212 N 0.69 1.19 -0.46 1.57 3.08 -0.50 0.17 114.38 120.13 3i4x h ARG 212 Ca 0.08 -0.16 0.03 0.00 0.07 0.00 0.00 59.98 60.01 3i4x h ARG 212 Cb 0.81 -0.22 -0.04 0.00 0.08 0.00 0.00 29.97 30.60 3i4x h ARG 212 CO 0.07 0.90 0.24 0.00 -1.07 0.00 0.00 179.97 180.11 3i4x h ARG 213 N 1.18 0.47 -0.35 0.04 3.08 -0.98 -2.46 114.38 115.36 3i4x h ARG 213 Ca 0.29 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 60.23 3i4x h ARG 213 Cb 0.08 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 3i4x h ARG 213 CO -0.04 0.31 -0.12 1.25 -1.07 0.00 0.00 179.97 180.30 3i4x h LEU 214 N 0.48 0.60 -1.65 3.04 5.85 -0.65 -3.07 115.31 119.91 3i4x h LEU 214 Ca 0.20 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 3i4x h LEU 214 Cb 0.08 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 40.95 3i4x h LEU 214 CO -0.12 0.74 -0.04 0.00 -0.34 0.00 0.00 178.44 178.68 3i4x h ALA 215 N 1.32 1.02 -0.54 1.25 0.00 -0.21 -0.17 119.26 121.93 3i4x h ALA 215 Ca 0.10 -0.03 0.11 0.00 0.00 0.00 0.00 54.91 55.09 3i4x h ALA 215 Cb 0.53 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.22 3i4x h ALA 215 CO 0.03 0.05 -0.07 0.28 0.00 0.00 0.00 179.25 179.53 3i4x h VAL 216 N 0.00 0.51 0.00 0.00 2.07 -1.41 -1.85 116.25 115.56 3i4x h VAL 216 Ca -0.00 -0.02 -0.20 0.00 0.82 0.00 0.00 66.70 67.30 3i4x h VAL 216 Cb 0.46 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 3i4x h VAL 216 CO 0.00 0.01 -1.16 0.03 0.02 0.00 0.00 177.57 176.48 3i4x h ARG 217 N 0.05 0.00 -2.94 1.57 3.08 -1.27 -3.40 114.38 111.47 3i4x h ARG 217 Ca 0.27 0.00 -0.61 0.00 0.07 0.00 0.00 59.98 59.70 3i4x h ARG 217 Cb 0.42 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 30.06 3i4x h ARG 217 CO -0.51 0.62 -0.69 -2.00 -1.07 0.00 0.00 179.97 176.32 3i4x s GLU 218 N -2.78 1.91 0.60 0.04 2.56 -0.26 -4.96 118.70 115.81 3i4x s GLU 218 Ca -0.01 -2.82 0.37 0.00 0.00 0.00 0.00 54.97 52.52 3i4x s GLU 218 Cb 0.09 -2.81 1.89 0.00 2.00 0.00 0.00 34.13 35.29 3i4x s GLU 218 CO 0.80 -1.28 2.19 -1.35 -0.56 0.00 0.00 175.26 175.07 3i4x h PRO 219 N 5.73 0.00 0.00 4.30 0.11 -1.57 -2.79 132.00 137.77 3i4x h PRO 219 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 3i4x h PRO 219 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.93 3i4x h PRO 219 CO 0.61 0.02 0.00 0.00 -0.21 0.00 0.00 178.00 178.42 3i4x h ARG 220 N 0.00 0.00 0.00 1.05 3.08 -1.88 -2.25 114.38 114.38 3i4x h ARG 220 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3i4x h ARG 220 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.28 3i4x h ARG 220 CO 0.00 0.00 0.00 0.44 -1.07 0.00 0.00 179.97 179.34 3i4x n ILE 221 N -2.80 0.03 -0.01 2.04 -5.35 -1.05 -4.30 119.36 107.92 3i4x n ILE 221 Ca 0.02 0.01 -0.13 0.00 -0.27 0.00 0.00 62.75 62.38 3i4x n ILE 221 Cb 0.31 -0.52 -0.10 0.00 -1.74 0.00 0.00 39.64 37.60 3i4x n ILE 221 CO 0.00 0.00 0.00 0.25 -1.76 0.00 0.00 176.55 175.04 3i4x h LEU 222 N 0.00 -0.01 -0.35 7.28 5.85 -1.60 -2.66 115.31 123.82 3i4x h LEU 222 Ca 0.00 -0.46 0.06 0.00 0.84 0.00 0.00 57.88 58.33 3i4x h LEU 222 Cb 0.42 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.39 3i4x h LEU 222 CO 0.00 0.46 -0.03 -0.65 -0.34 0.00 0.00 178.44 177.88 3i4x h PRO 223 N -0.47 0.06 0.00 5.25 0.11 -1.78 0.29 132.00 135.46 3i4x h PRO 223 Ca -0.00 -0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.02 3i4x h PRO 223 Cb 0.46 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.55 3i4x h PRO 223 CO 0.00 0.04 -0.42 -1.00 -0.21 0.00 0.00 178.00 176.42 3i4x h PRO 224 N 0.06 0.00 -0.61 1.05 0.13 -1.55 -0.82 132.00 130.26 3i4x h PRO 224 Ca 0.17 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.26 3i4x h PRO 224 Cb 0.24 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.35 3i4x h PRO 224 CO -0.31 0.42 0.22 1.25 -0.23 0.00 0.00 178.00 179.34 3i4x h LEU 225 N 0.00 0.88 -0.44 1.56 5.85 -1.02 -0.54 115.31 121.59 3i4x h LEU 225 Ca -0.00 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 58.47 3i4x h LEU 225 Cb 0.74 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 3i4x h LEU 225 CO 0.05 0.83 0.07 0.78 -0.34 0.00 0.00 178.44 179.84 3i4x h ASN 226 N 0.87 0.70 -0.37 1.25 2.35 0.22 -1.01 115.58 119.60 3i4x h ASN 226 Ca 0.20 -0.26 -0.02 0.00 -0.55 0.00 0.00 56.30 55.68 3i4x h ASN 226 Cb 0.25 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.42 3i4x h ASN 226 CO -0.01 0.78 0.17 -0.03 -1.65 0.00 0.00 177.43 176.69 3i4x h MET 227 N 0.59 0.54 -0.34 0.81 4.05 -1.09 -0.31 114.93 119.19 3i4x h MET 227 Ca 0.13 -0.09 0.04 0.00 -0.28 0.00 0.00 59.70 59.50 3i4x h MET 227 Cb 0.38 -0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 31.05 3i4x h MET 227 CO 0.01 0.50 0.13 1.25 0.23 0.00 0.00 176.91 179.02 3i4x h LEU 228 N 0.45 0.16 -0.83 3.39 5.85 -0.94 -0.71 115.31 122.68 3i4x h LEU 228 Ca 0.12 0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.78 3i4x h LEU 228 Cb 0.14 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 3i4x h LEU 228 CO -0.01 0.13 -0.21 -0.08 -0.34 0.00 0.00 178.44 177.92 3i4x h GLU 229 N 0.28 0.64 -0.35 1.25 4.81 -0.99 0.76 114.58 120.98 3i4x h GLU 229 Ca 0.15 -0.24 -0.05 0.00 -0.13 0.00 0.00 59.36 59.10 3i4x h GLU 229 Cb 0.11 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 3i4x h GLU 229 CO -0.14 0.81 0.04 0.93 -0.73 0.00 0.00 179.01 179.91 3i4x h GLU 230 N 0.57 0.59 -0.22 1.92 5.08 -0.84 0.22 114.58 121.89 3i4x h GLU 230 Ca 0.09 -0.17 0.05 0.00 -1.00 0.00 0.00 59.36 58.33 3i4x h GLU 230 Cb 0.67 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.81 3i4x h GLU 230 CO 0.05 0.68 -0.09 -0.92 -1.00 0.00 0.00 179.01 177.73 3i4x h TYR 231 N 0.41 -0.20 -0.12 4.33 3.20 -0.71 -0.51 116.97 123.37 3i4x h TYR 231 Ca 0.10 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.99 3i4x h TYR 231 Cb 0.39 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.77 3i4x h TYR 231 CO 0.03 -0.14 0.07 0.82 -1.64 0.00 0.00 178.16 177.30 3i4x h ILE 232 N -0.05 1.09 -0.91 1.81 2.04 -0.55 -2.74 117.51 118.21 3i4x h ILE 232 Ca 0.11 -0.26 0.08 0.00 1.00 0.00 0.00 64.86 65.79 3i4x h ILE 232 Cb 0.22 1.05 -0.07 0.00 -0.74 0.00 0.00 36.82 37.28 3i4x h ILE 232 CO -0.26 0.09 0.57 -0.09 0.00 0.00 0.00 178.15 178.46 3i4x h ARG 233 N 0.10 0.96 0.00 2.37 2.43 -0.39 -0.18 114.38 119.67 3i4x h ARG 233 Ca 0.04 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3i4x h ARG 233 Cb 0.08 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.41 3i4x h ARG 233 CO -0.01 0.63 0.07 -1.13 -1.51 0.00 0.00 179.97 178.03 3i4x n SER 234 N -4.62 0.06 -0.06 -3.80 3.41 -0.22 -1.13 113.62 107.27 3i4x n SER 234 Ca 0.15 0.46 0.11 0.00 -0.26 0.00 0.00 58.87 59.33 3i4x n SER 234 Cb 0.23 -0.46 0.14 0.00 -0.26 0.00 0.00 64.21 63.86 3i4x n SER 234 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3i4x n ARG 235 N -1.52 0.18 -0.29 4.33 1.74 -0.08 -5.07 116.66 115.95 3i4x n ARG 235 Ca -0.00 -0.12 0.04 0.00 -0.77 0.00 0.00 57.85 57.00 3i4x n ARG 235 Cb 0.08 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.01 3i4x n ARG 235 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3i4x n GLY 236 N 1.48 -1.50 0.03 -0.13 0.00 -0.28 -3.57 105.19 101.21 3i4x n GLY 236 Ca 0.06 -1.46 0.11 0.00 0.00 0.00 0.00 46.02 44.73 3i4x n GLY 236 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3i4x n SER 237 N -1.85 0.19 -1.04 1.61 3.41 -1.26 -2.87 113.62 111.82 3i4x n SER 237 Ca 0.00 0.53 0.08 0.00 -0.26 0.00 0.00 58.87 59.22 3i4x n SER 237 Cb 0.13 -0.58 0.28 0.00 -0.26 0.00 0.00 64.21 63.78 3i4x n SER 237 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3i4x n LYS 238 N -1.69 3.13 -1.66 4.33 5.02 -1.26 -5.02 118.16 121.00 3i4x n LYS 238 Ca 0.05 -2.90 -0.43 0.00 -2.02 0.00 0.00 58.31 53.00 3i4x n LYS 238 Cb 0.27 -1.90 -0.01 0.00 -0.02 0.00 0.00 35.03 33.36 3i4x n LYS 238 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3i4x n SER 239 N -0.40 2.32 -0.08 4.39 2.88 -1.14 -4.88 113.62 116.71 3i4x n SER 239 Ca 0.23 1.19 0.15 0.00 -1.33 0.00 0.00 58.87 59.11 3i4x n SER 239 Cb 0.95 -1.42 0.72 0.00 -0.75 0.00 0.00 64.21 63.71 3i4x n SER 239 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3i4x n THR 240 N 0.50 0.00 -4.46 2.46 -2.24 -1.26 -4.73 114.28 104.55 3i4x n THR 240 Ca 0.07 -0.04 -0.34 0.00 -2.27 0.00 0.00 64.05 61.47 3i4x n THR 240 Cb 0.34 -0.27 -0.11 0.00 -2.10 0.00 0.00 70.33 68.20 3i4x n THR 240 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3i4x s ALA 241 N -2.39 3.09 0.01 6.98 0.00 -1.26 -0.74 121.76 127.45 3i4x s ALA 241 Ca 0.33 -0.84 -0.10 0.00 0.00 0.00 0.00 51.96 51.35 3i4x s ALA 241 Cb 0.21 -1.44 0.01 0.00 0.00 0.00 0.00 23.12 21.90 3i4x s ALA 241 CO 0.44 0.44 0.20 -1.54 0.00 0.00 0.00 175.76 175.30 3i4x s SER 242 N -0.38 -0.03 0.26 0.00 1.04 -0.60 -4.95 113.70 109.03 3i4x s SER 242 Ca 0.06 -0.17 -0.30 0.00 0.48 0.00 0.00 55.95 56.02 3i4x s SER 242 Cb -0.12 0.26 -0.11 0.00 0.10 0.00 0.00 66.02 66.15 3i4x s SER 242 CO 0.02 -0.44 1.54 -2.84 0.98 0.00 0.00 173.24 172.51 3i4x s PRO 243 N -1.67 4.19 -0.07 4.02 0.02 -1.26 -0.46 135.00 139.76 3i4x s PRO 243 Ca -0.12 2.45 -0.01 0.00 0.02 0.00 0.00 61.00 63.35 3i4x s PRO 243 Cb -0.05 -3.07 -0.04 0.00 0.02 0.00 0.00 34.50 31.35 3i4x s PRO 243 CO 0.01 -0.56 -0.07 -2.13 -0.33 0.00 0.00 177.00 173.92 3i4x n ARG 244 N 2.58 0.17 -3.89 5.54 0.63 0.13 -4.70 116.66 117.12 3i4x n ARG 244 Ca 0.09 0.05 -0.08 0.00 -0.92 0.00 0.00 57.85 56.98 3i4x n ARG 244 Cb 0.38 -1.02 -0.02 0.00 0.45 0.00 0.00 32.46 32.26 3i4x n ARG 244 CO 0.00 0.00 0.00 -0.48 -2.51 0.00 0.00 177.63 174.64 3i4x s LEU 245 N -5.72 0.03 0.02 6.15 2.34 -1.24 -4.18 118.68 116.07 3i4x s LEU 245 Ca -0.10 -0.89 0.01 0.00 0.06 0.00 0.00 54.13 53.22 3i4x s LEU 245 Cb 0.03 2.47 -0.01 0.00 -0.56 0.00 0.00 46.19 48.12 3i4x s LEU 245 CO 0.15 -1.40 -0.05 -0.69 -1.06 0.00 0.00 176.35 173.31 3i4x s VAL 246 N -3.43 0.32 0.11 1.48 1.01 -0.65 -1.09 120.40 118.14 3i4x s VAL 246 Ca 0.16 -0.58 0.07 0.00 0.00 0.00 0.00 61.98 61.63 3i4x s VAL 246 Cb -0.04 -0.35 -0.03 0.00 0.00 0.00 0.00 36.38 35.95 3i4x s VAL 246 CO 0.10 -0.18 -0.19 -0.55 0.00 0.00 0.00 175.10 174.28 3i4x s SER 247 N -0.81 2.35 0.09 3.32 0.15 0.43 0.03 113.70 119.25 3i4x s SER 247 Ca -0.06 -0.70 -0.03 0.00 0.70 0.00 0.00 55.95 55.86 3i4x s SER 247 Cb -0.06 -0.12 -0.03 0.00 -1.71 0.00 0.00 66.02 64.11 3i4x s SER 247 CO -0.00 0.01 0.07 0.00 1.20 0.00 0.00 173.24 174.51 3i4x s ASP 249 N -2.94 7.21 -1.20 0.00 1.01 -1.13 -1.56 116.67 118.06 3i4x s ASP 249 Ca 0.11 2.18 -0.08 0.00 0.71 0.00 0.00 52.55 55.47 3i4x s ASP 249 Cb 0.07 -2.62 0.22 0.00 1.01 0.00 0.00 42.92 41.61 3i4x s ASP 249 CO -0.07 -0.18 1.68 0.18 0.21 0.00 0.00 175.17 177.00 3i4x n LEU 250 N 0.96 6.45 -4.17 1.23 4.32 0.13 -4.81 117.00 121.10 3i4x n LEU 250 Ca 0.00 -4.86 -0.16 0.00 -0.02 0.00 0.00 56.01 50.98 3i4x n LEU 250 Cb 0.46 -1.41 -0.07 0.00 -1.62 0.00 0.00 43.42 40.78 3i4x n LEU 250 CO 0.51 1.45 -0.01 0.28 -1.22 0.00 0.00 177.39 178.41 3i4x s THR 251 N -0.77 0.00 0.33 -5.08 -1.32 -1.23 -1.43 115.64 106.13 3i4x s THR 251 Ca 0.36 -1.80 -0.28 0.00 -1.21 0.00 0.00 61.69 58.76 3i4x s THR 251 Cb 0.06 -2.53 -0.12 0.00 -1.51 0.00 0.00 72.50 68.40 3i4x s THR 251 CO 0.04 0.00 1.30 -1.54 -2.21 0.00 0.00 174.62 172.21 3i4x n SER 252 N -1.19 2.74 -0.33 8.08 3.41 -1.26 -4.59 113.62 120.48 3i4x n SER 252 Ca 0.03 1.20 0.20 0.00 -0.26 0.00 0.00 58.87 60.05 3i4x n SER 252 Cb 0.63 -1.47 0.42 0.00 -0.26 0.00 0.00 64.21 63.52 3i4x n SER 252 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 3i4x h PRO 253 N 2.75 0.30 0.00 4.33 0.11 -1.94 0.14 132.00 137.68 3i4x h PRO 253 Ca -0.46 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 3i4x h PRO 253 Cb 1.28 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 3i4x h PRO 253 CO 0.64 0.20 -0.11 0.00 -0.21 0.00 0.00 178.00 178.52 3i4x h ALA 254 N 1.83 1.37 -0.00 -0.75 0.00 -2.03 -2.32 119.26 117.35 3i4x h ALA 254 Ca 0.68 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.49 3i4x h ALA 254 Cb 1.49 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.26 3i4x h ALA 254 CO -0.62 0.14 -0.90 1.63 0.00 0.00 0.00 179.25 179.50 3i4x n LYS 255 N -3.75 0.14 -3.30 0.00 4.76 0.40 -4.98 118.16 111.42 3i4x n LYS 255 Ca -0.02 -0.11 -0.38 0.00 -2.87 0.00 0.00 58.31 54.93 3i4x n LYS 255 Cb 0.22 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 31.85 3i4x n LYS 255 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 3i4x s SER 256 N -2.94 6.77 0.14 4.39 0.15 -0.71 -4.97 113.70 116.53 3i4x s SER 256 Ca 0.09 0.91 -0.17 0.00 0.70 0.00 0.00 55.95 57.49 3i4x s SER 256 Cb 0.16 -2.30 -0.07 0.00 -1.71 0.00 0.00 66.02 62.10 3i4x s SER 256 CO 0.82 0.04 0.59 -0.13 1.20 0.00 0.00 173.24 175.77 3i4x s ARG 257 N 0.32 4.11 -0.15 5.44 0.52 -1.26 -4.88 118.95 123.05 3i4x s ARG 257 Ca 0.27 0.65 -0.03 0.00 -0.52 0.00 0.00 55.73 56.10 3i4x s ARG 257 Cb -0.16 -3.02 -0.02 0.00 0.52 0.00 0.00 34.95 32.27 3i4x s ARG 257 CO 0.12 0.51 -0.06 0.42 0.02 0.00 0.00 175.30 176.32 3i4x s ILE 258 N -1.36 3.67 -0.17 1.52 1.01 -1.25 -2.86 121.20 121.76 3i4x s ILE 258 Ca 0.36 -0.44 0.01 0.00 0.00 0.00 0.00 60.65 60.58 3i4x s ILE 258 Cb -0.17 -2.60 0.01 0.00 0.01 0.00 0.00 42.46 39.71 3i4x s ILE 258 CO 0.19 0.49 -0.18 -0.54 0.00 0.00 0.00 174.94 174.91 3i4x s LYS 259 N 0.44 3.09 -0.19 2.79 1.02 0.66 -0.57 119.74 126.98 3i4x s LYS 259 Ca -0.05 -0.79 -0.07 0.00 0.02 0.00 0.00 55.97 55.07 3i4x s LYS 259 Cb -0.15 -2.61 -0.04 0.00 -0.52 0.00 0.00 37.83 34.52 3i4x s LYS 259 CO 0.03 -0.12 0.05 0.42 -0.92 0.00 0.00 175.35 174.81 3i4x s ILE 260 N 1.12 4.67 -0.17 2.17 1.01 -0.25 -0.43 121.20 129.33 3i4x s ILE 260 Ca 0.01 -0.08 -0.06 0.00 0.00 0.00 0.00 60.65 60.52 3i4x s ILE 260 Cb -0.14 -3.11 -0.04 0.00 0.01 0.00 0.00 42.46 39.18 3i4x s ILE 260 CO -0.07 0.45 0.05 -0.31 0.00 0.00 0.00 174.94 175.06 3i4x s TYR 261 N 0.48 3.24 -0.10 3.97 2.02 -0.25 -0.20 117.35 126.52 3i4x s TYR 261 Ca 0.03 0.08 -0.02 0.00 -0.37 0.00 0.00 57.07 56.78 3i4x s TYR 261 Cb -0.13 -2.03 -0.03 0.00 -0.40 0.00 0.00 41.96 39.37 3i4x s TYR 261 CO 0.01 0.20 -0.01 -0.51 -1.57 0.00 0.00 175.55 173.67 3i4x s LEU 262 N 0.15 3.48 -0.07 -1.29 1.43 0.16 -0.69 118.68 121.86 3i4x s LEU 262 Ca 0.04 0.08 -0.20 0.00 -1.03 0.00 0.00 54.13 53.02 3i4x s LEU 262 Cb -0.12 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.25 3i4x s LEU 262 CO 0.01 0.34 0.57 -0.22 0.23 0.00 0.00 176.35 177.28 3i4x s LEU 263 N -0.65 4.33 -0.34 1.79 2.96 0.39 -1.77 118.68 125.39 3i4x s LEU 263 Ca 0.10 1.02 0.02 0.00 -0.22 0.00 0.00 54.13 55.05 3i4x s LEU 263 Cb -0.12 -2.86 0.09 0.00 0.50 0.00 0.00 46.19 43.80 3i4x s LEU 263 CO 0.02 0.00 0.05 -0.70 -1.32 0.00 0.00 176.35 174.40 3i4x s GLU 264 N 0.41 1.75 0.54 1.98 2.56 0.78 -1.55 118.70 125.17 3i4x s GLU 264 Ca 0.31 -1.75 0.32 0.00 0.00 0.00 0.00 54.97 53.85 3i4x s GLU 264 Cb -0.17 -3.23 1.41 0.00 2.00 0.00 0.00 34.13 34.15 3i4x s GLU 264 CO 0.14 -0.89 2.01 1.96 -0.56 0.00 0.00 175.26 177.93 3i4x h GLN 265 N 7.74 0.00 -5.88 4.30 4.20 -1.18 0.69 115.11 124.98 3i4x h GLN 265 Ca -0.09 0.00 -0.61 0.00 0.06 0.00 0.00 58.65 58.01 3i4x h GLN 265 Cb 1.03 0.00 -0.12 0.00 0.30 0.00 0.00 27.48 28.69 3i4x h GLN 265 CO 0.54 0.06 0.54 1.41 -0.67 0.00 0.00 178.83 180.71 3i4x s MET 266 N -3.78 3.36 -0.77 1.46 1.75 -1.26 -0.78 119.30 119.28 3i4x s MET 266 Ca -0.00 -0.20 -0.22 0.00 -1.25 0.00 0.00 55.69 54.03 3i4x s MET 266 Cb 0.10 -4.02 0.09 0.00 2.84 0.00 0.00 34.83 33.83 3i4x s MET 266 CO 0.55 -1.41 1.06 0.08 -0.65 0.00 0.00 175.02 174.66 3i4x s VAL 267 N 3.84 4.40 0.13 10.11 1.01 -0.37 -4.76 120.40 134.75 3i4x s VAL 267 Ca 0.31 -0.75 -0.15 0.00 0.00 0.00 0.00 61.98 61.39 3i4x s VAL 267 Cb -0.12 -4.75 0.03 0.00 0.00 0.00 0.00 36.38 31.54 3i4x s VAL 267 CO 0.20 -1.52 0.39 -0.94 0.00 0.00 0.00 175.10 173.23 3i4x s SER 268 N 3.77 -0.19 0.18 3.32 1.04 -1.26 -0.17 113.70 120.39 3i4x s SER 268 Ca 0.28 -0.40 -0.12 0.00 0.48 0.00 0.00 55.95 56.19 3i4x s SER 268 Cb -0.12 0.47 0.10 0.00 0.10 0.00 0.00 66.02 66.58 3i4x s SER 268 CO 0.03 -0.87 1.80 0.25 0.98 0.00 0.00 173.24 175.43 3i4x h LEU 269 N 2.39 0.79 -0.11 2.42 5.85 -1.98 0.55 115.31 125.21 3i4x h LEU 269 Ca -0.33 -0.09 0.04 0.00 0.84 0.00 0.00 57.88 58.33 3i4x h LEU 269 Cb 1.25 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 42.03 3i4x h LEU 269 CO 0.47 0.65 -0.16 -0.08 -0.34 0.00 0.00 178.44 178.98 3i4x h GLU 270 N 0.86 -0.20 -0.60 1.25 4.81 -1.97 0.34 114.58 119.07 3i4x h GLU 270 Ca 0.22 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.50 3i4x h GLU 270 Cb 0.04 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.42 3i4x h GLU 270 CO -0.04 -0.14 0.35 0.00 -0.73 0.00 0.00 179.01 178.46 3i4x h ALA 271 N 0.82 0.78 -0.53 2.92 0.00 -1.80 -0.79 119.26 120.67 3i4x h ALA 271 Ca 0.09 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 3i4x h ALA 271 Cb 0.34 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3i4x h ALA 271 CO -0.24 0.07 -0.12 1.98 0.00 0.00 0.00 179.25 180.95 3i4x h MET 272 N 0.69 0.99 -0.68 0.00 1.85 -0.15 -2.58 114.93 115.05 3i4x h MET 272 Ca 0.25 -0.37 -0.05 0.00 -0.61 0.00 0.00 59.70 58.92 3i4x h MET 272 Cb 0.06 -0.06 -0.03 0.00 0.43 0.00 0.00 31.60 32.00 3i4x h MET 272 CO -0.12 1.05 0.23 0.93 -0.40 0.00 0.00 176.91 178.59 3i4x h GLU 273 N 0.88 1.05 -0.70 0.39 5.08 -0.06 -1.40 114.58 119.81 3i4x h GLU 273 Ca 0.14 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 3i4x h GLU 273 Cb 0.68 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 3i4x h GLU 273 CO 0.05 0.90 0.41 0.22 -1.00 0.00 0.00 179.01 179.58 3i4x h ASP 274 N 0.99 0.85 -0.25 1.42 3.58 -1.06 -0.33 116.42 121.61 3i4x h ASP 274 Ca 0.22 -0.05 -0.09 0.00 0.42 0.00 0.00 57.03 57.53 3i4x h ASP 274 Cb 0.28 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 41.11 3i4x h ASP 274 CO -0.01 0.66 -0.21 -0.07 -2.88 0.00 0.00 179.24 176.74 3i4x h LEU 275 N 0.97 0.61 -0.70 2.28 3.38 -1.18 0.18 115.31 120.84 3i4x h LEU 275 Ca 0.25 -0.46 0.06 0.00 0.09 0.00 0.00 57.88 57.82 3i4x h LEU 275 Cb -0.01 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.51 3i4x h LEU 275 CO -0.04 0.94 0.41 -0.25 0.09 0.00 0.00 178.44 179.58 3i4x h TRP 276 N 0.29 0.75 -0.69 1.13 2.91 -0.62 -2.63 115.95 117.09 3i4x h TRP 276 Ca 0.04 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.09 3i4x h TRP 276 Cb 0.75 -0.23 0.00 0.00 -0.51 0.00 0.00 29.16 29.17 3i4x h TRP 276 CO 0.07 0.37 0.00 0.25 -1.03 0.00 0.00 178.44 178.10 3i4x n THR 277 N -4.75 1.02 -3.98 2.65 -2.24 -0.19 -4.77 114.28 102.02 3i4x n THR 277 Ca 0.09 -1.00 -0.37 0.00 -2.27 0.00 0.00 64.05 60.50 3i4x n THR 277 Cb 0.16 0.49 0.00 0.00 -2.10 0.00 0.00 70.33 68.89 3i4x n THR 277 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3i4x n LEU 278 N 1.51 -1.42 -3.18 3.22 4.32 -0.73 -0.87 117.00 119.85 3i4x n LEU 278 Ca 0.23 -1.17 -0.20 0.00 -0.02 0.00 0.00 56.01 54.85 3i4x n LEU 278 Cb 0.61 -1.94 0.07 0.00 -1.62 0.00 0.00 43.42 40.54 3i4x n LEU 278 CO 0.16 0.60 0.21 0.61 -1.22 0.00 0.00 177.39 177.75 3i4x n GLY 279 N -2.04 -0.34 2.30 -0.72 0.00 0.54 -2.66 105.19 102.27 3i4x n GLY 279 Ca -0.17 0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.97 3i4x n GLY 279 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3i4x n GLY 280 N -1.77 0.88 0.19 -0.02 0.00 -0.85 -4.91 105.19 98.70 3i4x n GLY 280 Ca -0.01 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.06 3i4x n GLY 280 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3i4x h ARG 281 N 3.45 0.00 -4.84 1.61 3.08 -0.93 -3.41 114.38 113.34 3i4x h ARG 281 Ca 0.00 0.00 -0.66 0.00 0.07 0.00 0.00 59.98 59.39 3i4x h ARG 281 Cb 0.00 0.00 -0.19 0.00 0.08 0.00 0.00 29.97 29.86 3i4x h ARG 281 CO 0.00 0.39 -0.53 1.03 -1.07 0.00 0.00 179.97 179.79 3i4x s ARG 282 N -3.69 3.69 0.00 0.04 0.52 -0.05 -4.90 118.95 114.55 3i4x s ARG 282 Ca -0.00 -0.50 0.00 0.00 -0.52 0.00 0.00 55.73 54.71 3i4x s ARG 282 Cb 0.12 -3.64 0.00 0.00 0.52 0.00 0.00 34.95 31.95 3i4x s ARG 282 CO 0.69 -0.29 0.67 2.89 0.02 0.00 0.00 175.30 179.28 3i4x n ARG 283 N 5.04 0.00 -0.83 3.54 1.85 -1.26 -4.75 116.66 120.24 3i4x n ARG 283 Ca -0.14 -0.59 -0.30 0.00 -1.00 0.00 0.00 57.85 55.82 3i4x n ARG 283 Cb 0.51 -0.37 0.17 0.00 -1.05 0.00 0.00 32.46 31.72 3i4x n ARG 283 CO 0.00 0.00 0.00 0.16 -0.01 0.00 0.00 177.63 177.78 3i4x s ASP 284 N -0.44 2.79 0.35 2.89 -4.77 -1.26 -4.82 116.67 111.42 3i4x s ASP 284 Ca 0.00 1.86 0.04 0.00 -3.30 0.00 0.00 52.55 51.14 3i4x s ASP 284 Cb 0.00 -2.43 0.65 0.00 -1.09 0.00 0.00 42.92 40.05 3i4x s ASP 284 CO 0.00 -3.13 1.96 0.00 0.70 0.00 0.00 175.17 174.70 3i4x h ALA 285 N -1.89 1.49 -0.13 2.11 0.00 -1.99 -2.14 119.26 116.71 3i4x h ALA 285 Ca -0.49 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.27 3i4x h ALA 285 Cb 1.28 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 3i4x h ALA 285 CO 0.47 0.41 -0.09 1.03 0.00 0.00 0.00 179.25 181.07 3i4x h SER 286 N 0.67 0.30 -0.56 0.00 0.87 -1.99 0.11 113.55 112.96 3i4x h SER 286 Ca 0.17 -0.44 0.11 0.00 -1.23 0.00 0.00 61.79 60.40 3i4x h SER 286 Cb 0.09 -0.08 -0.11 0.00 -0.44 0.00 0.00 62.40 61.86 3i4x h SER 286 CO -0.02 0.68 -0.15 0.74 -0.53 0.00 0.00 176.83 177.55 3i4x h THR 287 N -0.07 0.43 -0.73 2.23 2.02 -1.87 -1.70 112.91 113.21 3i4x h THR 287 Ca 0.03 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.14 3i4x h THR 287 Cb 0.57 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 67.38 3i4x h THR 287 CO 0.02 0.00 0.22 -0.07 0.37 0.00 0.00 175.52 176.06 3i4x h LEU 288 N -0.01 1.08 -0.99 2.58 3.38 -1.12 0.75 115.31 120.99 3i4x h LEU 288 Ca 0.27 -0.22 0.04 0.00 0.09 0.00 0.00 57.88 58.07 3i4x h LEU 288 Cb 0.42 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.82 3i4x h LEU 288 CO -0.58 1.01 0.64 -0.33 0.09 0.00 0.00 178.44 179.27 3i4x h GLU 289 N 1.09 1.18 -0.37 1.13 5.08 -0.38 -1.99 114.58 120.33 3i4x h GLU 289 Ca 0.23 -0.07 -0.11 0.00 -1.00 0.00 0.00 59.36 58.42 3i4x h GLU 289 Cb 0.32 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 3i4x h GLU 289 CO -0.00 0.78 -0.18 0.78 -1.00 0.00 0.00 179.01 179.39 3i4x h GLY 290 N 1.22 0.85 0.50 -3.84 0.00 -0.63 -3.06 103.07 98.10 3i4x h GLY 290 Ca 0.40 -0.76 0.11 0.00 0.00 0.00 0.00 47.33 47.07 3i4x h GLY 290 CO -0.14 0.69 0.54 -2.00 0.00 0.00 0.00 176.54 175.64 3i4x h LEU 291 N 0.58 0.79 -0.52 3.11 5.85 -0.28 -0.31 115.31 124.52 3i4x h LEU 291 Ca 0.08 0.05 0.09 0.00 0.84 0.00 0.00 57.88 58.94 3i4x h LEU 291 Cb 0.73 -0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.58 3i4x h LEU 291 CO 0.05 0.44 0.09 0.28 -0.34 0.00 0.00 178.44 178.96 3i4x h SER 292 N 0.88 -0.03 -0.42 1.25 0.02 -1.28 0.65 113.55 114.62 3i4x h SER 292 Ca 0.44 0.10 -0.06 0.00 -0.84 0.00 0.00 61.79 61.42 3i4x h SER 292 Cb 0.41 0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.08 3i4x h SER 292 CO -0.26 0.01 0.01 -0.07 -1.14 0.00 0.00 176.83 175.39 3i4x h LEU 293 N 0.23 0.72 -0.28 5.07 3.38 -1.23 -0.68 115.31 122.52 3i4x h LEU 293 Ca 0.26 -0.30 0.07 0.00 0.09 0.00 0.00 57.88 58.00 3i4x h LEU 293 Cb 0.37 -0.19 -0.07 0.00 0.09 0.00 0.00 40.66 40.85 3i4x h LEU 293 CO -0.35 0.85 -0.23 0.58 0.09 0.00 0.00 178.44 179.37 3i4x h VAL 294 N 0.58 0.40 -0.71 1.22 2.07 -0.73 0.27 116.25 119.35 3i4x h VAL 294 Ca 0.12 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.66 3i4x h VAL 294 Cb 0.47 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 30.60 3i4x h VAL 294 CO 0.02 0.00 0.46 0.03 0.02 0.00 0.00 177.57 178.10 3i4x h ARG 295 N -0.21 0.90 -0.34 1.57 3.08 -0.68 0.26 114.38 118.95 3i4x h ARG 295 Ca 0.15 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.14 3i4x h ARG 295 Cb 0.45 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.28 3i4x h ARG 295 CO -0.41 0.60 0.18 1.49 -1.07 0.00 0.00 179.97 180.76 3i4x h GLU 296 N 0.93 0.48 0.01 0.04 4.81 -0.61 0.14 114.58 120.39 3i4x h GLU 296 Ca 0.27 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.46 3i4x h GLU 296 Cb -0.05 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.22 3i4x h GLU 296 CO -0.08 0.41 -0.07 -0.07 -0.73 0.00 0.00 179.01 178.46 3i4x h LEU 297 N 0.42 -0.21 -0.69 1.64 3.38 -0.14 -0.05 115.31 119.66 3i4x h LEU 297 Ca 0.12 0.03 0.15 0.00 0.09 0.00 0.00 57.88 58.27 3i4x h LEU 297 Cb 0.07 0.09 -0.12 0.00 0.09 0.00 0.00 40.66 40.79 3i4x h LEU 297 CO -0.02 -0.11 -0.04 -0.25 0.09 0.00 0.00 178.44 178.11 3i4x h TRP 298 N -0.14 -0.13 -0.34 1.13 2.91 -0.22 0.27 115.95 119.43 3i4x h TRP 298 Ca 0.03 0.05 -0.11 0.00 1.13 0.00 0.00 58.89 59.99 3i4x h TRP 298 Cb 0.17 0.17 -0.01 0.00 -0.51 0.00 0.00 29.16 28.97 3i4x h TRP 298 CO -0.14 -0.23 -0.24 -0.44 -1.03 0.00 0.00 178.44 176.36 3i4x h ASP 299 N 0.08 0.68 -0.03 2.65 3.32 0.01 -2.10 116.42 121.04 3i4x h ASP 299 Ca 0.36 -0.24 -0.15 0.00 0.02 0.00 0.00 57.03 57.02 3i4x h ASP 299 Cb 0.61 -0.19 0.01 0.00 0.22 0.00 0.00 39.33 39.98 3i4x h ASP 299 CO -0.63 0.90 -0.56 -0.07 -1.72 0.00 0.00 179.24 177.16 3i4x h LEU 300 N 0.59 0.55 -0.25 1.55 3.38 -0.31 -3.34 115.31 117.47 3i4x h LEU 300 Ca 0.08 -0.72 -0.21 0.00 0.09 0.00 0.00 57.88 57.12 3i4x h LEU 300 Cb 0.72 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3i4x h LEU 300 CO 0.06 1.19 -0.78 0.40 0.09 0.00 0.00 178.44 179.40 3i4x h ILE 301 N -0.05 1.32 -5.84 1.22 2.04 -0.47 -3.43 117.51 112.29 3i4x h ILE 301 Ca -0.06 -2.07 -0.35 0.00 1.00 0.00 0.00 64.86 63.38 3i4x h ILE 301 Cb 1.26 2.07 0.13 0.00 -0.74 0.00 0.00 36.82 39.53 3i4x h ILE 301 CO 0.11 0.64 -0.88 0.00 0.00 0.00 0.00 178.15 178.03 3i4x n GLN 302 N -3.88 -2.68 -1.88 2.37 6.02 -0.79 -4.92 117.38 111.61 3i4x n GLN 302 Ca -0.06 0.68 -0.41 0.00 -0.01 0.00 0.00 57.00 57.20 3i4x n GLN 302 Cb 0.74 -5.14 -0.00 0.00 1.02 0.00 0.00 30.24 26.85 3i4x n GLN 302 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3i4x s LEU 303 N -6.05 4.30 -0.21 1.08 1.43 -1.26 -4.91 118.68 113.06 3i4x s LEU 303 Ca 0.35 2.94 -0.29 0.00 -1.03 0.00 0.00 54.13 56.10 3i4x s LEU 303 Cb -0.08 -3.72 -0.06 0.00 0.03 0.00 0.00 46.19 42.36 3i4x s LEU 303 CO 0.79 -0.85 2.20 -0.24 0.23 0.00 0.00 176.35 178.49 3i4x n SER 304 N 0.41 3.24 -4.85 2.29 2.88 -1.26 -4.96 113.62 111.37 3i4x n SER 304 Ca 0.01 0.27 -0.30 0.00 -1.33 0.00 0.00 58.87 57.52 3i4x n SER 304 Cb 0.40 -1.53 0.06 0.00 -0.75 0.00 0.00 64.21 62.39 3i4x n SER 304 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 3i4x s PRO 305 N 6.21 2.61 0.00 -1.46 0.04 -1.26 -4.88 135.00 136.26 3i4x s PRO 305 Ca 1.01 0.58 0.00 0.00 0.04 0.00 0.00 61.00 62.63 3i4x s PRO 305 Cb -0.38 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.18 3i4x s PRO 305 CO 0.37 -1.24 0.00 0.41 0.04 0.00 0.00 177.00 176.58 3i4x n GLY 306 N -2.57 1.87 3.69 0.56 0.00 0.76 -4.93 105.19 104.57 3i4x n GLY 306 Ca 0.07 -2.21 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 3i4x n GLY 306 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3i4x s LEU 307 N 0.00 4.34 -0.14 0.99 0.20 -1.26 -1.24 118.68 121.57 3i4x s LEU 307 Ca 0.00 2.30 -0.04 0.00 0.69 0.00 0.00 54.13 57.08 3i4x s LEU 307 Cb 0.00 -3.57 -0.03 0.00 -0.43 0.00 0.00 46.19 42.16 3i4x s LEU 307 CO 0.00 -0.78 -0.02 -0.54 -0.29 0.00 0.00 176.35 174.72 3i4x s LYS 308 N 2.29 3.54 0.70 1.98 -0.14 0.04 -4.94 119.74 123.20 3i4x s LYS 308 Ca 0.68 -0.47 -0.11 0.00 -1.36 0.00 0.00 55.97 54.70 3i4x s LYS 308 Cb -0.36 -2.91 0.01 0.00 -1.68 0.00 0.00 37.83 32.89 3i4x s LYS 308 CO 0.29 0.36 1.07 -1.12 -0.76 0.00 0.00 175.35 175.19 3i4x s SER 309 N 0.06 5.42 0.23 2.83 0.01 -1.26 -4.67 113.70 116.32 3i4x s SER 309 Ca 0.01 1.43 -0.32 0.00 1.31 0.00 0.00 55.95 58.39 3i4x s SER 309 Cb -0.13 -2.31 -0.12 0.00 0.21 0.00 0.00 66.02 63.67 3i4x s SER 309 CO 0.02 -1.39 1.70 -0.31 0.41 0.00 0.00 173.24 173.67 3i4x s TYR 310 N -3.15 2.86 1.01 2.43 1.51 -1.26 -4.67 117.35 116.08 3i4x s TYR 310 Ca 0.58 0.42 -0.17 0.00 -1.01 0.00 0.00 57.07 56.89 3i4x s TYR 310 Cb -0.13 -4.14 0.23 0.00 -0.11 0.00 0.00 41.96 37.81 3i4x s TYR 310 CO 0.54 -4.21 1.34 -1.25 -1.11 0.00 0.00 175.55 170.86 3i4x s PRO 311 N 0.81 0.26 0.44 -1.71 0.04 -1.26 -5.00 135.00 128.58 3i4x s PRO 311 Ca 0.73 -0.49 -0.24 0.00 0.04 0.00 0.00 61.00 61.03 3i4x s PRO 311 Cb -0.50 -1.81 -0.10 0.00 0.04 0.00 0.00 34.50 32.14 3i4x s PRO 311 CO 0.36 -2.66 1.08 0.00 0.04 0.00 0.00 177.00 175.82 3i4x n ALA 312 N -3.92 0.48 -0.32 8.56 0.00 -1.26 -4.85 120.51 119.21 3i4x n ALA 312 Ca 0.16 0.22 0.09 0.00 0.00 0.00 0.00 53.44 53.91 3i4x n ALA 312 Cb 0.59 -2.13 0.25 0.00 0.00 0.00 0.00 19.45 18.16 3i4x n ALA 312 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3i4x h PRO 313 N 1.59 0.68 -3.15 0.00 0.11 -1.94 -3.43 132.00 125.85 3i4x h PRO 313 Ca -0.46 -0.04 0.03 0.00 0.11 0.00 0.00 66.00 65.64 3i4x h PRO 313 Cb 1.33 -0.15 -0.07 0.00 0.11 0.00 0.00 31.00 32.22 3i4x h PRO 313 CO 0.57 0.45 0.15 1.52 -0.21 0.00 0.00 178.00 180.47 3i4x s TYR 314 N -5.94 -0.10 -0.06 0.65 -0.85 -1.26 -4.88 117.35 104.92 3i4x s TYR 314 Ca -0.12 -0.31 0.03 0.00 -0.52 0.00 0.00 57.07 56.15 3i4x s TYR 314 Cb 0.23 0.57 -0.03 0.00 0.38 0.00 0.00 41.96 43.11 3i4x s TYR 314 CO 0.79 -1.14 -0.12 -0.51 -1.52 0.00 0.00 175.55 173.05 3i4x s LEU 315 N -2.92 2.89 0.57 -3.49 1.43 0.25 -5.01 118.68 112.40 3i4x s LEU 315 Ca 0.12 -0.13 -0.21 0.00 -1.03 0.00 0.00 54.13 52.88 3i4x s LEU 315 Cb -0.04 -1.60 -0.04 0.00 0.03 0.00 0.00 46.19 44.53 3i4x s LEU 315 CO 0.05 0.35 1.28 -2.65 0.23 0.00 0.00 176.35 175.61 3i4x n PRO 316 N 2.30 1.44 -1.87 1.29 -0.02 -1.26 -4.35 135.00 132.53 3i4x n PRO 316 Ca -0.17 0.54 -0.39 0.00 -2.02 0.00 0.00 63.50 61.45 3i4x n PRO 316 Cb 0.52 -2.49 0.02 0.00 -0.02 0.00 0.00 33.50 31.53 3i4x n PRO 316 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3i4x s LEU 317 N -3.38 4.08 0.00 2.45 1.43 -1.26 -2.06 118.68 119.94 3i4x s LEU 317 Ca 0.75 2.81 0.00 0.00 -1.03 0.00 0.00 54.13 56.66 3i4x s LEU 317 Cb -0.41 -4.01 0.00 0.00 0.03 0.00 0.00 46.19 41.80 3i4x s LEU 317 CO 0.47 -1.17 0.00 0.61 0.23 0.00 0.00 176.35 176.49 3i4x n GLY 318 N 0.62 1.69 3.63 -3.19 0.00 -1.26 -4.94 105.19 101.74 3i4x n GLY 318 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 3i4x n GLY 318 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3i4x s VAL 319 N -2.57 5.07 0.27 1.61 1.01 -0.88 -5.04 120.40 119.88 3i4x s VAL 319 Ca 0.00 0.91 -0.29 0.00 0.00 0.00 0.00 61.98 62.60 3i4x s VAL 319 Cb 0.00 -3.84 -0.09 0.00 0.00 0.00 0.00 36.38 32.45 3i4x s VAL 319 CO 0.00 0.10 0.98 0.27 0.00 0.00 0.00 175.10 176.45 3i4x s ILE 320 N 2.18 3.96 0.57 2.22 -4.36 -1.26 -4.89 121.20 119.61 3i4x s ILE 320 Ca 0.22 1.87 -0.17 0.00 -0.26 0.00 0.00 60.65 62.31 3i4x s ILE 320 Cb -0.16 -4.15 -0.04 0.00 1.25 0.00 0.00 42.46 39.36 3i4x s ILE 320 CO 0.09 0.37 1.07 -2.16 0.24 0.00 0.00 174.94 174.55 3i4x s PRO 321 N -1.49 3.36 -0.46 0.37 0.04 -1.26 -5.01 135.00 130.55 3i4x s PRO 321 Ca 0.45 1.29 0.03 0.00 0.04 0.00 0.00 61.00 62.81 3i4x s PRO 321 Cb -0.26 -2.03 0.16 0.00 0.04 0.00 0.00 34.50 32.41 3i4x s PRO 321 CO 0.32 -0.79 0.33 0.16 0.04 0.00 0.00 177.00 177.06 3i4x s ASP 322 N -2.51 2.74 0.04 6.66 3.84 -1.26 -4.97 116.67 121.22 3i4x s ASP 322 Ca 0.66 -3.01 -0.27 0.00 -0.00 0.00 0.00 52.55 49.93 3i4x s ASP 322 Cb -0.17 -0.78 0.09 0.00 -1.38 0.00 0.00 42.92 40.68 3i4x s ASP 322 CO 0.33 -0.19 0.83 -1.83 -0.00 0.00 0.00 175.17 174.31 3i4x s GLU 323 N -0.03 0.95 0.02 2.11 -1.05 -1.26 -5.11 118.70 114.34 3i4x s GLU 323 Ca 0.26 -0.37 0.01 0.00 -0.15 0.00 0.00 54.97 54.72 3i4x s GLU 323 Cb -0.07 0.43 -0.02 0.00 -0.44 0.00 0.00 34.13 34.03 3i4x s GLU 323 CO -0.12 -0.42 -0.05 1.03 0.95 0.00 0.00 175.26 176.65 3i4x s ARG 324 N -3.27 0.39 0.25 -4.83 1.81 -1.26 -4.52 118.95 107.51 3i4x s ARG 324 Ca 0.05 -0.49 0.11 0.00 -1.72 0.00 0.00 55.73 53.67 3i4x s ARG 324 Cb -0.01 -0.20 -0.05 0.00 -0.45 0.00 0.00 34.95 34.25 3i4x s ARG 324 CO -0.09 0.04 -0.14 -0.51 -0.68 0.00 0.00 175.30 173.92 3i4x s LEU 325 N -1.00 2.79 0.71 2.53 1.43 -1.26 -4.73 118.68 119.15 3i4x s LEU 325 Ca -0.07 -0.83 -0.16 0.00 -1.03 0.00 0.00 54.13 52.04 3i4x s LEU 325 Cb -0.07 -1.37 -0.04 0.00 0.03 0.00 0.00 46.19 44.74 3i4x s LEU 325 CO -0.00 0.05 0.51 -2.65 0.23 0.00 0.00 176.35 174.50 3i4x n PRO 326 N -0.45 0.31 -1.44 1.29 -0.02 -1.26 -4.82 135.00 128.61 3i4x n PRO 326 Ca -0.07 0.14 -0.29 0.00 -2.02 0.00 0.00 63.50 61.26 3i4x n PRO 326 Cb 0.58 -1.81 0.14 0.00 -0.02 0.00 0.00 33.50 32.39 3i4x n PRO 326 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3i4x s LEU 327 N -0.05 2.04 0.06 2.45 1.43 0.23 -4.66 118.68 120.18 3i4x s LEU 327 Ca 0.65 1.10 0.01 0.00 -1.03 0.00 0.00 54.13 54.87 3i4x s LEU 327 Cb -0.36 -3.45 -0.03 0.00 0.03 0.00 0.00 46.19 42.38 3i4x s LEU 327 CO 0.58 -2.59 -0.06 -0.32 0.23 0.00 0.00 176.35 174.20 3i4x s MET 328 N -5.17 0.61 -0.04 1.70 1.75 -1.22 -0.16 119.30 116.78 3i4x s MET 328 Ca 0.64 -1.02 -0.13 0.00 -1.25 0.00 0.00 55.69 53.93 3i4x s MET 328 Cb -0.16 -0.10 0.02 0.00 2.84 0.00 0.00 34.83 37.44 3i4x s MET 328 CO 0.55 -0.02 0.29 0.00 -0.65 0.00 0.00 175.02 175.18 3i4x s ALA 329 N -2.66 -0.73 0.25 4.11 0.00 -0.73 -0.05 121.76 121.96 3i4x s ALA 329 Ca -0.00 0.43 0.11 0.00 0.00 0.00 0.00 51.96 52.49 3i4x s ALA 329 Cb -0.01 -0.09 -0.05 0.00 0.00 0.00 0.00 23.12 22.97 3i4x s ALA 329 CO -0.04 -0.22 -0.12 0.54 0.00 0.00 0.00 175.76 175.93 3i4x s ASN 330 N -0.91 4.02 -0.10 0.00 2.20 0.10 0.40 114.94 120.66 3i4x s ASN 330 Ca -0.10 -0.81 0.01 0.00 -0.94 0.00 0.00 52.86 51.02 3i4x s ASN 330 Cb -0.05 -0.56 0.02 0.00 -2.00 0.00 0.00 41.25 38.66 3i4x s ASN 330 CO 0.03 0.04 -0.11 -0.36 -2.94 0.00 0.00 177.10 173.76 3i4x s PHE 331 N -2.25 1.63 -0.10 1.54 0.08 0.72 -0.29 117.98 119.31 3i4x s PHE 331 Ca 0.29 -0.75 -0.14 0.00 0.12 0.00 0.00 56.93 56.45 3i4x s PHE 331 Cb -0.06 -1.24 -0.05 0.00 -0.57 0.00 0.00 43.02 41.10 3i4x s PHE 331 CO 0.16 -0.44 0.35 0.99 -0.10 0.00 0.00 175.22 176.19 3i4x s THR 332 N 1.17 5.22 -0.53 0.64 2.01 0.72 -1.09 115.64 123.78 3i4x s THR 332 Ca -0.04 0.69 -0.17 0.00 0.31 0.00 0.00 61.69 62.48 3i4x s THR 332 Cb -0.14 -3.68 0.10 0.00 0.01 0.00 0.00 72.50 68.79 3i4x s THR 332 CO -0.03 0.45 0.54 -0.76 -0.69 0.00 0.00 174.62 174.14 3i4x s LEU 333 N -0.07 5.63 0.16 4.42 1.43 0.26 -0.79 118.68 129.73 3i4x s LEU 333 Ca 0.20 -1.43 -0.18 0.00 -1.03 0.00 0.00 54.13 51.70 3i4x s LEU 333 Cb -0.14 -2.27 -0.07 0.00 0.03 0.00 0.00 46.19 43.74 3i4x s LEU 333 CO 0.08 -0.87 0.63 -1.00 0.23 0.00 0.00 176.35 175.42 3i4x s HIS 334 N 2.06 3.67 -0.86 0.29 3.76 -1.26 -3.84 115.29 119.11 3i4x s HIS 334 Ca 0.07 1.25 0.27 0.00 -0.15 0.00 0.00 55.06 56.50 3i4x s HIS 334 Cb -0.25 -2.50 0.95 0.00 1.11 0.00 0.00 32.58 31.88 3i4x s HIS 334 CO 0.06 0.42 1.79 1.04 -0.85 0.00 0.00 174.74 177.21 3i4x n GLN 335 N 0.96 0.13 -0.35 1.40 6.02 -1.26 -3.42 117.38 120.87 3i4x n GLN 335 Ca -0.05 0.10 0.07 0.00 -0.01 0.00 0.00 57.00 57.11 3i4x n GLN 335 Cb 0.51 -1.65 0.22 0.00 1.02 0.00 0.00 30.24 30.35 3i4x n GLN 335 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 3i4x n ASN 336 N -1.87 3.54 -3.68 1.08 6.94 -1.26 -4.80 115.26 115.21 3i4x n ASN 336 Ca 0.06 -2.57 -0.11 0.00 -0.02 0.00 0.00 54.58 51.94 3i4x n ASN 336 Cb 0.39 -0.42 -0.11 0.00 -2.36 0.00 0.00 39.78 37.28 3i4x n ASN 336 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3i4x s ASP 337 N -1.49 -0.22 0.00 0.53 -1.08 -1.22 -5.04 116.67 108.15 3i4x s ASP 337 Ca 0.35 0.81 0.27 0.00 -0.52 0.00 0.00 52.55 53.46 3i4x s ASP 337 Cb 0.25 0.89 1.20 0.00 -1.46 0.00 0.00 42.92 43.80 3i4x s ASP 337 CO 0.12 -0.21 1.88 -0.81 0.52 0.00 0.00 175.17 176.67 3i4x n PRO 338 N 4.84 0.10 -3.69 4.34 -0.04 -1.26 -4.38 135.00 134.90 3i4x n PRO 338 Ca -0.15 0.04 -0.36 0.00 -0.04 0.00 0.00 63.50 62.98 3i4x n PRO 338 Cb 0.52 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.39 3i4x n PRO 338 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3i4x s VAL 339 N -2.89 5.30 0.39 0.52 1.01 -1.26 -2.50 120.40 120.96 3i4x s VAL 339 Ca 0.16 0.16 -0.27 0.00 0.00 0.00 0.00 61.98 62.03 3i4x s VAL 339 Cb 0.18 -3.46 -0.10 0.00 0.00 0.00 0.00 36.38 33.00 3i4x s VAL 339 CO 0.47 0.37 1.41 -2.16 0.00 0.00 0.00 175.10 175.19 3i4x s PRO 340 N 0.93 4.03 -0.27 2.72 0.04 -1.26 -4.74 135.00 136.46 3i4x s PRO 340 Ca 0.07 2.40 -0.10 0.00 0.04 0.00 0.00 61.00 63.42 3i4x s PRO 340 Cb -0.13 -2.88 -0.05 0.00 0.04 0.00 0.00 34.50 31.48 3i4x s PRO 340 CO 0.03 -0.53 0.16 -2.00 0.04 0.00 0.00 177.00 174.70 3i4x s GLU 341 N -2.15 3.90 0.48 4.56 2.12 0.03 -4.79 118.70 122.85 3i4x s GLU 341 Ca 0.55 -0.35 -0.15 0.00 0.36 0.00 0.00 54.97 55.38 3i4x s GLU 341 Cb -0.43 -3.56 -0.07 0.00 0.26 0.00 0.00 34.13 30.32 3i4x s GLU 341 CO 0.57 -0.14 0.92 -1.25 -0.54 0.00 0.00 175.26 174.83 3i4x s PRO 342 N 1.59 3.90 -0.05 4.30 0.04 -1.26 -0.20 135.00 143.33 3i4x s PRO 342 Ca 0.07 0.81 0.01 0.00 0.04 0.00 0.00 61.00 61.92 3i4x s PRO 342 Cb -0.15 -2.21 0.02 0.00 0.04 0.00 0.00 34.50 32.20 3i4x s PRO 342 CO 0.08 -0.20 -0.03 -1.14 0.04 0.00 0.00 177.00 175.75 3i4x s GLN 343 N -3.99 0.74 0.15 4.56 0.74 0.60 -4.60 119.66 117.85 3i4x s GLN 343 Ca 0.57 -0.06 0.06 0.00 0.05 0.00 0.00 55.36 55.98 3i4x s GLN 343 Cb -0.10 -0.81 -0.04 0.00 1.10 0.00 0.00 33.01 33.16 3i4x s GLN 343 CO 0.31 -0.12 0.06 0.14 -0.55 0.00 0.00 175.29 175.13 3i4x s VAL 344 N 1.06 4.12 -0.16 1.34 -7.23 0.08 0.01 120.40 119.62 3i4x s VAL 344 Ca -0.09 -1.18 0.01 0.00 -1.81 0.00 0.00 61.98 58.90 3i4x s VAL 344 Cb -0.14 -3.06 0.02 0.00 0.56 0.00 0.00 36.38 33.76 3i4x s VAL 344 CO -0.01 -0.06 -0.15 -0.31 -0.31 0.00 0.00 175.10 174.26 3i4x s TYR 345 N -1.65 2.31 -0.44 2.82 1.51 0.93 -0.84 117.35 121.99 3i4x s TYR 345 Ca 0.29 -1.33 -0.25 0.00 -1.01 0.00 0.00 57.07 54.76 3i4x s TYR 345 Cb -0.10 -1.66 0.02 0.00 -0.11 0.00 0.00 41.96 40.11 3i4x s TYR 345 CO 0.21 -0.70 0.89 -0.06 -1.11 0.00 0.00 175.55 174.77 3i4x s PHE 346 N 1.44 2.97 -0.69 2.71 0.40 0.10 -3.37 117.98 121.55 3i4x s PHE 346 Ca 0.05 0.42 -0.21 0.00 -0.60 0.00 0.00 56.93 56.59 3i4x s PHE 346 Cb -0.13 -3.82 0.09 0.00 0.51 0.00 0.00 43.02 39.67 3i4x s PHE 346 CO -0.11 -1.00 0.93 0.99 0.70 0.00 0.00 175.22 176.72 3i4x s THR 347 N 3.57 4.52 -1.15 0.64 2.01 -1.26 -1.17 115.64 122.80 3i4x s THR 347 Ca 0.35 -0.74 0.23 0.00 0.31 0.00 0.00 61.69 61.85 3i4x s THR 347 Cb -0.11 -4.65 -0.08 0.00 0.01 0.00 0.00 72.50 67.67 3i4x s THR 347 CO 0.24 -1.38 1.17 0.35 -0.69 0.00 0.00 174.62 174.30 3i4x n THR 348 N 5.74 0.00 -1.64 -0.82 -2.24 -1.00 -4.58 114.28 109.74 3i4x n THR 348 Ca -0.00 -0.03 -0.54 0.00 -2.27 0.00 0.00 64.05 61.20 3i4x n THR 348 Cb 0.45 0.69 -0.06 0.00 -2.10 0.00 0.00 70.33 69.30 3i4x n THR 348 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 3i4x n PHE 349 N -1.31 1.71 0.00 4.78 7.35 -0.76 -0.48 117.46 128.75 3i4x n PHE 349 Ca 0.06 0.60 0.00 0.00 -0.76 0.00 0.00 57.45 57.35 3i4x n PHE 349 Cb 0.35 -2.38 0.00 0.00 0.35 0.00 0.00 39.48 37.80 3i4x n PHE 349 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3i4x n GLY 350 N 3.16 1.46 3.89 7.13 0.00 -0.90 -4.54 105.19 115.39 3i4x n GLY 350 Ca 0.21 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.94 3i4x n GLY 350 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3i4x s MET 351 N -0.93 3.71 -0.05 1.61 -1.94 0.36 -4.83 119.30 117.24 3i4x s MET 351 Ca 0.00 0.23 -0.33 0.00 -1.71 0.00 0.00 55.69 53.88 3i4x s MET 351 Cb 0.00 -2.53 -0.11 0.00 2.01 0.00 0.00 34.83 34.20 3i4x s MET 351 CO 0.00 0.11 1.93 -1.71 -0.01 0.00 0.00 175.02 175.34 3i4x n ASN 352 N -1.05 3.72 -0.04 3.03 2.85 -1.26 -4.15 115.26 118.36 3i4x n ASN 352 Ca 0.00 0.93 -0.08 0.00 -0.11 0.00 0.00 54.58 55.32 3i4x n ASN 352 Cb 0.54 -1.43 0.09 0.00 1.24 0.00 0.00 39.78 40.22 3i4x n ASN 352 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 3i4x h ASP 353 N 9.89 0.68 -0.29 1.20 3.32 -1.18 -2.04 116.42 128.00 3i4x h ASP 353 Ca -0.49 -0.28 -0.09 0.00 0.02 0.00 0.00 57.03 56.18 3i4x h ASP 353 Cb 1.26 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.60 3i4x h ASP 353 CO 0.95 0.97 -0.14 0.24 -1.72 0.00 0.00 179.24 179.54 3i4x h MET 354 N 0.54 0.73 -0.20 3.56 2.86 -1.79 0.94 114.93 121.57 3i4x h MET 354 Ca 0.06 -0.25 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 3i4x h MET 354 Cb 0.86 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.45 3i4x h MET 354 CO 0.07 0.83 0.10 0.00 1.06 0.00 0.00 176.91 178.97 3i4x h ALA 355 N 1.19 0.26 -0.61 6.32 0.00 -1.88 0.58 119.26 125.12 3i4x h ALA 355 Ca 0.11 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.96 3i4x h ALA 355 Cb 0.60 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 3i4x h ALA 355 CO 0.04 -0.18 0.37 0.28 0.00 0.00 0.00 179.25 179.77 3i4x h VAL 356 N 0.19 1.07 -0.36 0.00 2.07 -1.16 -0.21 116.25 117.86 3i4x h VAL 356 Ca 0.07 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 3i4x h VAL 356 Cb 0.12 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 3i4x h VAL 356 CO -0.01 0.13 0.17 0.00 0.02 0.00 0.00 177.57 177.89 3i4x h ALA 357 N 1.27 1.63 -0.14 1.67 0.00 -0.52 0.05 119.26 123.21 3i4x h ALA 357 Ca 0.25 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 3i4x h ALA 357 Cb 0.02 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 3i4x h ALA 357 CO -0.10 0.31 -0.18 0.22 0.00 0.00 0.00 179.25 179.49 3i4x h ASP 358 N 0.50 0.40 -0.47 0.00 3.58 -0.06 -0.71 116.42 119.67 3i4x h ASP 358 Ca 0.13 -0.51 0.09 0.00 0.42 0.00 0.00 57.03 57.16 3i4x h ASP 358 Cb 0.06 -0.11 -0.08 0.00 1.72 0.00 0.00 39.33 40.91 3i4x h ASP 358 CO -0.02 0.83 -0.02 0.00 -2.88 0.00 0.00 179.24 177.15 3i4x h ALA 359 N 0.58 0.42 -0.11 -0.78 0.00 -0.51 -1.21 119.26 117.64 3i4x h ALA 359 Ca 0.02 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3i4x h ALA 359 Cb 0.74 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 3i4x h ALA 359 CO 0.04 -0.40 0.04 -0.07 0.00 0.00 0.00 179.25 178.87 3i4x h LEU 360 N 0.09 0.16 -0.65 0.00 3.38 -0.92 -1.44 115.31 115.93 3i4x h LEU 360 Ca 0.23 -0.17 0.12 0.00 0.09 0.00 0.00 57.88 58.16 3i4x h LEU 360 Cb 0.35 -0.04 -0.09 0.00 0.09 0.00 0.00 40.66 40.97 3i4x h LEU 360 CO -0.41 0.28 0.17 0.74 0.09 0.00 0.00 178.44 179.31 3i4x h THR 361 N 0.03 0.63 -0.31 0.22 2.02 -0.93 0.35 112.91 114.91 3i4x h THR 361 Ca 0.04 -0.10 -0.01 0.00 0.77 0.00 0.00 66.41 67.10 3i4x h THR 361 Cb 0.17 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 66.87 3i4x h THR 361 CO -0.00 0.06 0.14 0.74 0.37 0.00 0.00 175.52 176.83 3i4x h THR 362 N 0.30 1.16 -0.38 3.16 2.02 -0.95 0.07 112.91 118.29 3i4x h THR 362 Ca 0.35 -0.48 0.00 0.00 0.77 0.00 0.00 66.41 67.05 3i4x h THR 362 Cb 0.52 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 67.82 3i4x h THR 362 CO -0.41 0.17 0.24 0.15 0.37 0.00 0.00 175.52 176.04 3i4x h PHE 363 N 0.37 0.49 -0.46 3.16 3.57 -0.59 -1.18 116.94 122.30 3i4x h PHE 363 Ca 0.11 0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.69 3i4x h PHE 363 Cb 0.14 -0.16 -0.07 0.00 2.79 0.00 0.00 35.95 38.65 3i4x h PHE 363 CO -0.01 0.33 0.07 0.74 -2.23 0.00 0.00 178.31 177.21 3i4x h PHE 364 N 0.50 0.11 0.07 0.41 0.04 -0.10 -1.63 116.94 116.35 3i4x h PHE 364 Ca 0.14 0.03 0.03 0.00 2.80 0.00 0.00 57.97 60.96 3i4x h PHE 364 Cb -0.02 0.02 -0.05 0.00 2.20 0.00 0.00 35.95 38.10 3i4x h PHE 364 CO -0.04 -0.02 -0.35 0.93 -0.60 0.00 0.00 178.31 178.23 3i4x h GLU 365 N 0.20 -0.53 -0.65 1.51 5.08 -0.47 -0.15 114.58 119.58 3i4x h GLU 365 Ca 0.23 0.04 0.13 0.00 -1.00 0.00 0.00 59.36 58.76 3i4x h GLU 365 Cb 0.30 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.63 3i4x h GLU 365 CO -0.31 -0.35 0.44 0.00 -1.00 0.00 0.00 179.01 177.79 3i4x h ARG 366 N -0.55 0.30 -0.00 2.33 3.08 -0.91 0.66 114.38 119.30 3i4x h ARG 366 Ca 0.04 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 3i4x h ARG 366 Cb 0.60 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.58 3i4x h ARG 366 CO -0.24 0.20 -0.12 0.54 -1.07 0.00 0.00 179.97 179.28 3i4x n ARG 367 N -4.45 0.54 -1.83 0.04 5.12 -0.64 -4.94 116.66 110.49 3i4x n ARG 367 Ca 0.12 -0.17 -0.14 0.00 -1.93 0.00 0.00 57.85 55.73 3i4x n ARG 367 Cb 0.50 -1.50 -0.03 0.00 -1.16 0.00 0.00 32.46 30.27 3i4x n ARG 367 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3i4x n GLY 368 N 1.32 0.61 3.36 -0.13 0.00 0.23 -4.92 105.19 105.67 3i4x n GLY 368 Ca 0.13 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.39 3i4x n GLY 368 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3i4x n TRP 369 N -3.32 4.01 -0.07 1.61 8.01 -0.21 -4.80 117.44 122.67 3i4x n TRP 369 Ca -0.15 -2.63 -0.07 0.00 -1.31 0.00 0.00 57.50 53.33 3i4x n TRP 369 Cb 0.54 -2.57 0.10 0.00 -2.01 0.00 0.00 31.31 27.37 3i4x n TRP 369 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.69 177.71 3i4x h SER 370 N 7.52 0.74 0.29 -0.99 0.87 -1.90 -0.25 113.55 119.83 3i4x h SER 370 Ca 0.44 -0.27 -0.01 0.00 -1.23 0.00 0.00 61.79 60.72 3i4x h SER 370 Cb 0.82 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.58 3i4x h SER 370 CO 1.55 0.96 -0.14 -0.33 -0.53 0.00 0.00 176.83 178.34 3i4x h GLU 371 N 0.63 -0.37 -0.83 2.24 4.39 -1.97 -1.23 114.58 117.44 3i4x h GLU 371 Ca 0.09 0.03 0.13 0.00 0.34 0.00 0.00 59.36 59.94 3i4x h GLU 371 Cb 0.75 0.08 -0.14 0.00 -0.10 0.00 0.00 28.75 29.34 3i4x h GLU 371 CO 0.06 -0.03 -0.39 1.98 -1.16 0.00 0.00 179.01 179.47 3i4x h MET 372 N -0.81 -0.07 -0.71 2.33 4.05 -1.93 0.14 114.93 117.93 3i4x h MET 372 Ca -0.04 0.00 -0.05 0.00 -0.28 0.00 0.00 59.70 59.34 3i4x h MET 372 Cb 0.51 0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 31.30 3i4x h MET 372 CO 0.06 -0.05 0.26 0.00 0.23 0.00 0.00 176.91 177.42 3i4x h ALA 373 N 1.15 1.12 -0.34 0.39 0.00 -1.03 -0.62 119.26 119.92 3i4x h ALA 373 Ca 0.29 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 3i4x h ALA 373 Cb 0.57 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3i4x h ALA 373 CO -0.87 0.62 -0.17 -0.09 0.00 0.00 0.00 179.25 178.75 3i4x h ARG 374 N 1.04 0.72 0.00 0.00 2.43 0.18 -3.36 114.38 115.39 3i4x h ARG 374 Ca 0.24 -0.31 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 3i4x h ARG 374 Cb 0.23 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 3i4x h ARG 374 CO -0.02 0.92 -1.64 0.25 -1.51 0.00 0.00 179.97 177.97 3i4x n THR 375 N -4.33 0.03 0.06 0.20 -2.24 0.33 -4.69 114.28 103.63 3i4x n THR 375 Ca -0.02 -0.35 -0.12 0.00 -2.27 0.00 0.00 64.05 61.28 3i4x n THR 375 Cb 0.40 0.27 -0.05 0.00 -2.10 0.00 0.00 70.33 68.84 3i4x n THR 375 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 3i4x h TYR 376 N 0.00 -0.93 -0.18 4.78 3.20 -1.26 -0.30 116.97 122.29 3i4x h TYR 376 Ca 0.00 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 3i4x h TYR 376 Cb 0.85 0.41 -0.01 0.00 1.54 0.00 0.00 36.73 39.52 3i4x h TYR 376 CO 0.00 -0.43 0.09 0.93 -1.64 0.00 0.00 178.16 177.11 3i4x h GLU 377 N -0.48 0.25 -0.42 1.82 5.08 -1.84 0.94 114.58 119.93 3i4x h GLU 377 Ca 0.06 -0.04 0.07 0.00 -1.00 0.00 0.00 59.36 58.45 3i4x h GLU 377 Cb 0.57 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.72 3i4x h GLU 377 CO -0.28 0.28 0.09 1.15 -1.00 0.00 0.00 179.01 179.25 3i4x h THR 378 N 0.16 0.78 -0.25 1.13 2.02 -1.80 -0.28 112.91 114.68 3i4x h THR 378 Ca 0.06 -0.08 -0.06 0.00 0.77 0.00 0.00 66.41 67.11 3i4x h THR 378 Cb 0.11 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 67.06 3i4x h THR 378 CO -0.01 0.04 -0.08 0.74 0.37 0.00 0.00 175.52 176.59 3i4x h THR 379 N 0.22 1.29 -0.10 3.16 2.02 -0.75 -0.73 112.91 118.02 3i4x h THR 379 Ca 0.21 -1.11 0.03 0.00 0.77 0.00 0.00 66.41 66.31 3i4x h THR 379 Cb 0.25 1.50 -0.03 0.00 -1.74 0.00 0.00 68.15 68.13 3i4x h THR 379 CO -0.27 0.34 -0.09 0.25 0.37 0.00 0.00 175.52 176.12 3i4x h LEU 380 N 0.23 -0.30 -0.91 2.58 5.85 -0.56 -0.84 115.31 121.36 3i4x h LEU 380 Ca 0.06 0.06 0.11 0.00 0.84 0.00 0.00 57.88 58.95 3i4x h LEU 380 Cb 0.55 0.15 -0.08 0.00 0.37 0.00 0.00 40.66 41.65 3i4x h LEU 380 CO 0.03 -0.13 0.55 0.11 -0.34 0.00 0.00 178.44 178.66 3i4x h LYS 381 N -0.12 0.86 0.00 1.25 1.57 -0.96 -1.87 116.57 117.29 3i4x h LYS 381 Ca 0.07 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3i4x h LYS 381 Cb 0.22 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 3i4x h LYS 381 CO -0.17 0.57 -0.00 0.66 -0.57 0.00 0.00 179.45 179.94 3i4x h SER 382 N 0.88 0.00 0.57 0.86 4.64 0.31 -0.93 113.55 119.87 3i4x h SER 382 Ca 0.45 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.64 3i4x h SER 382 Cb 0.44 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.51 3i4x h SER 382 CO -0.26 0.00 -0.60 1.88 -0.87 0.00 0.00 176.83 176.97 3i4x h TYR 383 N 0.00 0.05 -2.10 4.77 0.05 -0.78 0.26 116.97 119.22 3i4x h TYR 383 Ca -0.00 -0.02 -0.54 0.00 0.05 0.00 0.00 58.73 58.22 3i4x h TYR 383 Cb 0.26 -0.01 -0.41 0.00 1.01 0.00 0.00 36.73 37.58 3i4x h TYR 383 CO 0.00 0.63 -0.96 0.66 -1.05 0.00 0.00 178.16 177.44 3i4x n TYR 384 N -3.83 1.56 0.38 4.88 4.02 -0.42 -0.35 117.16 123.41 3i4x n TYR 384 Ca -0.01 -3.86 0.13 0.00 -0.01 0.00 0.00 57.90 54.15 3i4x n TYR 384 Cb 0.61 -0.44 0.52 0.00 -0.02 0.00 0.00 39.34 40.01 3i4x n TYR 384 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 3i4x h PRO 385 N 3.33 0.00 -0.37 -0.72 0.13 -1.51 -1.59 132.00 131.27 3i4x h PRO 385 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3i4x h PRO 385 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 3i4x h PRO 385 CO 0.62 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.11 3i4x n HIS 386 N -2.48 0.47 -2.43 1.56 8.25 -1.26 -4.98 115.22 114.35 3i4x n HIS 386 Ca 0.02 -0.26 -0.33 0.00 -0.26 0.00 0.00 57.72 56.89 3i4x n HIS 386 Cb 0.28 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.35 3i4x n HIS 386 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3i4x s ALA 387 N -1.37 2.89 -1.07 -1.41 0.00 -0.60 -4.96 121.76 115.24 3i4x s ALA 387 Ca 0.35 0.45 -0.22 0.00 0.00 0.00 0.00 51.96 52.54 3i4x s ALA 387 Cb 0.21 -3.21 0.02 0.00 0.00 0.00 0.00 23.12 20.14 3i4x s ALA 387 CO 0.29 -0.36 1.67 0.34 0.00 0.00 0.00 175.76 177.69 3i4x s ASP 388 N -2.40 6.14 0.34 0.00 -1.08 -1.26 -4.86 116.67 113.55 3i4x s ASP 388 Ca 0.64 -1.52 0.07 0.00 -0.52 0.00 0.00 52.55 51.21 3i4x s ASP 388 Cb -0.14 -2.57 0.75 0.00 -1.46 0.00 0.00 42.92 39.49 3i4x s ASP 388 CO 0.25 -1.86 1.89 0.45 0.52 0.00 0.00 175.17 176.43 3i4x h HIS 389 N 9.62 0.86 0.00 -5.34 3.86 -1.93 0.76 115.15 122.99 3i4x h HIS 389 Ca 0.23 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.47 3i4x h HIS 389 Cb 0.97 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 29.17 3i4x h HIS 389 CO 1.29 0.36 0.00 -0.25 0.86 0.00 0.00 177.93 180.20 3i4x n ASP 390 N -4.54 0.05 -0.12 2.45 8.00 -1.26 -2.45 116.55 118.68 3i4x n ASP 390 Ca 0.16 0.51 0.07 0.00 0.71 0.00 0.00 54.79 56.24 3i4x n ASP 390 Cb 0.38 -0.52 -0.06 0.00 -0.02 0.00 0.00 41.12 40.90 3i4x n ASP 390 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3i4x n LYS 391 N -1.55 1.94 -1.82 -1.24 4.76 0.25 -4.84 118.16 115.65 3i4x n LYS 391 Ca 0.04 -0.26 -0.41 0.00 -2.87 0.00 0.00 58.31 54.81 3i4x n LYS 391 Cb 0.23 -1.23 -0.01 0.00 -1.84 0.00 0.00 35.03 32.18 3i4x n LYS 391 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3i4x s LEU 392 N -2.48 4.34 -0.22 -0.35 1.43 -1.03 -4.91 118.68 115.47 3i4x s LEU 392 Ca 0.08 2.94 0.18 0.00 -1.03 0.00 0.00 54.13 56.31 3i4x s LEU 392 Cb 0.12 -3.64 0.42 0.00 0.03 0.00 0.00 46.19 43.12 3i4x s LEU 392 CO 0.54 -0.87 1.24 -0.46 0.23 0.00 0.00 176.35 177.03 3i4x n ASN 393 N 1.71 0.35 0.00 2.29 6.94 -1.26 -0.63 115.26 124.65 3i4x n ASN 393 Ca 0.06 -2.08 0.00 0.00 -0.02 0.00 0.00 54.58 52.54 3i4x n ASN 393 Cb 0.38 -0.03 0.00 0.00 -2.36 0.00 0.00 39.78 37.77 3i4x n ASN 393 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3i4x n TYR 394 N -0.68 0.00 -0.03 -2.53 0.18 -1.26 -2.11 117.16 110.74 3i4x n TYR 394 Ca -0.04 0.00 -0.15 0.00 1.88 0.00 0.00 57.90 59.59 3i4x n TYR 394 Cb 0.86 0.05 -0.12 0.00 -0.38 0.00 0.00 39.34 39.76 3i4x n TYR 394 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 3i4x h LEU 395 N 0.00 0.16 -8.50 -3.48 3.38 -1.90 -3.40 115.31 101.57 3i4x h LEU 395 Ca 0.00 -0.85 -0.60 0.00 0.09 0.00 0.00 57.88 56.52 3i4x h LEU 395 Cb 0.82 -0.05 -0.11 0.00 0.09 0.00 0.00 40.66 41.41 3i4x h LEU 395 CO 0.00 0.99 0.66 -1.00 0.09 0.00 0.00 178.44 179.18 3i4x s HIS 396 N -2.83 2.74 -0.05 1.13 3.76 -1.26 -0.08 115.29 118.69 3i4x s HIS 396 Ca -0.17 0.06 -0.24 0.00 -0.15 0.00 0.00 55.06 54.56 3i4x s HIS 396 Cb -0.00 -4.18 -0.25 0.00 1.11 0.00 0.00 32.58 29.26 3i4x s HIS 396 CO 0.73 -1.42 1.00 0.00 -0.85 0.00 0.00 174.74 174.20 3i4x h ALA 397 N 9.38 0.02 -2.33 -1.40 0.00 -1.18 -2.02 119.26 121.73 3i4x h ALA 397 Ca -0.26 -0.50 -0.09 0.00 0.00 0.00 0.00 54.91 54.05 3i4x h ALA 397 Cb 1.07 0.02 -0.20 0.00 0.00 0.00 0.00 17.79 18.68 3i4x h ALA 397 CO 1.11 0.14 -0.09 0.71 0.00 0.00 0.00 179.25 181.12 3i4x s TYR 398 N -2.98 -0.40 -0.10 0.00 1.51 -1.20 -2.38 117.35 111.81 3i4x s TYR 398 Ca -0.16 0.70 0.03 0.00 -1.01 0.00 0.00 57.07 56.64 3i4x s TYR 398 Cb 0.01 0.22 -0.01 0.00 -0.11 0.00 0.00 41.96 42.07 3i4x s TYR 398 CO 0.75 -0.45 -0.21 0.42 -1.11 0.00 0.00 175.55 174.95 3i4x s ILE 399 N -1.09 2.33 0.11 2.71 1.01 -0.32 -0.65 121.20 125.30 3i4x s ILE 399 Ca -0.11 -0.93 0.03 0.00 0.00 0.00 0.00 60.65 59.64 3i4x s ILE 399 Cb -0.03 -1.91 -0.04 0.00 0.01 0.00 0.00 42.46 40.49 3i4x s ILE 399 CO 0.06 0.55 0.16 -0.94 0.00 0.00 0.00 174.94 174.77 3i4x s SER 400 N 0.27 5.84 -0.13 3.58 1.04 0.15 0.01 113.70 124.46 3i4x s SER 400 Ca -0.15 0.04 -0.09 0.00 0.48 0.00 0.00 55.95 56.23 3i4x s SER 400 Cb -0.17 -1.65 0.04 0.00 0.10 0.00 0.00 66.02 64.35 3i4x s SER 400 CO 0.07 0.12 0.32 0.12 0.98 0.00 0.00 173.24 174.86 3i4x s PHE 401 N -1.58 -0.41 0.21 5.02 5.36 -0.02 -2.89 117.98 123.66 3i4x s PHE 401 Ca 0.32 0.95 -0.05 0.00 -0.96 0.00 0.00 56.93 57.19 3i4x s PHE 401 Cb -0.11 0.14 -0.03 0.00 -0.34 0.00 0.00 43.02 42.68 3i4x s PHE 401 CO 0.25 -0.23 0.25 -1.54 -1.46 0.00 0.00 175.22 172.48 3i4x s SER 402 N 0.77 0.07 -0.35 6.13 1.04 -0.74 -0.74 113.70 119.88 3i4x s SER 402 Ca -0.05 -1.22 0.00 0.00 0.48 0.00 0.00 55.95 55.16 3i4x s SER 402 Cb -0.06 0.45 0.11 0.00 0.10 0.00 0.00 66.02 66.62 3i4x s SER 402 CO -0.05 -0.94 0.15 -0.47 0.98 0.00 0.00 173.24 172.91 3i4x s TYR 403 N -4.11 1.69 -0.22 5.02 5.04 -1.26 -0.72 117.35 122.80 3i4x s TYR 403 Ca 0.33 -1.93 -0.06 0.00 -2.44 0.00 0.00 57.07 52.96 3i4x s TYR 403 Cb 0.04 -1.69 -0.03 0.00 0.35 0.00 0.00 41.96 40.63 3i4x s TYR 403 CO 0.11 -0.84 0.04 1.03 -1.34 0.00 0.00 175.55 174.54 3i4x s ARG 404 N 1.19 3.70 -1.41 4.97 0.52 0.13 -4.36 118.95 123.68 3i4x s ARG 404 Ca 0.13 -0.47 -0.06 0.00 -0.52 0.00 0.00 55.73 54.80 3i4x s ARG 404 Cb -0.20 -3.20 0.01 0.00 0.52 0.00 0.00 34.95 32.08 3i4x s ARG 404 CO -0.15 -0.02 0.12 -0.25 0.02 0.00 0.00 175.30 175.02 3i4x n ASP 405 N 4.37 0.04 -1.98 0.23 8.00 -1.26 -0.32 116.55 125.64 3i4x n ASP 405 Ca -0.17 -1.22 -0.20 0.00 0.71 0.00 0.00 54.79 53.92 3i4x n ASP 405 Cb 0.52 -1.51 -0.04 0.00 -0.02 0.00 0.00 41.12 40.07 3i4x n ASP 405 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3i4x n ARG 406 N -4.50 -1.50 -4.87 -1.24 1.74 -1.26 -4.99 116.66 100.05 3i4x n ARG 406 Ca -0.28 1.04 -0.33 0.00 -0.77 0.00 0.00 57.85 57.51 3i4x n ARG 406 Cb 0.64 -5.54 -0.15 0.00 -1.02 0.00 0.00 32.46 26.39 3i4x n ARG 406 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3i4x s THR 407 N -2.89 2.75 0.29 0.55 2.01 0.57 -5.11 115.64 113.80 3i4x s THR 407 Ca 0.00 -0.77 -0.29 0.00 0.31 0.00 0.00 61.69 60.94 3i4x s THR 407 Cb 0.00 -2.13 -0.10 0.00 0.01 0.00 0.00 72.50 70.28 3i4x s THR 407 CO 0.00 0.53 1.31 -2.16 -0.69 0.00 0.00 174.62 173.61 3i4x s PRO 408 N 0.40 4.38 -0.10 4.92 0.04 -1.26 -0.69 135.00 142.68 3i4x s PRO 408 Ca -0.12 2.16 0.01 0.00 0.04 0.00 0.00 61.00 63.08 3i4x s PRO 408 Cb -0.16 -3.11 0.02 0.00 0.04 0.00 0.00 34.50 31.28 3i4x s PRO 408 CO 0.06 -0.20 -0.13 -0.47 0.04 0.00 0.00 177.00 176.30 3i4x s TYR 409 N -0.69 1.78 -0.03 0.56 5.04 0.10 -4.84 117.35 119.26 3i4x s TYR 409 Ca 0.52 -0.83 -0.01 0.00 -2.44 0.00 0.00 57.07 54.30 3i4x s TYR 409 Cb -0.39 -1.33 0.03 0.00 0.35 0.00 0.00 41.96 40.62 3i4x s TYR 409 CO 0.47 -0.46 0.07 -1.17 -1.34 0.00 0.00 175.55 173.12 3i4x s LEU 410 N 1.12 1.17 0.06 6.97 0.20 -1.26 -1.79 118.68 125.15 3i4x s LEU 410 Ca -0.05 0.14 0.05 0.00 0.69 0.00 0.00 54.13 54.96 3i4x s LEU 410 Cb -0.14 0.14 -0.03 0.00 -0.43 0.00 0.00 46.19 45.73 3i4x s LEU 410 CO -0.03 -0.10 -0.13 -0.44 -0.29 0.00 0.00 176.35 175.36 3i4x s SER 411 N 0.80 1.56 -0.01 3.68 0.01 -1.14 0.82 113.70 119.43 3i4x s SER 411 Ca -0.06 -0.55 0.07 0.00 1.31 0.00 0.00 55.95 56.72 3i4x s SER 411 Cb -0.09 -0.06 -0.02 0.00 0.21 0.00 0.00 66.02 66.06 3i4x s SER 411 CO -0.03 -0.06 -0.23 0.68 0.41 0.00 0.00 173.24 174.02 3i4x s VAL 412 N -1.14 2.36 -0.21 3.43 -7.23 -0.19 -0.68 120.40 116.74 3i4x s VAL 412 Ca -0.02 -1.09 -0.03 0.00 -1.81 0.00 0.00 61.98 59.03 3i4x s VAL 412 Cb -0.09 -1.88 -0.00 0.00 0.56 0.00 0.00 36.38 34.96 3i4x s VAL 412 CO 0.02 0.51 -0.07 -0.31 -0.31 0.00 0.00 175.10 174.94 3i4x s TYR 413 N -0.71 2.93 -0.00 2.82 2.02 0.17 -1.06 117.35 123.52 3i4x s TYR 413 Ca 0.11 -1.05 0.07 0.00 -0.37 0.00 0.00 57.07 55.83 3i4x s TYR 413 Cb -0.10 -2.08 -0.02 0.00 -0.40 0.00 0.00 41.96 39.36 3i4x s TYR 413 CO 0.01 -0.59 -0.21 -0.51 -1.57 0.00 0.00 175.55 172.67 3i4x s LEU 414 N 1.45 2.07 -0.06 -1.29 1.43 -0.88 -0.73 118.68 120.66 3i4x s LEU 414 Ca 0.06 -0.41 -0.38 0.00 -1.03 0.00 0.00 54.13 52.36 3i4x s LEU 414 Cb -0.14 -1.08 -0.16 0.00 0.03 0.00 0.00 46.19 44.83 3i4x s LEU 414 CO -0.05 0.24 1.48 1.67 0.23 0.00 0.00 176.35 179.93 3i4x n GLN 415 N 2.42 1.10 -3.55 1.70 -0.06 0.88 -3.99 117.38 115.88 3i4x n GLN 415 Ca -0.16 0.40 -0.27 0.00 -2.00 0.00 0.00 57.00 54.97 3i4x n GLN 415 Cb 0.53 -2.05 -0.10 0.00 -4.06 0.00 0.00 30.24 24.56 3i4x n GLN 415 CO 0.00 0.00 0.00 0.43 -0.20 0.00 0.00 177.06 177.29 3i4x n SER 416 N 3.56 1.66 -3.64 1.69 7.64 -1.26 -4.94 113.62 118.34 3i4x n SER 416 Ca 0.22 -2.92 -0.04 0.00 1.01 0.00 0.00 58.87 57.14 3i4x n SER 416 Cb 0.16 -0.66 -0.07 0.00 -1.01 0.00 0.00 64.21 62.63 3i4x n SER 416 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 3i4x s PHE 417 N -1.16 -0.77 -1.13 1.43 5.36 -1.26 -4.78 117.98 115.68 3i4x s PHE 417 Ca 0.32 1.52 -0.11 0.00 -0.96 0.00 0.00 56.93 57.70 3i4x s PHE 417 Cb 0.05 0.46 -0.03 0.00 -0.34 0.00 0.00 43.02 43.16 3i4x s PHE 417 CO -0.14 -0.38 0.84 0.39 -1.46 0.00 0.00 175.22 174.47 3i4x n GLU 418 N 4.00 -2.38 -2.82 10.12 1.02 -0.97 -5.00 120.64 124.61 3i4x n GLU 418 Ca -0.19 0.67 -0.20 0.00 -0.02 0.00 0.00 57.16 57.42 3i4x n GLU 418 Cb 0.58 -5.05 0.05 0.00 -0.02 0.00 0.00 31.44 26.99 3i4x n GLU 418 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 3i4x s THR 419 N -3.46 2.58 0.00 2.62 -4.23 0.85 -4.64 115.64 109.35 3i4x s THR 419 Ca 0.38 -0.82 0.00 0.00 -1.18 0.00 0.00 61.69 60.07 3i4x s THR 419 Cb -0.09 -2.75 0.00 0.00 1.34 0.00 0.00 72.50 70.99 3i4x s THR 419 CO 0.80 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.49 3i4x n GLY 420 N -2.25 2.80 0.44 3.99 0.00 0.52 -1.78 105.19 108.91 3i4x n GLY 420 Ca 0.11 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.92 3i4x n GLY 420 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3i4x n ASP 421 N 1.65 0.77 0.00 1.61 8.00 -1.26 -4.50 116.55 122.83 3i4x n ASP 421 Ca 0.00 -1.75 0.00 0.00 0.71 0.00 0.00 54.79 53.75 3i4x n ASP 421 Cb 0.00 -0.39 0.00 0.00 -0.02 0.00 0.00 41.12 40.71 3i4x n ASP 421 CO 0.00 0.00 0.00 1.87 -0.39 0.00 0.00 177.20 178.68