#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wvi s TYR 4003N 0.00 3.60 -0.40 -1.42 1.51 -1.26 -4.93 117.35 114.44 1wvi s TYR 4003Ca 0.00 1.17 0.21 0.00 -1.01 0.00 0.00 57.07 57.45 1wvi s TYR 4003Cb 0.00 -2.70 -0.30 0.00 -0.11 0.00 0.00 41.96 38.85 1wvi s TYR 4003CO 0.00 0.18 0.64 1.63 -1.11 0.00 0.00 175.55 176.89 1wvi n LYS 4004N 3.43 0.42 -3.91 -0.62 4.76 0.29 -4.99 118.16 117.54 1wvi n LYS 4004Ca -0.04 -0.12 -0.10 0.00 -2.87 0.00 0.00 58.31 55.18 1wvi n LYS 4004Cb 0.51 -1.51 -0.10 0.00 -1.84 0.00 0.00 35.03 32.09 1wvi n LYS 4004CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 1wvi s GLY 4005N -3.91 0.12 -0.09 0.72 0.00 -1.04 -4.13 107.32 98.99 1wvi s GLY 4005Ca -0.02 -0.31 0.03 0.00 0.00 0.00 0.00 44.72 44.42 1wvi s GLY 4005CO 0.89 -0.42 -0.17 -0.19 0.00 0.00 0.00 173.10 173.21 1wvi s TYR 4006N -1.39 1.95 -0.18 1.90 1.51 -0.80 -2.30 117.35 118.03 1wvi s TYR 4006Ca -0.15 -0.80 -0.06 0.00 -1.01 0.00 0.00 57.07 55.05 1wvi s TYR 4006Cb -0.08 -1.37 -0.03 0.00 -0.11 0.00 0.00 41.96 40.37 1wvi s TYR 4006CO 0.01 -0.37 0.03 -0.51 -1.11 0.00 0.00 175.55 173.60 1wvi s LEU 4007N 0.61 3.56 -0.04 -1.29 1.43 -0.12 -0.91 118.68 121.91 1wvi s LEU 4007Ca -0.15 -0.04 0.02 0.00 -1.03 0.00 0.00 54.13 52.93 1wvi s LEU 4007Cb -0.16 -1.89 0.01 0.00 0.03 0.00 0.00 46.19 44.17 1wvi s LEU 4007CO 0.05 0.14 -0.07 -0.63 0.23 0.00 0.00 176.35 176.07 1wvi s ILE 4008N 0.56 0.67 0.50 -0.59 1.01 -0.15 0.35 121.20 123.55 1wvi s ILE 4008Ca 0.01 -0.25 -0.20 0.00 0.00 0.00 0.00 60.65 60.21 1wvi s ILE 4008Cb -0.13 -0.64 -0.08 0.00 0.01 0.00 0.00 42.46 41.62 1wvi s ILE 4008CO 0.02 0.23 1.06 -0.62 0.00 0.00 0.00 174.94 175.63 1wvi s ASP 4009N 0.53 6.20 0.00 3.58 3.68 -0.16 0.04 116.67 130.54 1wvi s ASP 4009Ca -0.08 1.97 0.00 0.00 2.13 0.00 0.00 52.55 56.57 1wvi s ASP 4009Cb -0.11 -2.56 0.00 0.00 -1.45 0.00 0.00 42.92 38.79 1wvi s ASP 4009CO 0.01 -0.88 0.00 0.18 0.13 0.00 0.00 175.17 174.60 1wvi n LEU 4010N -1.07 0.73 -4.71 -1.34 4.77 -1.24 -4.26 117.00 109.87 1wvi n LEU 4010Ca 0.10 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.66 1wvi n LEU 4010Cb 0.52 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 1wvi n LEU 4010CO 0.40 0.00 1.31 -0.62 -1.33 0.00 0.00 177.39 177.16 1wvi s ASP 4011N -1.00 6.49 0.00 -1.43 2.15 -1.26 -1.87 116.67 119.76 1wvi s ASP 4011Ca 0.00 2.72 0.00 0.00 0.43 0.00 0.00 52.55 55.70 1wvi s ASP 4011Cb 0.00 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 40.03 1wvi s ASP 4011CO 0.00 -0.90 0.00 0.61 -0.17 0.00 0.00 175.17 174.71 1wvi n GLY 4012N 3.90 2.74 0.54 2.66 0.00 0.26 -4.87 105.19 110.41 1wvi n GLY 4012Ca 0.15 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.08 1wvi n GLY 4012CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1wvi n THR 4013N -2.00 1.18 -0.01 2.61 -1.04 -0.78 -3.37 114.28 110.87 1wvi n THR 4013Ca 0.00 0.10 0.11 0.00 -2.04 0.00 0.00 64.05 62.23 1wvi n THR 4013Cb 0.00 -1.89 0.26 0.00 -1.82 0.00 0.00 70.33 66.88 1wvi n THR 4013CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 1wvi n ILE 4014N -3.89 0.73 0.00 12.58 -5.35 -0.99 -4.55 119.36 117.90 1wvi n ILE 4014Ca -0.15 -0.87 0.00 0.00 -0.27 0.00 0.00 62.75 61.47 1wvi n ILE 4014Cb 0.42 0.76 0.00 0.00 -1.74 0.00 0.00 39.64 39.09 1wvi n ILE 4014CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1wvi n TYR 4015N 1.51 0.00 -3.58 4.28 4.11 -1.26 -4.05 117.16 118.17 1wvi n TYR 4015Ca 0.21 0.00 -0.20 0.00 -0.00 0.00 0.00 57.90 57.91 1wvi n TYR 4015Cb 0.60 0.00 -0.15 0.00 -0.00 0.00 0.00 39.34 39.79 1wvi n TYR 4015CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.86 177.07 1wvi s LYS 4016N -2.00 0.10 7.38 -3.48 2.20 0.09 0.88 119.74 124.91 1wvi s LYS 4016Ca 0.00 0.21 0.00 0.00 -0.36 0.00 0.00 55.97 55.82 1wvi s LYS 4016Cb 0.00 -1.15 0.00 0.00 -1.51 0.00 0.00 37.83 35.17 1wvi s LYS 4016CO 0.00 -0.56 0.00 0.41 -0.36 0.00 0.00 175.35 174.84 1wvi n GLY 4017N 5.31 2.89 0.10 5.54 0.00 -1.26 -1.16 105.19 116.61 1wvi n GLY 4017Ca -0.06 -0.25 0.12 0.00 0.00 0.00 0.00 46.02 45.83 1wvi n GLY 4017CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1wvi h LYS 4018N 0.00 0.00 -7.07 1.61 6.56 -2.03 -3.46 116.57 112.18 1wvi h LYS 4018Ca 0.00 0.00 -0.45 0.00 -1.06 0.00 0.00 60.65 59.14 1wvi h LYS 4018Cb 0.00 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.65 1wvi h LYS 4018CO 0.00 0.00 0.35 -0.51 -2.06 0.00 0.00 179.45 177.23 1wvi s ASP 4019N -4.85 6.79 0.38 0.86 -0.00 -0.31 -5.08 116.67 114.47 1wvi s ASP 4019Ca 0.04 1.74 0.08 0.00 -0.00 0.00 0.00 52.55 54.41 1wvi s ASP 4019Cb 0.11 -2.54 -0.03 0.00 -0.00 0.00 0.00 42.92 40.46 1wvi s ASP 4019CO 0.73 -0.46 0.31 0.00 -0.00 0.00 0.00 175.17 175.75 1wvi s ARG 4020N -3.22 2.58 -0.36 8.23 1.70 -1.26 -0.73 118.95 125.89 1wvi s ARG 4020Ca 0.63 -1.45 0.01 0.00 -0.47 0.00 0.00 55.73 54.45 1wvi s ARG 4020Cb -0.11 -2.38 0.11 0.00 -0.57 0.00 0.00 34.95 32.00 1wvi s ARG 4020CO 0.15 -0.04 0.14 0.42 -1.08 0.00 0.00 175.30 174.89 1wvi s ILE 4021N -2.40 1.20 0.36 4.99 1.01 -1.26 -4.70 121.20 120.41 1wvi s ILE 4021Ca 0.44 -1.91 0.13 0.00 0.00 0.00 0.00 60.65 59.31 1wvi s ILE 4021Cb -0.04 -1.88 0.35 0.00 0.01 0.00 0.00 42.46 40.90 1wvi s ILE 4021CO 0.27 -0.75 1.77 1.55 0.00 0.00 0.00 174.94 177.78 1wvi h PRO 4022N 7.55 0.51 -0.69 2.79 0.13 -1.98 0.25 132.00 140.56 1wvi h PRO 4022Ca -0.08 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 65.00 1wvi h PRO 4022Cb 0.98 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 31.97 1wvi h PRO 4022CO 0.48 0.34 0.34 0.00 -0.23 0.00 0.00 178.00 178.92 1wvi h ALA 4023N 1.65 1.29 -0.08 -0.56 0.00 -1.94 0.10 119.26 119.72 1wvi h ALA 4023Ca 0.59 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.35 1wvi h ALA 4023Cb 1.27 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 1wvi h ALA 4023CO -0.34 0.55 0.01 0.78 0.00 0.00 0.00 179.25 180.25 1wvi h GLY 4024N 1.04 0.14 0.87 0.00 0.00 -0.76 -0.36 103.07 104.01 1wvi h GLY 4024Ca 0.24 -0.10 0.03 0.00 0.00 0.00 0.00 47.33 47.50 1wvi h GLY 4024CO -0.03 0.09 0.53 0.83 0.00 0.00 0.00 176.54 177.96 1wvi h GLU 4025N -0.13 0.99 -0.47 4.80 5.08 -1.07 -1.49 114.58 122.29 1wvi h GLU 4025Ca 0.02 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 1wvi h GLU 4025Cb 0.32 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 1wvi h GLU 4025CO 0.00 0.66 0.03 0.22 -1.00 0.00 0.00 179.01 178.92 1wvi h ASP 4026N 1.02 0.71 -0.48 1.42 3.58 -0.84 -2.26 116.42 119.56 1wvi h ASP 4026Ca 0.33 -0.15 0.04 0.00 0.42 0.00 0.00 57.03 57.66 1wvi h ASP 4026Cb 0.01 -0.19 -0.04 0.00 1.72 0.00 0.00 39.33 40.84 1wvi h ASP 4026CO -0.12 0.75 0.25 0.15 -2.88 0.00 0.00 179.24 177.40 1wvi h PHE 4027N 0.71 0.47 -0.28 0.28 3.04 0.00 0.31 116.94 121.47 1wvi h PHE 4027Ca 0.15 0.02 -0.04 0.00 3.98 0.00 0.00 57.97 62.07 1wvi h PHE 4027Cb 0.38 -0.14 -0.01 0.00 2.56 0.00 0.00 35.95 38.74 1wvi h PHE 4027CO 0.02 0.24 0.02 0.28 -2.02 0.00 0.00 178.31 176.85 1wvi h VAL 4028N 0.50 1.25 -0.73 1.41 2.07 -1.26 -1.51 116.25 117.98 1wvi h VAL 4028Ca 0.21 -0.88 0.03 0.00 0.82 0.00 0.00 66.70 66.88 1wvi h VAL 4028Cb 0.10 1.27 -0.05 0.00 -1.52 0.00 0.00 31.29 31.09 1wvi h VAL 4028CO -0.13 0.28 0.46 0.11 0.02 0.00 0.00 177.57 178.31 1wvi h LYS 4029N 0.29 0.86 -0.76 1.57 1.57 -0.91 0.41 116.57 119.61 1wvi h LYS 4029Ca 0.08 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1wvi h LYS 4029Cb 0.40 -0.19 -0.04 0.00 0.08 0.00 0.00 32.23 32.48 1wvi h LYS 4029CO 0.01 0.57 0.42 0.00 -0.57 0.00 0.00 179.45 179.88 1wvi h ARG 4030N 0.89 1.06 -0.47 3.15 3.08 -0.22 -0.18 114.38 121.69 1wvi h ARG 4030Ca 0.30 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 60.22 1wvi h ARG 4030Cb 0.03 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 29.85 1wvi h ARG 4030CO -0.12 0.79 0.30 -0.07 -1.07 0.00 0.00 179.97 179.80 1wvi h LEU 4031N 1.05 0.54 -0.94 3.04 3.38 -0.33 -1.47 115.31 120.60 1wvi h LEU 4031Ca 0.27 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 1wvi h LEU 4031Cb 0.03 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.60 1wvi h LEU 4031CO -0.04 0.41 0.56 1.56 0.09 0.00 0.00 178.44 181.01 1wvi h GLN 4032N 0.63 1.28 -0.75 1.13 4.20 -0.43 -0.09 115.11 121.08 1wvi h GLN 4032Ca 0.17 -0.12 -0.05 0.00 0.06 0.00 0.00 58.65 58.71 1wvi h GLN 4032Cb -0.05 -0.26 -0.03 0.00 0.30 0.00 0.00 27.48 27.43 1wvi h GLN 4032CO -0.04 0.90 0.27 0.93 -0.67 0.00 0.00 178.83 180.22 1wvi h GLU 4033N 1.30 1.14 -0.00 1.46 5.08 -0.51 -1.61 114.58 121.43 1wvi h GLU 4033Ca 0.34 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1wvi h GLU 4033Cb -0.04 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.03 1wvi h GLU 4033CO -0.06 0.95 -0.05 0.54 -1.00 0.00 0.00 179.01 179.38 1wvi n ARG 4034N -4.29 0.54 -3.39 2.33 5.12 -0.60 -4.90 116.66 111.47 1wvi n ARG 4034Ca 0.06 -0.09 -0.24 0.00 -1.93 0.00 0.00 57.85 55.65 1wvi n ARG 4034Cb 0.20 -1.50 0.06 0.00 -1.16 0.00 0.00 32.46 30.06 1wvi n ARG 4034CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1wvi n GLN 4035N -1.15 -6.55 -3.13 5.56 6.02 -0.18 -4.96 117.38 113.00 1wvi n GLN 4035Ca 0.15 0.84 -0.39 0.00 -0.01 0.00 0.00 57.00 57.58 1wvi n GLN 4035Cb 0.25 -5.81 -0.05 0.00 1.02 0.00 0.00 30.24 25.65 1wvi n GLN 4035CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1wvi s LEU 4036N -7.06 4.28 0.51 1.08 1.43 -0.42 -5.02 118.68 113.48 1wvi s LEU 4036Ca 0.48 1.04 -0.23 0.00 -1.03 0.00 0.00 54.13 54.39 1wvi s LEU 4036Cb -0.21 -2.95 -0.06 0.00 0.03 0.00 0.00 46.19 43.00 1wvi s LEU 4036CO 0.59 -0.10 1.32 -2.16 0.23 0.00 0.00 176.35 176.24 1wvi s PRO 4037N 0.88 3.37 0.02 1.29 0.04 -1.26 -4.65 135.00 134.70 1wvi s PRO 4037Ca 0.33 2.16 -0.26 0.00 0.04 0.00 0.00 61.00 63.27 1wvi s PRO 4037Cb -0.17 -2.36 0.06 0.00 0.04 0.00 0.00 34.50 32.07 1wvi s PRO 4037CO 0.15 -0.98 0.59 1.52 0.04 0.00 0.00 177.00 178.32 1wvi s TYR 4038N -1.34 -0.53 -0.03 0.56 1.13 -1.26 -1.91 117.35 113.97 1wvi s TYR 4038Ca 0.68 0.71 0.01 0.00 -1.41 0.00 0.00 57.07 57.06 1wvi s TYR 4038Cb -0.38 0.40 0.02 0.00 -1.10 0.00 0.00 41.96 40.90 1wvi s TYR 4038CO 0.46 -0.66 -0.02 0.42 -2.51 0.00 0.00 175.55 173.24 1wvi s ILE 4039N -2.12 0.31 -0.23 -3.49 1.09 -0.09 -4.79 121.20 111.88 1wvi s ILE 4039Ca -0.07 -0.03 -0.20 0.00 -1.10 0.00 0.00 60.65 59.25 1wvi s ILE 4039Cb -0.01 -0.35 -0.02 0.00 -1.06 0.00 0.00 42.46 41.02 1wvi s ILE 4039CO 0.01 0.16 0.62 -0.76 -0.10 0.00 0.00 174.94 174.86 1wvi s LEU 4040N 0.75 4.10 -0.18 2.97 2.01 0.18 -0.98 118.68 127.54 1wvi s LEU 4040Ca -0.08 0.75 -0.02 0.00 0.01 0.00 0.00 54.13 54.78 1wvi s LEU 4040Cb -0.12 -2.85 -0.01 0.00 0.01 0.00 0.00 46.19 43.23 1wvi s LEU 4040CO -0.01 -0.32 -0.10 -0.69 1.01 0.00 0.00 176.35 176.25 1wvi s VAL 4041N 2.20 3.10 0.03 -1.59 1.01 0.11 -0.84 120.40 124.41 1wvi s VAL 4041Ca 0.27 -0.61 0.04 0.00 0.00 0.00 0.00 61.98 61.68 1wvi s VAL 4041Cb -0.16 -2.36 -0.02 0.00 0.00 0.00 0.00 36.38 33.85 1wvi s VAL 4041CO 0.09 0.48 -0.11 0.28 0.00 0.00 0.00 175.10 175.84 1wvi s THR 4042N 1.00 0.89 -1.96 3.92 -1.32 -0.97 -3.70 115.64 113.51 1wvi s THR 4042Ca -0.01 -0.87 0.28 0.00 -1.21 0.00 0.00 61.69 59.88 1wvi s THR 4042Cb -0.15 -0.82 0.45 0.00 -1.51 0.00 0.00 72.50 70.47 1wvi s THR 4042CO -0.01 -0.03 1.75 0.59 -2.21 0.00 0.00 174.62 174.71 1wvi n ASN 4043N 2.03 0.92 -4.72 8.08 5.03 -1.26 -1.50 115.26 123.84 1wvi n ASN 4043Ca -0.18 -0.98 -0.42 0.00 0.87 0.00 0.00 54.58 53.87 1wvi n ASN 4043Cb 0.55 0.03 -0.03 0.00 -1.02 0.00 0.00 39.78 39.31 1wvi n ASN 4043CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1wvi s ASN 4044N -2.31 6.53 0.00 6.41 2.47 -1.26 -4.59 114.94 122.18 1wvi s ASN 4044Ca 0.31 2.69 0.09 0.00 0.42 0.00 0.00 52.86 56.37 1wvi s ASN 4044Cb 0.20 -2.59 0.16 0.00 -1.45 0.00 0.00 41.25 37.56 1wvi s ASN 4044CO 0.44 -0.87 0.99 0.35 -3.72 0.00 0.00 177.10 174.29 1wvi n THR 4045N 4.02 0.50 -0.01 -5.21 -2.24 -1.26 -4.20 114.28 105.87 1wvi n THR 4045Ca 0.15 -0.75 -0.21 0.00 -2.27 0.00 0.00 64.05 60.96 1wvi n THR 4045Cb 0.38 0.85 -0.14 0.00 -2.10 0.00 0.00 70.33 69.32 1wvi n THR 4045CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1wvi n THR 4046N 0.40 1.74 -3.47 4.28 -2.24 -1.26 -3.83 114.28 109.91 1wvi n THR 4046Ca 0.07 -0.57 -0.38 0.00 -2.27 0.00 0.00 64.05 60.90 1wvi n THR 4046Cb 0.30 -1.77 -0.06 0.00 -2.10 0.00 0.00 70.33 66.71 1wvi n THR 4046CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1wvi s ARG 4047N -2.53 4.09 0.87 -0.78 0.52 -1.26 -4.62 118.95 115.24 1wvi s ARG 4047Ca -0.24 0.34 -0.12 0.00 -0.52 0.00 0.00 55.73 55.20 1wvi s ARG 4047Cb 0.07 -3.32 0.11 0.00 0.52 0.00 0.00 34.95 32.33 1wvi s ARG 4047CO 0.74 0.46 1.11 0.95 0.02 0.00 0.00 175.30 178.58 1wvi s THR 4048N -0.30 2.56 0.26 0.02 -4.23 -1.26 -4.77 115.64 107.92 1wvi s THR 4048Ca 0.23 0.18 -0.03 0.00 -1.18 0.00 0.00 61.69 60.88 1wvi s THR 4048Cb -0.15 -2.86 0.24 0.00 1.34 0.00 0.00 72.50 71.07 1wvi s THR 4048CO 0.10 -0.24 1.86 -0.65 -0.54 0.00 0.00 174.62 175.15 1wvi h PRO 4049N -1.37 1.00 -0.15 3.99 0.11 -1.96 -0.08 132.00 133.54 1wvi h PRO 4049Ca -0.49 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 65.56 1wvi h PRO 4049Cb 1.30 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1wvi h PRO 4049CO 0.59 0.66 0.08 0.93 -0.21 0.00 0.00 178.00 180.06 1wvi h GLU 4050N 1.03 0.17 -0.49 1.05 3.07 -1.93 0.33 114.58 117.81 1wvi h GLU 4050Ca 0.42 -0.01 0.03 0.00 -0.50 0.00 0.00 59.36 59.30 1wvi h GLU 4050Cb 0.23 -0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 28.07 1wvi h GLU 4050CO -0.19 0.11 0.27 0.52 -1.40 0.00 0.00 179.01 178.32 1wvi h MET 4051N 0.17 0.52 -0.37 2.33 2.86 -1.72 0.38 114.93 119.11 1wvi h MET 4051Ca 0.06 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 1wvi h MET 4051Cb -0.00 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 1wvi h MET 4051CO -0.03 0.35 0.22 0.28 1.06 0.00 0.00 176.91 178.78 1wvi h VAL 4052N 0.54 1.13 -0.31 -2.22 2.07 -0.56 -0.24 116.25 116.66 1wvi h VAL 4052Ca 0.20 -0.33 0.02 0.00 0.82 0.00 0.00 66.70 67.41 1wvi h VAL 4052Cb 0.06 0.67 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1wvi h VAL 4052CO -0.11 0.14 0.16 -0.61 0.02 0.00 0.00 177.57 177.16 1wvi h GLN 4053N 0.48 0.32 -0.52 1.57 4.15 0.17 -1.52 115.11 119.75 1wvi h GLN 4053Ca 0.13 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 59.50 1wvi h GLN 4053Cb 0.03 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 27.62 1wvi h GLN 4053CO -0.02 0.21 0.21 1.49 -1.93 0.00 0.00 178.83 178.79 1wvi h GLU 4054N 0.33 0.78 -0.54 1.69 4.81 -0.72 -2.38 114.58 118.56 1wvi h GLU 4054Ca 0.13 -0.14 0.04 0.00 -0.13 0.00 0.00 59.36 59.25 1wvi h GLU 4054Cb 0.04 -0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.25 1wvi h GLU 4054CO -0.08 0.69 0.30 1.98 -0.73 0.00 0.00 179.01 181.16 1wvi h MET 4055N 0.71 0.57 -0.44 1.92 4.05 -0.77 0.16 114.93 121.12 1wvi h MET 4055Ca 0.17 -0.03 0.01 0.00 -0.28 0.00 0.00 59.70 59.57 1wvi h MET 4055Cb 0.20 -0.13 -0.03 0.00 -0.80 0.00 0.00 31.60 30.84 1wvi h MET 4055CO -0.01 0.38 0.27 -0.07 0.23 0.00 0.00 176.91 177.70 1wvi h LEU 4056N 0.59 0.45 -0.14 3.39 3.38 -1.01 0.19 115.31 122.16 1wvi h LEU 4056Ca 0.23 -0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.06 1wvi h LEU 4056Cb 0.08 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1wvi h LEU 4056CO -0.13 0.33 -0.42 0.00 0.09 0.00 0.00 178.44 178.31 1wvi h ALA 4057N 1.18 0.23 -0.19 1.53 0.00 -0.49 -0.64 119.26 120.88 1wvi h ALA 4057Ca 0.17 -0.47 -0.16 0.00 0.00 0.00 0.00 54.91 54.45 1wvi h ALA 4057Cb -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1wvi h ALA 4057CO -0.06 0.35 -0.52 1.15 0.00 0.00 0.00 179.25 180.17 1wvi h THR 4058N 0.14 1.32 0.00 0.00 2.02 -0.61 -3.21 112.91 112.57 1wvi h THR 4058Ca -0.01 -1.75 0.00 0.00 0.77 0.00 0.00 66.41 65.41 1wvi h THR 4058Cb 1.04 1.91 0.00 0.00 -1.74 0.00 0.00 68.15 69.36 1wvi h THR 4058CO 0.09 0.55 -1.14 -1.20 0.37 0.00 0.00 175.52 174.19 1wvi n SER 4059N -4.14 0.86 -0.61 4.18 7.64 0.67 -4.70 113.62 117.51 1wvi n SER 4059Ca -0.06 -0.61 0.02 0.00 1.01 0.00 0.00 58.87 59.23 1wvi n SER 4059Cb 0.61 1.26 0.02 0.00 -1.01 0.00 0.00 64.21 65.09 1wvi n SER 4059CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1wvi n PHE 4060N -1.64 0.00 -1.95 1.43 3.72 -0.52 -4.95 117.46 113.56 1wvi n PHE 4060Ca 0.01 -0.21 -0.13 0.00 -0.05 0.00 0.00 57.45 57.07 1wvi n PHE 4060Cb 0.33 -0.08 -0.03 0.00 -0.94 0.00 0.00 39.48 38.76 1wvi n PHE 4060CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1wvi n ASN 4061N -0.10 -3.72 -4.35 4.37 3.02 -0.99 -4.88 115.26 108.62 1wvi n ASN 4061Ca 0.03 0.24 -0.37 0.00 -0.03 0.00 0.00 54.58 54.46 1wvi n ASN 4061Cb 0.76 -3.30 -0.13 0.00 -0.61 0.00 0.00 39.78 36.51 1wvi n ASN 4061CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1wvi s ILE 4062N -2.38 3.89 -0.31 2.41 1.01 -0.37 -4.94 121.20 120.51 1wvi s ILE 4062Ca 0.00 -0.57 -0.03 0.00 0.00 0.00 0.00 60.65 60.05 1wvi s ILE 4062Cb 0.00 -2.93 0.04 0.00 0.01 0.00 0.00 42.46 39.58 1wvi s ILE 4062CO 0.00 0.19 0.03 -0.54 0.00 0.00 0.00 174.94 174.62 1wvi s LYS 4063N 1.51 2.57 0.03 2.79 1.02 -1.26 -0.88 119.74 125.52 1wvi s LYS 4063Ca 0.04 -1.19 0.04 0.00 0.02 0.00 0.00 55.97 54.88 1wvi s LYS 4063Cb -0.16 -3.26 -0.02 0.00 -0.52 0.00 0.00 37.83 33.87 1wvi s LYS 4063CO 0.01 -0.60 -0.11 -0.08 -0.92 0.00 0.00 175.35 173.65 1wvi s THR 4064N 1.32 0.84 0.61 2.17 -1.32 -1.26 -5.07 115.64 112.93 1wvi s THR 4064Ca -0.03 -0.86 -0.18 0.00 -1.21 0.00 0.00 61.69 59.40 1wvi s THR 4064Cb -0.19 -0.78 -0.04 0.00 -1.51 0.00 0.00 72.50 69.97 1wvi s THR 4064CO 0.00 -0.06 0.97 -2.65 -2.21 0.00 0.00 174.62 170.67 1wvi n PRO 4065N 2.01 0.87 -0.03 7.08 -0.02 -1.26 -4.88 135.00 138.76 1wvi n PRO 4065Ca -0.18 0.34 0.04 0.00 -2.02 0.00 0.00 63.50 61.68 1wvi n PRO 4065Cb 0.55 -2.18 0.41 0.00 -0.02 0.00 0.00 33.50 32.26 1wvi n PRO 4065CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1wvi h LEU 4066N 0.42 0.52 0.00 2.45 5.85 -1.98 -2.26 115.31 120.31 1wvi h LEU 4066Ca -0.49 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.22 1wvi h LEU 4066Cb 1.37 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.27 1wvi h LEU 4066CO 0.50 0.37 0.00 -0.62 -0.34 0.00 0.00 178.44 178.36 1wvi n GLU 4067N -4.47 0.03 0.00 1.25 4.71 -1.26 -2.22 120.64 118.68 1wvi n GLU 4067Ca 0.04 0.26 0.13 0.00 -0.01 0.00 0.00 57.16 57.59 1wvi n GLU 4067Cb 0.07 -1.50 0.44 0.00 -1.01 0.00 0.00 31.44 29.44 1wvi n GLU 4067CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1wvi n THR 4068N -1.47 0.00 -3.50 2.62 -2.24 -0.85 -4.75 114.28 104.09 1wvi n THR 4068Ca 0.04 -0.13 -0.42 0.00 -2.27 0.00 0.00 64.05 61.26 1wvi n THR 4068Cb 0.14 0.31 -0.10 0.00 -2.10 0.00 0.00 70.33 68.58 1wvi n THR 4068CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1wvi s ILE 4069N -2.43 4.99 -0.24 2.28 1.01 -0.94 0.51 121.20 126.38 1wvi s ILE 4069Ca 0.27 -0.83 0.00 0.00 0.00 0.00 0.00 60.65 60.09 1wvi s ILE 4069Cb 0.20 -3.83 0.03 0.00 0.01 0.00 0.00 42.46 38.87 1wvi s ILE 4069CO 0.49 -0.34 -0.10 -0.47 0.00 0.00 0.00 174.94 174.51 1wvi s TYR 4070N 1.62 3.06 0.40 3.97 5.04 -0.02 -4.93 117.35 126.50 1wvi s TYR 4070Ca 0.04 -1.78 0.08 0.00 -2.44 0.00 0.00 57.07 52.96 1wvi s TYR 4070Cb -0.20 -2.00 -0.02 0.00 0.35 0.00 0.00 41.96 40.09 1wvi s TYR 4070CO 0.08 -0.79 0.39 0.95 -1.34 0.00 0.00 175.55 174.84 1wvi s THR 4071N 1.26 2.84 0.42 4.34 -4.23 -1.26 -2.28 115.64 116.72 1wvi s THR 4071Ca -0.01 -1.30 0.17 0.00 -1.18 0.00 0.00 61.69 59.37 1wvi s THR 4071Cb -0.17 -3.03 0.19 0.00 1.34 0.00 0.00 72.50 70.83 1wvi s THR 4071CO -0.06 -0.03 1.97 0.00 -0.54 0.00 0.00 174.62 175.96 1wvi h ALA 4072N 1.01 1.50 -0.18 3.99 0.00 -1.43 -1.50 119.26 122.65 1wvi h ALA 4072Ca -0.42 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.28 1wvi h ALA 4072Cb 1.27 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1wvi h ALA 4072CO 0.56 0.27 0.05 1.15 0.00 0.00 0.00 179.25 181.27 1wvi h THR 4073N 0.00 1.20 -0.39 0.00 2.02 -1.87 0.21 112.91 114.08 1wvi h THR 4073Ca -0.00 -0.64 -0.01 0.00 0.77 0.00 0.00 66.41 66.53 1wvi h THR 4073Cb 0.42 1.29 -0.02 0.00 -1.74 0.00 0.00 68.15 68.09 1wvi h THR 4073CO 0.03 0.20 0.19 -0.07 0.37 0.00 0.00 175.52 176.23 1wvi h LEU 4074N 0.10 0.51 -0.76 2.58 3.38 -1.84 -1.65 115.31 117.63 1wvi h LEU 4074Ca 0.06 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 57.91 1wvi h LEU 4074Cb 0.26 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 1wvi h LEU 4074CO 0.00 0.49 0.50 0.00 0.09 0.00 0.00 178.44 179.52 1wvi h ALA 4075N 1.04 0.97 -0.48 1.53 0.00 -1.18 -0.22 119.26 120.92 1wvi h ALA 4075Ca 0.13 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1wvi h ALA 4075Cb 0.12 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1wvi h ALA 4075CO -0.02 0.37 0.24 1.15 0.00 0.00 0.00 179.25 180.98 1wvi h THR 4076N 1.02 1.19 -0.49 0.00 2.02 -0.66 -0.74 112.91 115.24 1wvi h THR 4076Ca 0.28 -0.52 -0.09 0.00 0.77 0.00 0.00 66.41 66.86 1wvi h THR 4076Cb -0.10 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 66.94 1wvi h THR 4076CO -0.07 0.20 -0.03 0.40 0.37 0.00 0.00 175.52 176.40 1wvi h ILE 4077N 0.63 1.27 -0.76 3.11 2.04 -0.92 -0.18 117.51 122.70 1wvi h ILE 4077Ca 0.17 -1.12 0.02 0.00 1.00 0.00 0.00 64.86 64.93 1wvi h ILE 4077Cb 0.11 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 1wvi h ILE 4077CO -0.02 0.39 0.49 0.44 0.00 0.00 0.00 178.15 179.45 1wvi h ASP 4078N 0.74 0.83 -0.18 1.72 3.32 -0.78 0.12 116.42 122.19 1wvi h ASP 4078Ca 0.14 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 1wvi h ASP 4078Cb 0.55 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 1wvi h ASP 4078CO 0.03 0.58 0.08 0.22 -1.72 0.00 0.00 179.24 178.43 1wvi h TYR 4079N 0.98 0.27 -0.49 4.55 3.20 -0.86 -0.07 116.97 124.55 1wvi h TYR 4079Ca 0.29 -0.02 0.05 0.00 3.14 0.00 0.00 58.73 62.20 1wvi h TYR 4079Cb -0.05 -0.08 -0.05 0.00 1.54 0.00 0.00 36.73 38.09 1wvi h TYR 4079CO -0.03 0.31 0.22 0.52 -1.64 0.00 0.00 178.16 177.54 1wvi h MET 4080N 0.15 0.41 -0.67 1.82 2.86 -0.40 -0.73 114.93 118.37 1wvi h MET 4080Ca 0.06 -0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.65 1wvi h MET 4080Cb 0.15 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.69 1wvi h MET 4080CO -0.01 0.27 0.30 -0.91 1.06 0.00 0.00 176.91 177.63 1wvi h ASN 4081N 0.42 0.87 -0.25 1.22 2.35 -0.45 -2.51 115.58 117.22 1wvi h ASN 4081Ca 0.23 -0.10 -0.04 0.00 -0.55 0.00 0.00 56.30 55.84 1wvi h ASN 4081Cb 0.18 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.32 1wvi h ASN 4081CO -0.19 0.75 0.01 0.44 -1.65 0.00 0.00 177.43 176.79 1wvi h ASP 4082N 0.95 0.43 0.53 5.81 3.45 -0.08 -3.01 116.42 124.50 1wvi h ASP 4082Ca 0.23 -0.30 -0.03 0.00 0.43 0.00 0.00 57.03 57.37 1wvi h ASP 4082Cb 0.12 -0.12 -0.00 0.00 -0.56 0.00 0.00 39.33 38.77 1wvi h ASP 4082CO -0.03 0.62 -0.14 0.24 -1.57 0.00 0.00 179.24 178.36 1wvi h MET 4083N 0.23 0.00 -6.58 3.56 2.86 -1.03 -3.48 114.93 110.50 1wvi h MET 4083Ca 0.07 0.00 -0.44 0.00 -2.06 0.00 0.00 59.70 57.27 1wvi h MET 4083Cb 0.39 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.05 1wvi h MET 4083CO 0.01 0.14 -0.94 0.36 1.06 0.00 0.00 176.91 177.54 1wvi n LYS 4084N -3.53 -1.33 -4.23 1.72 2.85 -0.96 -5.03 118.16 107.65 1wvi n LYS 4084Ca -0.01 0.75 -0.29 0.00 -1.05 0.00 0.00 58.31 57.70 1wvi n LYS 4084Cb 0.29 -2.84 -0.03 0.00 -0.65 0.00 0.00 35.03 31.79 1wvi n LYS 4084CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1wvi n ARG 4085N -2.92 0.72 -0.53 -1.58 3.00 -1.26 -5.07 116.66 109.02 1wvi n ARG 4085Ca -0.24 -3.56 -0.17 0.00 -0.01 0.00 0.00 57.85 53.87 1wvi n ARG 4085Cb 0.65 0.66 0.01 0.00 0.00 0.00 0.00 32.46 33.78 1wvi n ARG 4085CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1wvi n GLY 4086N -1.36 -1.50 2.19 -0.13 0.00 -1.26 -4.77 105.19 98.36 1wvi n GLY 4086Ca -0.11 -0.12 -0.23 0.00 0.00 0.00 0.00 46.02 45.56 1wvi n GLY 4086CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wvi n LYS 4087N 0.72 2.15 -4.14 1.61 4.01 -1.26 -4.72 118.16 116.53 1wvi n LYS 4087Ca 0.03 -2.13 -0.15 0.00 -0.51 0.00 0.00 58.31 55.55 1wvi n LYS 4087Cb 0.21 -1.90 -0.11 0.00 -0.51 0.00 0.00 35.03 32.72 1wvi n LYS 4087CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 1wvi s THR 4088N -2.74 0.88 -0.08 -0.18 -4.23 -1.26 -2.52 115.64 105.50 1wvi s THR 4088Ca 0.45 -1.38 -0.30 0.00 -1.18 0.00 0.00 61.69 59.28 1wvi s THR 4088Cb 0.33 -1.06 0.07 0.00 1.34 0.00 0.00 72.50 73.19 1wvi s THR 4088CO -0.09 -0.41 0.69 0.00 -0.54 0.00 0.00 174.62 174.27 1wvi s ALA 4089N -1.78 -1.77 -0.19 3.99 0.00 -0.90 -2.27 121.76 118.85 1wvi s ALA 4089Ca -0.01 1.40 -0.04 0.00 0.00 0.00 0.00 51.96 53.31 1wvi s ALA 4089Cb -0.07 -0.14 -0.02 0.00 0.00 0.00 0.00 23.12 22.89 1wvi s ALA 4089CO 0.01 -0.37 -0.03 -0.47 0.00 0.00 0.00 175.76 174.91 1wvi s TYR 4090N -1.01 3.00 -0.08 0.00 5.04 -0.37 -2.39 117.35 121.54 1wvi s TYR 4090Ca -0.10 -0.50 0.04 0.00 -2.44 0.00 0.00 57.07 54.07 1wvi s TYR 4090Cb -0.01 -2.03 -0.01 0.00 0.35 0.00 0.00 41.96 40.26 1wvi s TYR 4090CO 0.09 -0.23 -0.21 0.08 -1.34 0.00 0.00 175.55 173.94 1wvi s VAL 4091N 0.85 2.43 -0.21 3.14 1.01 -1.26 -1.13 120.40 125.24 1wvi s VAL 4091Ca -0.00 -0.92 -0.04 0.00 0.00 0.00 0.00 61.98 61.02 1wvi s VAL 4091Cb -0.14 -1.93 -0.01 0.00 0.00 0.00 0.00 36.38 34.29 1wvi s VAL 4091CO 0.02 0.56 -0.05 -0.63 0.00 0.00 0.00 175.10 175.00 1wvi s ILE 4092N -0.10 3.38 -3.67 2.22 1.01 0.17 -4.97 121.20 119.24 1wvi s ILE 4092Ca -0.04 -0.50 0.00 0.00 0.00 0.00 0.00 60.65 60.11 1wvi s ILE 4092Cb -0.14 -2.53 0.00 0.00 0.01 0.00 0.00 42.46 39.80 1wvi s ILE 4092CO 0.04 0.43 0.00 0.61 0.00 0.00 0.00 174.94 176.03 1wvi n GLY 4093N 4.65 -1.59 3.78 6.18 0.00 -1.26 -0.81 105.19 116.14 1wvi n GLY 4093Ca -0.18 -1.14 -0.30 0.00 0.00 0.00 0.00 46.02 44.39 1wvi n GLY 4093CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wvi s GLU 4094N -1.58 2.22 0.35 1.61 0.41 -1.06 -4.75 118.70 115.89 1wvi s GLU 4094Ca 0.00 0.90 0.10 0.00 -0.41 0.00 0.00 54.97 55.56 1wvi s GLU 4094Cb 0.00 -1.91 0.86 0.00 -1.78 0.00 0.00 34.13 31.30 1wvi s GLU 4094CO 0.00 -1.59 1.82 0.00 -0.49 0.00 0.00 175.26 175.00 1wvi h THR 4095N -1.08 0.73 -0.23 3.63 1.03 -1.95 -2.00 112.91 113.04 1wvi h THR 4095Ca -0.46 -0.22 0.03 0.00 -0.01 0.00 0.00 66.41 65.76 1wvi h THR 4095Cb 1.24 0.03 -0.03 0.00 -1.07 0.00 0.00 68.15 68.32 1wvi h THR 4095CO 0.56 0.12 0.04 1.23 -0.01 0.00 0.00 175.52 177.45 1wvi h GLY 4096N 0.65 0.25 0.91 2.99 0.00 -1.87 0.45 103.07 106.45 1wvi h GLY 4096Ca 0.52 -0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.81 1wvi h GLY 4096CO -0.27 -0.02 0.09 -2.00 0.00 0.00 0.00 176.54 174.35 1wvi h LEU 4097N 0.12 0.50 -1.05 3.11 5.85 -1.48 -0.84 115.31 121.52 1wvi h LEU 4097Ca 0.11 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 1wvi h LEU 4097Cb 0.11 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 1wvi h LEU 4097CO -0.15 0.58 0.44 0.11 -0.34 0.00 0.00 178.44 179.08 1wvi h LYS 4098N 0.38 1.10 0.02 1.25 1.57 -1.25 -1.95 116.57 117.69 1wvi h LYS 4098Ca 0.11 -0.12 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1wvi h LYS 4098Cb 0.27 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1wvi h LYS 4098CO -0.00 0.80 -0.01 -0.22 -0.57 0.00 0.00 179.45 179.45 1wvi h LYS 4099N 1.11 -0.02 -0.96 3.15 3.64 -0.69 -2.40 116.57 120.41 1wvi h LYS 4099Ca 0.28 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.76 1wvi h LYS 4099Cb 0.02 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 31.77 1wvi h LYS 4099CO -0.05 0.35 0.59 0.00 -2.27 0.00 0.00 179.45 178.08 1wvi h ALA 4100N 0.58 1.40 -0.34 5.00 0.00 -0.92 0.38 119.26 125.35 1wvi h ALA 4100Ca -0.00 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 1wvi h ALA 4100Cb 0.38 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1wvi h ALA 4100CO 0.00 0.24 -0.15 0.28 0.00 0.00 0.00 179.25 179.62 1wvi h VAL 4101N 0.98 1.29 -0.51 0.00 2.07 -1.33 -1.47 116.25 117.27 1wvi h VAL 4101Ca 0.46 -1.25 -0.04 0.00 0.82 0.00 0.00 66.70 66.69 1wvi h VAL 4101Cb 0.39 1.38 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 1wvi h VAL 4101CO -0.24 0.41 0.17 0.00 0.02 0.00 0.00 177.57 177.92 1wvi h ALA 4102N 0.79 0.67 0.00 1.67 0.00 -0.85 -2.14 119.26 119.39 1wvi h ALA 4102Ca 0.08 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1wvi h ALA 4102Cb 0.67 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1wvi h ALA 4102CO 0.05 0.32 -0.01 0.93 0.00 0.00 0.00 179.25 180.54 1wvi h GLU 4103N 0.69 0.00 -0.01 0.00 5.08 -0.90 -1.29 114.58 118.16 1wvi h GLU 4103Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1wvi h GLU 4103Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1wvi h GLU 4103CO -0.01 0.01 0.00 0.00 -1.00 0.00 0.00 179.01 178.01 1wvi n ALA 4104N -2.10 2.65 0.00 3.43 0.00 -0.56 -4.87 120.51 119.07 1wvi n ALA 4104Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1wvi n ALA 4104Cb 0.29 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.33 1wvi n ALA 4104CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1wvi n GLY 4105N 0.95 0.95 3.20 0.00 0.00 -0.49 -5.07 105.19 104.73 1wvi n GLY 4105Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 1wvi n GLY 4105CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1wvi s TYR 4106N -2.00 3.44 0.45 1.61 1.51 -0.96 -4.70 117.35 116.70 1wvi s TYR 4106Ca 0.00 -1.93 -0.22 0.00 -1.01 0.00 0.00 57.07 53.91 1wvi s TYR 4106Cb 0.00 -3.23 -0.08 0.00 -0.11 0.00 0.00 41.96 38.54 1wvi s TYR 4106CO 0.00 -0.94 1.09 -0.98 -1.11 0.00 0.00 175.55 173.61 1wvi s ARG 4107N 1.32 3.87 0.07 -0.62 1.70 -1.05 -3.53 118.95 120.71 1wvi s ARG 4107Ca 0.05 1.58 -0.31 0.00 -0.47 0.00 0.00 55.73 56.58 1wvi s ARG 4107Cb -0.24 -2.35 -0.08 0.00 -0.57 0.00 0.00 34.95 31.72 1wvi s ARG 4107CO -0.01 -0.41 1.51 -1.21 -1.08 0.00 0.00 175.30 174.10 1wvi s GLU 4108N -2.80 4.25 -0.20 3.89 0.41 -1.25 -2.11 118.70 120.89 1wvi s GLU 4108Ca 0.63 2.17 -0.04 0.00 -0.41 0.00 0.00 54.97 57.32 1wvi s GLU 4108Cb -0.23 -3.46 0.07 0.00 -1.78 0.00 0.00 34.13 28.73 1wvi s GLU 4108CO 0.28 -0.60 0.09 0.34 -0.49 0.00 0.00 175.26 174.87 1wvi s ASP 4109N 1.80 2.69 0.00 -0.19 -1.08 -1.01 -4.91 116.67 113.97 1wvi s ASP 4109Ca 0.68 -0.79 0.24 0.00 -0.52 0.00 0.00 52.55 52.16 1wvi s ASP 4109Cb -0.37 -0.34 0.99 0.00 -1.46 0.00 0.00 42.92 41.74 1wvi s ASP 4109CO 0.30 -0.36 1.69 -1.54 0.52 0.00 0.00 175.17 175.78 1wvi n SER 4110N 5.22 1.27 -0.08 -0.34 3.41 -1.26 -3.65 113.62 118.19 1wvi n SER 4110Ca -0.07 -1.54 -0.09 0.00 -0.26 0.00 0.00 58.87 56.91 1wvi n SER 4110Cb 0.47 -0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 64.35 1wvi n SER 4110CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1wvi n GLU 4111N 0.03 0.48 -2.74 4.33 -0.58 -1.26 -4.81 120.64 116.08 1wvi n GLU 4111Ca 0.17 0.19 -0.18 0.00 -0.42 0.00 0.00 57.16 56.93 1wvi n GLU 4111Cb 0.29 -1.33 0.00 0.00 -0.57 0.00 0.00 31.44 29.83 1wvi n GLU 4111CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1wvi n ASN 4112N -4.35 2.59 -4.74 1.62 4.13 -1.26 -4.67 115.26 108.58 1wvi n ASN 4112Ca -0.14 -3.16 -0.35 0.00 1.68 0.00 0.00 54.58 52.61 1wvi n ASN 4112Cb 0.48 -0.53 0.06 0.00 -1.54 0.00 0.00 39.78 38.25 1wvi n ASN 4112CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1wvi s PRO 4113N -3.15 2.64 0.22 3.52 0.04 -1.24 -4.91 135.00 132.12 1wvi s PRO 4113Ca 0.38 1.82 0.11 0.00 0.04 0.00 0.00 61.00 63.35 1wvi s PRO 4113Cb 0.40 -1.89 0.11 0.00 0.04 0.00 0.00 34.50 33.17 1wvi s PRO 4113CO -0.07 -1.46 1.46 0.00 0.04 0.00 0.00 177.00 176.97 1wvi h ALA 4114N 0.42 0.66 -3.43 8.56 0.00 -1.76 -3.39 119.26 120.34 1wvi h ALA 4114Ca -0.49 -0.66 -0.42 0.00 0.00 0.00 0.00 54.91 53.34 1wvi h ALA 4114Cb 1.30 -0.12 -0.22 0.00 0.00 0.00 0.00 17.79 18.76 1wvi h ALA 4114CO 0.53 0.91 -0.78 0.71 0.00 0.00 0.00 179.25 180.62 1wvi s TYR 4115N -3.12 1.23 -0.21 0.00 2.02 -0.96 -0.92 117.35 115.39 1wvi s TYR 4115Ca 0.01 -0.46 0.00 0.00 -0.37 0.00 0.00 57.07 56.25 1wvi s TYR 4115Cb 0.10 -0.69 0.05 0.00 -0.40 0.00 0.00 41.96 41.03 1wvi s TYR 4115CO 0.77 0.06 -0.06 0.08 -1.57 0.00 0.00 175.55 174.84 1wvi s VAL 4116N -1.26 1.40 -0.15 0.71 1.01 -0.09 -1.24 120.40 120.78 1wvi s VAL 4116Ca -0.02 -1.03 -0.03 0.00 0.00 0.00 0.00 61.98 60.91 1wvi s VAL 4116Cb -0.10 -1.63 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 1wvi s VAL 4116CO 0.02 -0.02 -0.05 -0.69 0.00 0.00 0.00 175.10 174.36 1wvi s VAL 4117N 1.47 3.76 -0.07 2.92 1.01 -0.28 -0.76 120.40 128.45 1wvi s VAL 4117Ca -0.03 -0.41 0.01 0.00 0.00 0.00 0.00 61.98 61.55 1wvi s VAL 4117Cb -0.18 -2.63 0.02 0.00 0.00 0.00 0.00 36.38 33.59 1wvi s VAL 4117CO -0.07 0.51 -0.07 -0.69 0.00 0.00 0.00 175.10 174.77 1wvi s VAL 4118N 0.28 0.82 0.14 2.92 1.01 -0.14 -0.66 120.40 124.77 1wvi s VAL 4118Ca -0.04 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 61.70 1wvi s VAL 4118Cb -0.14 -0.81 -0.01 0.00 0.00 0.00 0.00 36.38 35.42 1wvi s VAL 4118CO 0.03 0.30 0.07 0.61 0.00 0.00 0.00 175.10 176.11 1wvi n GLY 4119N 4.22 3.74 3.75 4.51 0.00 0.01 -1.09 105.19 120.33 1wvi n GLY 4119Ca -0.20 -1.91 -0.41 0.00 0.00 0.00 0.00 46.02 43.49 1wvi n GLY 4119CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1wvi s LEU 4120N 0.00 4.37 -0.26 0.99 0.20 -1.26 -4.26 118.68 118.45 1wvi s LEU 4120Ca 0.10 2.78 -0.03 0.00 0.69 0.00 0.00 54.13 57.67 1wvi s LEU 4120Cb 0.00 -3.63 0.09 0.00 -0.43 0.00 0.00 46.19 42.22 1wvi s LEU 4120CO 0.07 -0.77 0.09 -0.62 -0.29 0.00 0.00 176.35 174.83 1wvi s ASP 4121N 0.32 3.45 0.00 3.68 -1.08 -1.26 -2.58 116.67 119.20 1wvi s ASP 4121Ca 0.59 -1.24 0.15 0.00 -0.52 0.00 0.00 52.55 51.54 1wvi s ASP 4121Cb -0.44 -0.56 0.91 0.00 -1.46 0.00 0.00 42.92 41.37 1wvi s ASP 4121CO 0.47 -0.39 1.32 0.35 0.52 0.00 0.00 175.17 177.43 1wvi n THR 4122N 5.08 0.00 -1.46 1.71 -2.24 -1.26 -1.56 114.28 114.55 1wvi n THR 4122Ca -0.05 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.79 1wvi n THR 4122Cb 0.44 -0.72 0.19 0.00 -2.10 0.00 0.00 70.33 68.14 1wvi n THR 4122CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1wvi n ASN 4123N -0.97 1.95 -4.66 3.42 4.13 -1.26 -5.05 115.26 112.82 1wvi n ASN 4123Ca 0.11 -3.70 -0.43 0.00 1.68 0.00 0.00 54.58 52.24 1wvi n ASN 4123Cb 0.05 -0.52 -0.01 0.00 -1.54 0.00 0.00 39.78 37.77 1wvi n ASN 4123CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 1wvi n LEU 4124N -1.18 2.86 -4.17 3.41 0.00 -0.60 -5.01 117.00 112.30 1wvi n LEU 4124Ca 0.19 1.19 -0.11 0.00 0.00 0.00 0.00 56.01 57.29 1wvi n LEU 4124Cb 0.71 -1.41 -0.10 0.00 0.00 0.00 0.00 43.42 42.62 1wvi n LEU 4124CO -0.01 -0.82 -0.35 0.42 0.00 0.00 0.00 177.39 176.63 1wvi s THR 4125N -0.99 0.51 0.21 1.96 -4.23 -1.26 -5.04 115.64 106.81 1wvi s THR 4125Ca 0.58 -1.92 -0.09 0.00 -1.18 0.00 0.00 61.69 59.08 1wvi s THR 4125Cb -0.63 -1.82 0.17 0.00 1.34 0.00 0.00 72.50 71.56 1wvi s THR 4125CO 0.60 -0.73 1.85 0.22 -0.54 0.00 0.00 174.62 176.02 1wvi h TYR 4126N 2.91 1.08 -0.79 3.99 3.20 -2.00 -2.48 116.97 122.89 1wvi h TYR 4126Ca -0.35 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.58 1wvi h TYR 4126Cb 1.18 -0.35 -0.07 0.00 1.54 0.00 0.00 36.73 39.03 1wvi h TYR 4126CO 0.54 0.74 0.45 1.49 -1.64 0.00 0.00 178.16 179.73 1wvi h GLU 4127N 1.10 0.75 -0.67 1.82 4.57 -1.98 0.17 114.58 120.35 1wvi h GLU 4127Ca 0.28 -0.05 -0.07 0.00 -1.18 0.00 0.00 59.36 58.35 1wvi h GLU 4127Cb -0.00 -0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 28.39 1wvi h GLU 4127CO -0.05 0.50 0.14 0.87 -1.18 0.00 0.00 179.01 179.29 1wvi h LYS 4128N 0.78 1.09 -0.59 1.92 1.57 -1.87 0.31 116.57 119.77 1wvi h LYS 4128Ca 0.37 -0.27 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1wvi h LYS 4128Cb 0.30 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 1wvi h LYS 4128CO -0.22 0.98 0.21 -0.07 -0.57 0.00 0.00 179.45 179.78 1wvi h LEU 4129N 1.01 0.83 -0.32 2.94 4.07 -0.97 -1.16 115.31 121.71 1wvi h LEU 4129Ca 0.21 -0.19 -0.01 0.00 0.08 0.00 0.00 57.88 57.97 1wvi h LEU 4129Cb 0.40 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.91 1wvi h LEU 4129CO 0.01 0.80 0.14 0.74 -1.08 0.00 0.00 178.44 179.05 1wvi h THR 4130N 0.82 1.17 -0.34 0.22 2.02 -0.41 0.30 112.91 116.69 1wvi h THR 4130Ca 0.19 -0.49 0.03 0.00 0.77 0.00 0.00 66.41 66.91 1wvi h THR 4130Cb 0.24 0.90 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 1wvi h THR 4130CO -0.01 0.18 0.15 -0.07 0.37 0.00 0.00 175.52 176.14 1wvi h LEU 4131N 0.38 0.22 -0.44 2.58 4.07 -0.64 -0.90 115.31 120.58 1wvi h LEU 4131Ca 0.11 0.02 -0.03 0.00 0.08 0.00 0.00 57.88 58.05 1wvi h LEU 4131Cb 0.15 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 41.85 1wvi h LEU 4131CO -0.01 0.17 0.14 0.00 -1.08 0.00 0.00 178.44 177.65 1wvi h ALA 4132N 1.18 0.57 -0.17 1.53 0.00 -0.95 -2.05 119.26 119.38 1wvi h ALA 4132Ca 0.14 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1wvi h ALA 4132Cb 0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1wvi h ALA 4132CO -0.11 0.22 0.03 1.15 0.00 0.00 0.00 179.25 180.55 1wvi h THR 4133N 0.57 0.93 -0.54 0.00 2.02 -0.01 -0.04 112.91 115.84 1wvi h THR 4133Ca 0.14 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.28 1wvi h THR 4133Cb 0.26 0.81 -0.03 0.00 -1.74 0.00 0.00 68.15 67.46 1wvi h THR 4133CO -0.00 0.02 0.30 -0.07 0.37 0.00 0.00 175.52 176.13 1wvi h LEU 4134N 0.10 0.67 -0.62 2.58 4.07 -1.11 -0.96 115.31 120.06 1wvi h LEU 4134Ca 0.08 -0.09 -0.03 0.00 0.08 0.00 0.00 57.88 57.91 1wvi h LEU 4134Cb 0.07 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 41.61 1wvi h LEU 4134CO -0.10 0.57 0.26 0.00 -1.08 0.00 0.00 178.44 178.09 1wvi h ALA 4135N 1.13 0.80 -0.35 1.53 0.00 -1.10 -1.94 119.26 119.33 1wvi h ALA 4135Ca 0.19 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1wvi h ALA 4135Cb 0.05 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1wvi h ALA 4135CO -0.03 0.41 0.16 0.82 0.00 0.00 0.00 179.25 180.61 1wvi h ILE 4136N 0.86 1.17 -0.49 0.00 2.04 -0.74 -2.15 117.51 118.21 1wvi h ILE 4136Ca 0.21 -0.49 0.07 0.00 1.00 0.00 0.00 64.86 65.65 1wvi h ILE 4136Cb 0.19 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.08 1wvi h ILE 4136CO -0.02 0.18 0.33 1.56 0.00 0.00 0.00 178.15 180.20 1wvi h GLN 4137N 0.43 0.34 0.00 2.37 4.20 -0.89 0.10 115.11 121.66 1wvi h GLN 4137Ca 0.12 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.81 1wvi h GLN 4137Cb 0.13 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.84 1wvi h GLN 4137CO -0.01 0.22 0.00 1.63 -0.67 0.00 0.00 178.83 180.00 1wvi n LYS 4138N -4.47 0.53 0.00 1.46 5.02 -0.75 -4.88 118.16 115.06 1wvi n LYS 4138Ca 0.07 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.38 1wvi n LYS 4138Cb 0.30 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.81 1wvi n LYS 4138CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wvi n GLY 4139N 0.95 0.90 3.75 0.72 0.00 0.02 -5.09 105.19 106.43 1wvi n GLY 4139Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 1wvi n GLY 4139CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wvi s ALA 4140N -2.00 2.85 -0.26 4.61 0.00 -0.98 -4.90 121.76 121.08 1wvi s ALA 4140Ca 0.00 1.35 -0.29 0.00 0.00 0.00 0.00 51.96 53.02 1wvi s ALA 4140Cb 0.00 -3.57 -0.00 0.00 0.00 0.00 0.00 23.12 19.54 1wvi s ALA 4140CO 0.00 -1.37 1.31 0.08 0.00 0.00 0.00 175.76 175.78 1wvi s VAL 4141N -1.29 4.15 -0.45 0.00 1.01 -0.09 -4.72 120.40 119.00 1wvi s VAL 4141Ca 0.71 1.33 -0.26 0.00 0.00 0.00 0.00 61.98 63.75 1wvi s VAL 4141Cb -0.41 -4.09 0.03 0.00 0.00 0.00 0.00 36.38 31.90 1wvi s VAL 4141CO 0.49 -0.38 0.96 0.12 0.00 0.00 0.00 175.10 176.28 1wvi s PHE 4142N 4.20 2.92 -0.05 5.22 5.99 -1.26 -0.92 117.98 134.09 1wvi s PHE 4142Ca 0.57 0.48 0.06 0.00 0.00 0.00 0.00 56.93 58.04 1wvi s PHE 4142Cb -0.18 -4.00 -0.01 0.00 0.00 0.00 0.00 43.02 38.82 1wvi s PHE 4142CO 0.21 -1.09 -0.24 0.42 -0.00 0.00 0.00 175.22 174.52 1wvi s ILE 4143N 3.83 2.16 -0.10 3.12 1.01 0.06 -1.14 121.20 130.14 1wvi s ILE 4143Ca 0.39 -1.04 -0.01 0.00 0.00 0.00 0.00 60.65 59.99 1wvi s ILE 4143Cb -0.10 -1.78 -0.03 0.00 0.01 0.00 0.00 42.46 40.57 1wvi s ILE 4143CO 0.26 0.57 -0.06 -0.83 0.00 0.00 0.00 174.94 174.88 1wvi s GLY 4144N -0.30 1.69 0.10 6.18 0.00 -0.01 -0.96 107.32 114.01 1wvi s GLY 4144Ca 0.01 -0.86 -0.13 0.00 0.00 0.00 0.00 44.72 43.73 1wvi s GLY 4144CO 0.02 -0.43 1.34 -0.91 0.00 0.00 0.00 173.10 173.12 1wvi h THR 4145N 4.63 1.29 -2.64 0.90 1.35 -1.42 -0.85 112.91 116.18 1wvi h THR 4145Ca -0.41 -1.81 -0.09 0.00 -0.55 0.00 0.00 66.41 63.55 1wvi h THR 4145Cb 1.18 1.86 -0.19 0.00 -1.73 0.00 0.00 68.15 69.27 1wvi h THR 4145CO 0.56 0.58 -0.07 0.54 -0.25 0.00 0.00 175.52 176.88 1wvi s ASN 4146N -6.92 -0.39 0.01 5.36 2.20 -1.26 -0.19 114.94 113.74 1wvi s ASN 4146Ca -0.11 0.31 0.27 0.00 -0.94 0.00 0.00 52.86 52.39 1wvi s ASN 4146Cb 0.09 0.42 0.81 0.00 -2.00 0.00 0.00 41.25 40.56 1wvi s ASN 4146CO 0.88 -0.55 1.63 -0.81 -2.94 0.00 0.00 177.10 175.31 1wvi n PRO 4147N 1.00 0.02 -1.68 3.55 -0.04 -1.26 -3.46 135.00 133.13 1wvi n PRO 4147Ca -0.20 0.01 -0.60 0.00 -0.04 0.00 0.00 63.50 62.67 1wvi n PRO 4147Cb 0.57 -1.51 -0.08 0.00 -0.04 0.00 0.00 33.50 32.44 1wvi n PRO 4147CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1wvi n ASP 4148N -1.54 1.56 0.16 3.54 8.00 -1.26 -3.77 116.55 123.25 1wvi n ASP 4148Ca 0.06 1.13 0.04 0.00 0.71 0.00 0.00 54.79 56.73 1wvi n ASP 4148Cb 0.34 -1.04 0.20 0.00 -0.02 0.00 0.00 41.12 40.61 1wvi n ASP 4148CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1wvi h LEU 4149N 5.51 0.00 -8.71 0.64 -0.00 -1.90 0.47 115.31 111.31 1wvi h LEU 4149Ca -0.47 0.00 -0.33 0.00 -0.00 0.00 0.00 57.88 57.09 1wvi h LEU 4149Cb 1.35 0.00 -0.15 0.00 -0.00 0.00 0.00 40.66 41.87 1wvi h LEU 4149CO 0.89 0.46 -0.68 0.20 -0.00 0.00 0.00 178.44 179.31 1wvi s ASN 4150N -6.47 1.64 -0.14 -0.43 0.01 -1.26 -0.40 114.94 107.88 1wvi s ASN 4150Ca 0.01 -1.11 -0.01 0.00 -0.71 0.00 0.00 52.86 51.05 1wvi s ASN 4150Cb 0.10 0.03 0.04 0.00 0.41 0.00 0.00 41.25 41.82 1wvi s ASN 4150CO 0.72 -0.44 -0.05 -0.51 -1.51 0.00 0.00 177.10 175.30 1wvi s ILE 4151N -3.44 1.00 -0.19 0.60 1.10 0.26 -4.46 121.20 116.07 1wvi s ILE 4151Ca 0.21 -0.46 -0.29 0.00 -0.51 0.00 0.00 60.65 59.60 1wvi s ILE 4151Cb 0.04 -1.14 0.00 0.00 0.15 0.00 0.00 42.46 41.51 1wvi s ILE 4151CO 0.03 0.20 1.06 -2.16 -2.11 0.00 0.00 174.94 171.96 1wvi s PRO 4152N 1.69 4.30 0.37 3.50 0.04 -1.26 -1.54 135.00 142.10 1wvi s PRO 4152Ca 0.02 1.41 0.04 0.00 0.04 0.00 0.00 61.00 62.51 1wvi s PRO 4152Cb -0.14 -3.63 -0.05 0.00 0.04 0.00 0.00 34.50 30.72 1wvi s PRO 4152CO -0.08 -0.56 0.06 0.95 0.04 0.00 0.00 177.00 177.41 1wvi s THR 4153N 2.93 1.19 0.49 1.26 -4.23 -0.06 -4.98 115.64 112.25 1wvi s THR 4153Ca 0.47 -2.00 0.41 0.00 -1.18 0.00 0.00 61.69 59.39 1wvi s THR 4153Cb -0.17 -2.68 0.42 0.00 1.34 0.00 0.00 72.50 71.41 1wvi s THR 4153CO 0.10 0.00 2.25 -0.08 -0.54 0.00 0.00 174.62 176.35 1wvi h GLU 4154N 1.93 0.00 0.00 3.99 4.57 -2.05 0.15 114.58 123.16 1wvi h GLU 4154Ca -0.40 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.78 1wvi h GLU 4154Cb 1.26 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.85 1wvi h GLU 4154CO 0.69 0.00 -0.37 -0.09 -1.18 0.00 0.00 179.01 178.06 1wvi h ARG 4155N 0.00 0.00 0.00 1.92 2.43 -1.98 -3.50 114.38 113.25 1wvi h ARG 4155Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1wvi h ARG 4155Cb 0.09 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 1wvi h ARG 4155CO 0.00 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.87 1wvi n GLY 4156N 1.26 0.66 3.53 2.80 0.00 0.51 -4.98 105.19 108.97 1wvi n GLY 4156Ca 0.04 -2.10 -0.42 0.00 0.00 0.00 0.00 46.02 43.54 1wvi n GLY 4156CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wvi s LEU 4157N 0.00 3.73 0.56 0.99 1.43 -1.26 -0.88 118.68 123.25 1wvi s LEU 4157Ca 0.00 -1.18 -0.01 0.00 -1.03 0.00 0.00 54.13 51.91 1wvi s LEU 4157Cb 0.00 -2.52 0.03 0.00 0.03 0.00 0.00 46.19 43.72 1wvi s LEU 4157CO 0.00 -1.53 0.80 -0.76 0.23 0.00 0.00 176.35 175.09 1wvi s LEU 4158N 4.76 3.27 0.19 1.79 1.02 -0.59 -4.85 118.68 124.27 1wvi s LEU 4158Ca 0.38 0.18 -0.32 0.00 0.02 0.00 0.00 54.13 54.39 1wvi s LEU 4158Cb -0.05 -3.02 -0.12 0.00 0.02 0.00 0.00 46.19 43.02 1wvi s LEU 4158CO -0.00 -1.12 1.72 -2.84 0.02 0.00 0.00 176.35 174.13 1wvi s PRO 4159N -4.82 4.13 0.62 1.29 0.02 -1.26 -0.57 135.00 134.42 1wvi s PRO 4159Ca 0.56 2.58 0.08 0.00 0.02 0.00 0.00 61.00 64.24 1wvi s PRO 4159Cb -0.10 -3.14 0.11 0.00 0.02 0.00 0.00 34.50 31.38 1wvi s PRO 4159CO 0.40 -0.75 0.86 0.20 -0.33 0.00 0.00 177.00 177.38 1wvi s GLY 4160N 1.36 1.71 0.24 0.52 0.00 0.46 -4.41 107.32 107.21 1wvi s GLY 4160Ca 0.75 -2.13 -0.05 0.00 0.00 0.00 0.00 44.72 43.29 1wvi s GLY 4160CO 0.32 -1.61 1.81 0.00 0.00 0.00 0.00 173.10 173.62 1wvi h ALA 4161N -0.03 1.16 -0.65 3.20 0.00 -1.80 -1.56 119.26 119.57 1wvi h ALA 4161Ca -0.30 0.03 0.07 0.00 0.00 0.00 0.00 54.91 54.72 1wvi h ALA 4161Cb 1.28 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 1wvi h ALA 4161CO 0.40 0.09 0.43 0.78 0.00 0.00 0.00 179.25 180.95 1wvi h GLY 4162N 0.78 0.78 1.05 0.00 0.00 -0.09 0.11 103.07 105.71 1wvi h GLY 4162Ca 0.39 -0.24 -0.13 0.00 0.00 0.00 0.00 47.33 47.35 1wvi h GLY 4162CO -0.24 0.17 -0.24 0.00 0.00 0.00 0.00 176.54 176.23 1wvi h ALA 4163N 1.66 0.57 -0.44 3.60 0.00 -1.40 -1.35 119.26 121.90 1wvi h ALA 4163Ca 0.29 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 1wvi h ALA 4163Cb 0.34 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1wvi h ALA 4163CO -0.09 0.57 0.10 0.82 0.00 0.00 0.00 179.25 180.65 1wvi h ILE 4164N 0.69 1.23 -0.76 0.00 2.04 -1.14 -2.53 117.51 117.05 1wvi h ILE 4164Ca 0.08 -0.82 0.07 0.00 1.00 0.00 0.00 64.86 65.20 1wvi h ILE 4164Cb 0.81 0.92 -0.06 0.00 -0.74 0.00 0.00 36.82 37.75 1wvi h ILE 4164CO 0.07 0.29 0.44 -0.07 0.00 0.00 0.00 178.15 178.88 1wvi h LEU 4165N 0.58 0.65 -1.10 1.44 3.38 -0.64 -1.85 115.31 117.78 1wvi h LEU 4165Ca 0.14 0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 1wvi h LEU 4165Cb 0.33 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1wvi h LEU 4165CO 0.00 0.40 0.05 -0.26 0.09 0.00 0.00 178.44 178.73 1wvi h PHE 4166N 0.78 0.72 -0.08 1.13 0.04 -1.00 0.14 116.94 118.67 1wvi h PHE 4166Ca 0.35 -0.07 0.01 0.00 2.80 0.00 0.00 57.97 61.06 1wvi h PHE 4166Cb 0.24 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 38.17 1wvi h PHE 4166CO -0.06 0.65 0.01 1.25 -0.60 0.00 0.00 178.31 179.56 1wvi h LEU 4167N 0.66 -0.01 -0.78 1.54 7.12 -0.93 -0.17 115.31 122.74 1wvi h LEU 4167Ca 0.14 0.01 -0.08 0.00 0.13 0.00 0.00 57.88 58.08 1wvi h LEU 4167Cb 0.34 0.02 -0.02 0.00 -0.53 0.00 0.00 40.66 40.46 1wvi h LEU 4167CO 0.01 0.01 0.01 -0.07 -0.13 0.00 0.00 178.44 178.26 1wvi h LEU 4168N 0.04 0.90 -0.37 2.25 3.38 -0.89 -1.04 115.31 119.57 1wvi h LEU 4168Ca 0.04 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.77 1wvi h LEU 4168Cb 0.03 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1wvi h LEU 4168CO -0.05 0.96 0.22 -0.08 0.09 0.00 0.00 178.44 179.57 1wvi h GLU 4169N 0.86 0.51 -0.72 1.13 4.81 -0.40 -0.20 114.58 120.57 1wvi h GLU 4169Ca 0.16 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.30 1wvi h GLU 4169Cb 0.50 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.74 1wvi h GLU 4169CO 0.02 0.40 0.30 0.87 -0.73 0.00 0.00 179.01 179.87 1wvi h LYS 4170N 0.48 1.07 0.00 1.92 1.79 -0.72 0.47 116.57 121.59 1wvi h LYS 4170Ca 0.13 -0.19 -0.10 0.00 -2.18 0.00 0.00 60.65 58.31 1wvi h LYS 4170Cb 0.02 -0.18 -0.01 0.00 -1.58 0.00 0.00 32.23 30.48 1wvi h LYS 4170CO -0.02 0.87 -0.48 0.00 -1.08 0.00 0.00 179.45 178.74 1wvi h ALA 4171N 1.15 1.04 0.00 3.86 0.00 -0.82 -3.32 119.26 121.17 1wvi h ALA 4171Ca 0.24 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1wvi h ALA 4171Cb 0.19 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1wvi h ALA 4171CO -0.02 0.61 -1.17 0.25 0.00 0.00 0.00 179.25 178.91 1wvi n THR 4172N -3.73 0.00 -1.12 0.00 -2.24 -0.12 -5.00 114.28 102.07 1wvi n THR 4172Ca -0.01 -0.25 -0.04 0.00 -2.27 0.00 0.00 64.05 61.48 1wvi n THR 4172Cb 0.54 0.51 -0.02 0.00 -2.10 0.00 0.00 70.33 69.27 1wvi n THR 4172CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1wvi n ARG 4173N -1.67 -0.86 -4.65 -0.78 1.74 0.16 -4.96 116.66 105.65 1wvi n ARG 4173Ca -0.01 0.49 -0.33 0.00 -0.77 0.00 0.00 57.85 57.23 1wvi n ARG 4173Cb 0.26 -4.29 -0.15 0.00 -1.02 0.00 0.00 32.46 27.26 1wvi n ARG 4173CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1wvi s VAL 4174N -1.86 2.98 -0.01 1.55 -7.23 -1.23 -5.04 120.40 109.55 1wvi s VAL 4174Ca 0.00 -0.68 -0.30 0.00 -1.81 0.00 0.00 61.98 59.19 1wvi s VAL 4174Cb 0.00 -2.26 -0.04 0.00 0.56 0.00 0.00 36.38 34.64 1wvi s VAL 4174CO 0.00 0.51 1.17 -0.54 -0.31 0.00 0.00 175.10 175.94 1wvi s LYS 4175N 0.56 4.40 0.42 4.82 -0.14 -1.26 -4.42 119.74 124.12 1wvi s LYS 4175Ca -0.08 1.68 -0.23 0.00 -1.36 0.00 0.00 55.97 55.98 1wvi s LYS 4175Cb -0.16 -3.47 -0.09 0.00 -1.68 0.00 0.00 37.83 32.44 1wvi s LYS 4175CO 0.04 -0.33 1.05 -1.25 -0.76 0.00 0.00 175.35 174.10 1wvi s PRO 4176N 1.65 4.05 -0.29 -1.68 0.04 -1.26 -4.94 135.00 132.56 1wvi s PRO 4176Ca 0.56 1.49 -0.25 0.00 0.04 0.00 0.00 61.00 62.84 1wvi s PRO 4176Cb -0.26 -2.42 0.00 0.00 0.04 0.00 0.00 34.50 31.86 1wvi s PRO 4176CO 0.25 -0.23 0.86 -1.50 0.04 0.00 0.00 177.00 176.41 1wvi s ILE 4177N -1.74 4.75 -0.21 0.56 1.10 -0.29 -4.81 121.20 120.56 1wvi s ILE 4177Ca 0.60 1.38 -0.12 0.00 -0.51 0.00 0.00 60.65 62.01 1wvi s ILE 4177Cb -0.21 -4.20 -0.05 0.00 0.15 0.00 0.00 42.46 38.16 1wvi s ILE 4177CO 0.26 -0.26 0.21 -0.63 -2.11 0.00 0.00 174.94 172.41 1wvi s ILE 4178N 3.07 5.34 -0.15 2.00 1.01 -1.26 -0.83 121.20 130.38 1wvi s ILE 4178Ca 0.36 0.33 -0.21 0.00 0.00 0.00 0.00 60.65 61.12 1wvi s ILE 4178Cb -0.14 -3.55 -0.18 0.00 0.01 0.00 0.00 42.46 38.60 1wvi s ILE 4178CO 0.12 0.37 0.44 0.40 0.00 0.00 0.00 174.94 176.27 1wvi h ILE 4179N 4.84 1.17 -3.21 2.92 1.08 -1.27 -3.44 117.51 119.59 1wvi h ILE 4179Ca -0.39 -1.99 -0.43 0.00 -0.39 0.00 0.00 64.86 61.65 1wvi h ILE 4179Cb 1.16 2.32 0.21 0.00 -3.07 0.00 0.00 36.82 37.44 1wvi h ILE 4179CO 0.72 0.40 -0.01 -0.83 -0.69 0.00 0.00 178.15 177.74 1wvi s GLY 4180N -4.27 1.52 0.38 5.37 0.00 0.73 -2.28 107.32 108.77 1wvi s GLY 4180Ca -0.18 -0.27 -0.27 0.00 0.00 0.00 0.00 44.72 44.01 1wvi s GLY 4180CO 0.52 0.50 1.30 0.28 0.00 0.00 0.00 173.10 175.71 1wvi n LYS 4181N -5.02 2.09 -0.58 2.90 5.02 -1.26 -0.52 118.16 120.78 1wvi n LYS 4181Ca 0.04 0.74 0.02 0.00 -2.02 0.00 0.00 58.31 57.08 1wvi n LYS 4181Cb 0.55 -2.39 0.23 0.00 -0.02 0.00 0.00 35.03 33.40 1wvi n LYS 4181CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1wvi n PRO 4182N 0.31 3.16 -1.45 1.97 -0.04 -1.25 -4.49 135.00 133.21 1wvi n PRO 4182Ca 0.05 -1.92 -0.30 0.00 -0.04 0.00 0.00 63.50 61.30 1wvi n PRO 4182Cb 0.38 -1.94 0.10 0.00 -0.04 0.00 0.00 33.50 32.00 1wvi n PRO 4182CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1wvi s GLU 4183N -2.07 2.01 0.12 0.54 0.41 0.32 -4.42 118.70 115.60 1wvi s GLU 4183Ca 0.34 0.76 -0.19 0.00 -0.41 0.00 0.00 54.97 55.46 1wvi s GLU 4183Cb 0.26 -1.90 -0.07 0.00 -1.78 0.00 0.00 34.13 30.64 1wvi s GLU 4183CO 0.09 -1.70 1.76 0.00 -0.49 0.00 0.00 175.26 174.92 1wvi h ALA 4184N -1.15 0.27 -0.39 5.21 0.00 -1.85 -3.30 119.26 118.05 1wvi h ALA 4184Ca -0.47 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.48 1wvi h ALA 4184Cb 1.26 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.91 1wvi h ALA 4184CO 0.57 -0.24 0.05 0.28 0.00 0.00 0.00 179.25 179.91 1wvi h VAL 4185N 0.27 0.77 -0.32 0.00 2.07 -1.85 0.21 116.25 117.40 1wvi h VAL 4185Ca 0.08 -0.06 -0.08 0.00 0.82 0.00 0.00 66.70 67.46 1wvi h VAL 4185Cb -0.01 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 1wvi h VAL 4185CO -0.02 0.03 -0.15 -0.29 0.02 0.00 0.00 177.57 177.17 1wvi h ILE 4186N 0.17 1.24 -0.28 4.57 2.10 -1.57 -1.74 117.51 121.99 1wvi h ILE 4186Ca 0.19 -1.11 -0.17 0.00 1.08 0.00 0.00 64.86 64.85 1wvi h ILE 4186Cb 0.24 1.17 -0.00 0.00 -1.09 0.00 0.00 36.82 37.13 1wvi h ILE 4186CO -0.27 0.36 -0.48 0.24 -1.08 0.00 0.00 178.15 176.92 1wvi h MET 4187N 0.51 0.83 -0.32 2.19 2.86 -1.46 -0.71 114.93 118.82 1wvi h MET 4187Ca 0.09 -0.51 -0.00 0.00 -2.06 0.00 0.00 59.70 57.21 1wvi h MET 4187Cb 0.55 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.25 1wvi h MET 4187CO 0.04 1.14 0.19 -0.91 1.06 0.00 0.00 176.91 178.42 1wvi h ASN 4188N 0.59 0.40 -0.38 1.22 -0.26 -0.42 0.31 115.58 117.04 1wvi h ASN 4188Ca 0.02 -0.07 -0.12 0.00 -0.56 0.00 0.00 56.30 55.57 1wvi h ASN 4188Cb 1.09 -0.10 -0.01 0.00 -1.06 0.00 0.00 38.32 38.24 1wvi h ASN 4188CO 0.11 0.35 -0.22 0.11 -1.06 0.00 0.00 177.43 176.72 1wvi h LYS 4189N 0.41 0.83 -0.75 0.81 1.79 -1.31 -0.41 116.57 117.93 1wvi h LYS 4189Ca 0.12 -0.38 -0.01 0.00 -2.18 0.00 0.00 60.65 58.20 1wvi h LYS 4189Cb 0.04 -0.02 -0.04 0.00 -1.58 0.00 0.00 32.23 30.64 1wvi h LYS 4189CO -0.02 1.01 0.43 0.00 -1.08 0.00 0.00 179.45 179.80 1wvi h ALA 4190N 0.80 0.96 -0.76 3.86 0.00 -0.99 -0.55 119.26 122.57 1wvi h ALA 4190Ca 0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1wvi h ALA 4190Cb 0.78 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1wvi h ALA 4190CO 0.06 0.45 0.43 1.25 0.00 0.00 0.00 179.25 181.44 1wvi h LEU 4191N 1.03 0.94 -0.31 0.00 6.46 -0.70 -0.24 115.31 122.48 1wvi h LEU 4191Ca 0.27 -0.07 -0.02 0.00 -0.12 0.00 0.00 57.88 57.93 1wvi h LEU 4191Cb -0.00 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 39.68 1wvi h LEU 4191CO -0.05 0.75 0.10 -0.78 -0.62 0.00 0.00 178.44 177.84 1wvi h ASP 4192N 1.06 0.46 0.38 1.25 1.82 0.01 -2.30 116.42 119.10 1wvi h ASP 4192Ca 0.27 -0.20 -0.07 0.00 -0.39 0.00 0.00 57.03 56.64 1wvi h ASP 4192Cb 0.01 -0.12 -0.01 0.00 0.68 0.00 0.00 39.33 39.89 1wvi h ASP 4192CO -0.05 0.54 -0.33 0.03 -1.61 0.00 0.00 179.24 177.82 1wvi h ARG 4193N 0.35 0.00 0.00 0.28 3.08 -0.69 -2.30 114.38 115.10 1wvi h ARG 4193Ca 0.10 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.12 1wvi h ARG 4193Cb 0.24 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.29 1wvi h ARG 4193CO -0.00 0.33 -0.17 1.25 -1.07 0.00 0.00 179.97 180.31 1wvi h LEU 4194N 0.00 0.00 0.83 3.04 5.85 -0.50 -3.47 115.31 121.06 1wvi h LEU 4194Ca -0.00 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.54 1wvi h LEU 4194Cb 0.61 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.60 1wvi h LEU 4194CO 0.04 0.17 -0.19 0.61 -0.34 0.00 0.00 178.44 178.73 1wvi n GLY 4195N -1.03 0.50 3.39 3.75 0.00 -0.87 -4.83 105.19 106.11 1wvi n GLY 4195Ca -0.02 -0.59 -0.20 0.00 0.00 0.00 0.00 46.02 45.21 1wvi n GLY 4195CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wvi s VAL 4196N -2.37 1.57 0.51 1.61 1.01 -1.26 -5.11 120.40 116.36 1wvi s VAL 4196Ca 0.00 -2.13 -0.18 0.00 0.00 0.00 0.00 61.98 59.66 1wvi s VAL 4196Cb 0.00 -2.31 -0.07 0.00 0.00 0.00 0.00 36.38 33.99 1wvi s VAL 4196CO 0.00 -0.39 1.02 -0.54 0.00 0.00 0.00 175.10 175.19 1wvi s LYS 4197N -3.73 3.74 0.23 2.72 1.02 -1.26 -4.85 119.74 117.61 1wvi s LYS 4197Ca 0.27 1.21 -0.08 0.00 0.02 0.00 0.00 55.97 57.39 1wvi s LYS 4197Cb 0.03 -2.09 0.37 0.00 -0.52 0.00 0.00 37.83 35.61 1wvi s LYS 4197CO 0.10 -0.46 1.66 -0.09 -0.92 0.00 0.00 175.35 175.64 1wvi h ARG 4198N 1.17 0.15 0.00 1.68 2.43 -1.95 0.83 114.38 118.69 1wvi h ARG 4198Ca -0.48 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1wvi h ARG 4198Cb 1.21 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 1wvi h ARG 4198CO 0.59 0.10 0.00 -2.39 -1.51 0.00 0.00 179.97 176.76 1wvi n HIS 4199N -5.26 0.00 0.99 2.20 1.44 -1.26 -2.39 115.22 110.95 1wvi n HIS 4199Ca 0.11 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.93 1wvi n HIS 4199Cb 0.41 -0.24 0.01 0.00 0.12 0.00 0.00 29.99 30.28 1wvi n HIS 4199CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1wvi n GLU 4200N -1.24 1.38 -3.37 -1.40 1.02 0.27 -4.97 120.64 112.33 1wvi n GLU 4200Ca 0.11 -1.13 -0.19 0.00 -0.02 0.00 0.00 57.16 55.93 1wvi n GLU 4200Cb 0.15 -1.47 -0.01 0.00 -0.02 0.00 0.00 31.44 30.10 1wvi n GLU 4200CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wvi s ALA 4201N -2.40 4.27 -0.13 0.62 0.00 -1.00 -0.54 121.76 122.58 1wvi s ALA 4201Ca 0.20 -1.59 -0.10 0.00 0.00 0.00 0.00 51.96 50.46 1wvi s ALA 4201Cb 0.18 -1.54 0.04 0.00 0.00 0.00 0.00 23.12 21.80 1wvi s ALA 4201CO 0.53 -0.12 0.33 -1.50 0.00 0.00 0.00 175.76 175.00 1wvi s ILE 4202N -2.27 -0.01 -0.21 0.00 2.07 -0.97 -3.89 121.20 115.91 1wvi s ILE 4202Ca 0.48 0.03 -0.14 0.00 -1.41 0.00 0.00 60.65 59.61 1wvi s ILE 4202Cb -0.09 -0.48 -0.04 0.00 0.13 0.00 0.00 42.46 41.98 1wvi s ILE 4202CO 0.31 0.01 0.33 -0.32 -1.91 0.00 0.00 174.94 173.36 1wvi s MET 4203N 0.52 4.15 -0.18 3.50 -2.45 0.15 -0.95 119.30 124.04 1wvi s MET 4203Ca -0.03 0.06 -0.03 0.00 -1.25 0.00 0.00 55.69 54.45 1wvi s MET 4203Cb -0.04 -3.53 -0.01 0.00 1.25 0.00 0.00 34.83 32.49 1wvi s MET 4203CO -0.03 0.00 -0.07 0.08 1.05 0.00 0.00 175.02 176.06 1wvi s VAL 4204N 1.20 3.37 0.37 10.11 1.01 0.15 -0.75 120.40 135.87 1wvi s VAL 4204Ca 0.16 -0.52 -0.16 0.00 0.00 0.00 0.00 61.98 61.46 1wvi s VAL 4204Cb -0.14 -2.49 0.06 0.00 0.00 0.00 0.00 36.38 33.80 1wvi s VAL 4204CO 0.07 0.46 0.80 -0.83 0.00 0.00 0.00 175.10 175.60 1wvi s GLY 4205N 0.98 0.34 -0.01 4.51 0.00 -0.79 -0.98 107.32 111.38 1wvi s GLY 4205Ca -0.00 -0.72 0.08 0.00 0.00 0.00 0.00 44.72 44.08 1wvi s GLY 4205CO 0.00 -0.15 0.23 2.09 0.00 0.00 0.00 173.10 175.27 1wvi n ASP 4206N -1.38 2.01 -4.41 1.64 5.75 -1.26 -0.90 116.55 118.00 1wvi n ASP 4206Ca -0.08 -0.29 -0.39 0.00 -0.01 0.00 0.00 54.79 54.02 1wvi n ASP 4206Cb 0.60 1.20 -0.11 0.00 -1.03 0.00 0.00 41.12 41.78 1wvi n ASP 4206CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 1wvi s ASN 4207N -2.39 5.61 0.11 -1.12 3.84 -1.26 -2.35 114.94 117.38 1wvi s ASN 4207Ca -0.00 -0.71 -0.22 0.00 0.21 0.00 0.00 52.86 52.14 1wvi s ASN 4207Cb 0.05 -2.01 -0.07 0.00 -0.55 0.00 0.00 41.25 38.67 1wvi s ASN 4207CO 0.32 -0.27 1.70 0.22 -2.79 0.00 0.00 177.10 176.28 1wvi h TYR 4208N 8.38 -0.19 -0.74 0.43 3.20 -1.94 0.65 116.97 126.77 1wvi h TYR 4208Ca -0.30 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.53 1wvi h TYR 4208Cb 1.13 0.09 -0.03 0.00 1.54 0.00 0.00 36.73 39.46 1wvi h TYR 4208CO 0.61 -0.12 0.23 1.25 -1.64 0.00 0.00 178.16 178.49 1wvi h LEU 4209N -0.10 1.08 0.09 2.82 5.85 -1.96 -0.61 115.31 122.48 1wvi h LEU 4209Ca 0.06 -0.20 -0.37 0.00 0.84 0.00 0.00 57.88 58.21 1wvi h LEU 4209Cb 0.18 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.90 1wvi h LEU 4209CO -0.14 1.00 -2.09 0.35 -0.34 0.00 0.00 178.44 177.22 1wvi n THR 4210N -4.25 1.71 -0.12 1.05 -2.24 -1.18 -4.24 114.28 105.01 1wvi n THR 4210Ca 0.06 -0.65 -0.24 0.00 -2.27 0.00 0.00 64.05 60.95 1wvi n THR 4210Cb 0.23 -1.61 -0.10 0.00 -2.10 0.00 0.00 70.33 66.75 1wvi n THR 4210CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1wvi n ASP 4211N -3.40 1.90 -0.09 3.42 8.00 0.20 -3.74 116.55 122.84 1wvi n ASP 4211Ca -0.34 0.39 -0.14 0.00 0.71 0.00 0.00 54.79 55.42 1wvi n ASP 4211Cb 1.04 -0.90 -0.04 0.00 -0.02 0.00 0.00 41.12 41.19 1wvi n ASP 4211CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1wvi h ILE 4212N -1.00 1.30 -0.26 0.53 1.08 -1.27 -2.66 117.51 115.23 1wvi h ILE 4212Ca -0.48 -1.51 -0.03 0.00 -0.39 0.00 0.00 64.86 62.45 1wvi h ILE 4212Cb 1.40 1.63 -0.01 0.00 -3.07 0.00 0.00 36.82 36.76 1wvi h ILE 4212CO -0.29 0.48 0.01 0.74 -0.69 0.00 0.00 178.15 178.41 1wvi h THR 4213N 0.45 1.15 -0.67 -0.27 2.02 -1.29 -0.29 112.91 114.02 1wvi h THR 4213Ca 0.04 -0.59 0.01 0.00 0.77 0.00 0.00 66.41 66.64 1wvi h THR 4213Cb 0.91 0.94 -0.03 0.00 -1.74 0.00 0.00 68.15 68.23 1wvi h THR 4213CO 0.08 0.20 0.44 0.00 0.37 0.00 0.00 175.52 176.61 1wvi h ALA 4214N 1.65 1.55 0.28 6.16 0.00 -1.57 0.73 119.26 128.05 1wvi h ALA 4214Ca 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1wvi h ALA 4214Cb 0.23 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1wvi h ALA 4214CO 0.00 0.41 -0.13 0.78 0.00 0.00 0.00 179.25 180.31 1wvi h GLY 4215N 0.88 -0.39 -0.05 0.00 0.00 -0.82 -3.05 103.07 99.63 1wvi h GLY 4215Ca 0.25 0.15 0.07 0.00 0.00 0.00 0.00 47.33 47.80 1wvi h GLY 4215CO -0.06 -0.14 -0.31 -2.22 0.00 0.00 0.00 176.54 173.80 1wvi h ILE 4216N -1.08 0.26 -0.48 2.60 2.04 -1.08 0.14 117.51 119.91 1wvi h ILE 4216Ca -0.04 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.87 1wvi h ILE 4216Cb 0.33 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.65 1wvi h ILE 4216CO 0.06 0.00 0.32 0.50 0.00 0.00 0.00 178.15 179.04 1wvi h LYS 4217N -0.29 0.46 -0.45 2.37 3.64 -1.01 -2.77 116.57 118.53 1wvi h LYS 4217Ca 0.15 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1wvi h LYS 4217Cb 0.53 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1wvi h LYS 4217CO -0.47 0.30 0.00 0.09 -2.27 0.00 0.00 179.45 177.10 1wvi n ASN 4218N -4.48 4.37 -3.50 4.20 3.02 -0.65 -4.97 115.26 113.25 1wvi n ASN 4218Ca 0.06 -2.68 -0.19 0.00 -0.03 0.00 0.00 54.58 51.73 1wvi n ASN 4218Cb 0.20 -0.54 0.06 0.00 -0.61 0.00 0.00 39.78 38.90 1wvi n ASN 4218CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1wvi n ASP 4219N 0.34 -2.85 -4.01 6.41 2.03 -0.20 -5.01 116.55 113.25 1wvi n ASP 4219Ca 0.22 -0.73 -0.21 0.00 0.52 0.00 0.00 54.79 54.59 1wvi n ASP 4219Cb 0.89 -4.66 -0.16 0.00 -0.72 0.00 0.00 41.12 36.46 1wvi n ASP 4219CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1wvi s ILE 4220N -3.48 0.85 0.72 5.18 1.01 0.32 -4.75 121.20 121.06 1wvi s ILE 4220Ca 0.12 -0.39 -0.16 0.00 0.00 0.00 0.00 60.65 60.22 1wvi s ILE 4220Cb -0.02 -0.76 0.00 0.00 0.01 0.00 0.00 42.46 41.68 1wvi s ILE 4220CO 0.77 0.27 0.93 0.00 0.00 0.00 0.00 174.94 176.90 1wvi n ALA 4221N 3.36 -0.35 -2.73 9.38 0.00 -1.25 -3.71 120.51 125.20 1wvi n ALA 4221Ca -0.19 -0.19 -0.17 0.00 0.00 0.00 0.00 53.44 52.89 1wvi n ALA 4221Cb 0.54 -2.09 -0.14 0.00 0.00 0.00 0.00 19.45 17.76 1wvi n ALA 4221CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1wvi s THR 4222N -1.82 0.68 -0.20 0.00 -4.23 -1.26 -0.68 115.64 108.13 1wvi s THR 4222Ca 0.73 -0.62 0.00 0.00 -1.18 0.00 0.00 61.69 60.62 1wvi s THR 4222Cb -0.35 -0.62 0.05 0.00 1.34 0.00 0.00 72.50 72.92 1wvi s THR 4222CO 0.51 0.01 -0.06 -0.22 -0.54 0.00 0.00 174.62 174.32 1wvi s LEU 4223N -0.67 2.13 -0.22 4.79 0.20 0.07 -1.70 118.68 123.27 1wvi s LEU 4223Ca -0.00 -0.93 -0.10 0.00 0.69 0.00 0.00 54.13 53.79 1wvi s LEU 4223Cb -0.05 -1.08 -0.05 0.00 -0.43 0.00 0.00 46.19 44.58 1wvi s LEU 4223CO 0.00 -0.20 0.13 -0.22 -0.29 0.00 0.00 176.35 175.77 1wvi s LEU 4224N 1.49 4.04 -0.24 -0.68 1.98 0.10 -1.88 118.68 123.49 1wvi s LEU 4224Ca -0.02 0.11 -0.08 0.00 -2.89 0.00 0.00 54.13 51.25 1wvi s LEU 4224Cb -0.17 -2.07 -0.03 0.00 0.66 0.00 0.00 46.19 44.58 1wvi s LEU 4224CO -0.07 0.10 0.08 -0.69 -1.89 0.00 0.00 176.35 173.87 1wvi s VAL 4225N 0.87 4.43 -2.00 1.68 1.01 -0.08 -0.82 120.40 125.49 1wvi s VAL 4225Ca 0.07 -0.13 0.01 0.00 0.00 0.00 0.00 61.98 61.92 1wvi s VAL 4225Cb -0.13 -3.07 0.02 0.00 0.00 0.00 0.00 36.38 33.20 1wvi s VAL 4225CO 0.03 0.34 0.32 0.35 0.00 0.00 0.00 175.10 176.14 1wvi n THR 4226N 4.79 0.00 -1.76 3.92 -2.24 0.15 -4.37 114.28 114.77 1wvi n THR 4226Ca -0.16 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.35 1wvi n THR 4226Cb 0.52 -0.74 0.20 0.00 -2.10 0.00 0.00 70.33 68.20 1wvi n THR 4226CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1wvi n THR 4227N -0.76 0.00 -4.31 4.28 5.66 -1.26 -4.22 114.28 113.67 1wvi n THR 4227Ca 0.01 -0.86 0.00 0.00 -3.05 0.00 0.00 64.05 60.14 1wvi n THR 4227Cb 0.00 -1.51 0.00 0.00 -1.55 0.00 0.00 70.33 67.28 1wvi n THR 4227CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1wvi n GLY 4228N -3.25 0.91 0.00 1.09 0.00 -1.22 -4.32 105.19 98.40 1wvi n GLY 4228Ca 0.15 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.38 1wvi n GLY 4228CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1wvi n PHE 4229N 0.00 0.00 -2.01 1.61 7.35 -1.26 -4.30 117.46 118.85 1wvi n PHE 4229Ca 0.00 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.28 1wvi n PHE 4229Cb 0.00 -0.39 -0.03 0.00 0.35 0.00 0.00 39.48 39.42 1wvi n PHE 4229CO 0.00 0.00 0.00 0.99 -0.76 0.00 0.00 176.76 176.99 1wvi s THR 4230N -2.81 3.42 0.61 -2.13 2.01 -0.99 -4.98 115.64 110.77 1wvi s THR 4230Ca 0.00 0.37 -0.18 0.00 0.31 0.00 0.00 61.69 62.19 1wvi s THR 4230Cb 0.00 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.74 1wvi s THR 4230CO 0.00 -0.59 1.19 -0.54 -0.69 0.00 0.00 174.62 173.98 1wvi s LYS 4231N 6.28 2.93 0.58 4.92 1.02 -1.26 -4.54 119.74 129.68 1wvi s LYS 4231Ca 0.75 1.74 0.28 0.00 0.02 0.00 0.00 55.97 58.77 1wvi s LYS 4231Cb -0.18 -1.93 1.77 0.00 -0.52 0.00 0.00 37.83 36.97 1wvi s LYS 4231CO 0.28 -1.22 2.24 -1.00 -0.92 0.00 0.00 175.35 174.74 1wvi h PRO 4232N 0.73 0.00 0.00 -1.68 0.13 -1.94 -2.03 132.00 127.21 1wvi h PRO 4232Ca -0.50 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.58 1wvi h PRO 4232Cb 1.29 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 1wvi h PRO 4232CO 0.55 0.00 -0.27 0.93 -0.23 0.00 0.00 178.00 178.98 1wvi h GLU 4233N 0.00 0.00 0.00 0.86 3.07 -1.97 -3.19 114.58 113.36 1wvi h GLU 4233Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1wvi h GLU 4233Cb 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.92 1wvi h GLU 4233CO 0.00 0.27 0.00 0.93 -1.40 0.00 0.00 179.01 178.81 1wvi h GLU 4234N 0.00 0.00 -0.94 2.33 5.08 -1.73 -3.36 114.58 115.96 1wvi h GLU 4234Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1wvi h GLU 4234Cb 1.08 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.29 1wvi h GLU 4234CO 0.04 0.00 0.57 -0.39 -1.00 0.00 0.00 179.01 178.23 1wvi h VAL 4235N 0.00 1.26 -0.12 3.13 -1.51 -1.62 -2.74 116.25 114.65 1wvi h VAL 4235Ca 0.00 -0.56 0.01 0.00 -1.23 0.00 0.00 66.70 64.92 1wvi h VAL 4235Cb 0.75 -0.08 -0.01 0.00 -2.13 0.00 0.00 31.29 29.83 1wvi h VAL 4235CO 0.00 0.27 0.08 -0.65 -1.23 0.00 0.00 177.57 176.05 1wvi h PRO 4236N 1.30 0.11 -0.00 5.19 0.11 -1.81 -2.10 132.00 134.80 1wvi h PRO 4236Ca 0.34 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.44 1wvi h PRO 4236Cb -0.06 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.03 1wvi h PRO 4236CO -0.06 0.08 -0.12 0.00 -0.21 0.00 0.00 178.00 177.69 1wvi n ALA 4237N -2.53 2.76 -1.74 -0.75 0.00 -1.04 -4.92 120.51 112.29 1wvi n ALA 4237Ca -0.01 -0.26 -0.42 0.00 0.00 0.00 0.00 53.44 52.75 1wvi n ALA 4237Cb 0.12 -1.34 -0.01 0.00 0.00 0.00 0.00 19.45 18.22 1wvi n ALA 4237CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1wvi n LEU 4238N -1.01 4.21 -0.17 0.00 4.77 -0.79 -4.90 117.00 119.10 1wvi n LEU 4238Ca 0.14 1.17 0.01 0.00 -0.03 0.00 0.00 56.01 57.29 1wvi n LEU 4238Cb 0.28 -1.57 0.26 0.00 -2.33 0.00 0.00 43.42 40.07 1wvi n LEU 4238CO 0.24 0.01 1.19 1.55 -1.33 0.00 0.00 177.39 179.06 1wvi h PRO 4239N 4.13 0.90 -4.09 3.23 0.13 -1.91 -3.40 132.00 130.99 1wvi h PRO 4239Ca -0.47 -0.07 -0.49 0.00 -0.87 0.00 0.00 66.00 64.10 1wvi h PRO 4239Cb 1.24 -0.20 -0.36 0.00 0.13 0.00 0.00 31.00 31.81 1wvi h PRO 4239CO 0.74 0.62 -0.79 0.42 -0.23 0.00 0.00 178.00 178.76 1wvi s ILE 4240N -5.71 0.80 0.30 -3.56 -1.09 -1.26 -5.13 121.20 105.54 1wvi s ILE 4240Ca -0.10 -0.17 -0.29 0.00 -2.23 0.00 0.00 60.65 57.85 1wvi s ILE 4240Cb 0.17 -0.84 -0.10 0.00 -1.58 0.00 0.00 42.46 40.12 1wvi s ILE 4240CO 0.78 0.32 1.11 -1.10 -1.23 0.00 0.00 174.94 174.82 1wvi s GLN 4241N 1.56 4.57 0.99 2.79 -1.52 -1.26 -5.02 119.66 121.77 1wvi s GLN 4241Ca 0.01 1.82 -0.12 0.00 -1.95 0.00 0.00 55.36 55.11 1wvi s GLN 4241Cb -0.13 -3.12 0.18 0.00 -0.22 0.00 0.00 33.01 29.72 1wvi s GLN 4241CO -0.05 0.14 1.09 -1.25 -0.25 0.00 0.00 175.29 174.97 1wvi s PRO 4242N -1.57 0.52 0.33 2.91 0.04 -1.26 -4.90 135.00 131.07 1wvi s PRO 4242Ca 0.46 0.59 0.06 0.00 0.04 0.00 0.00 61.00 62.15 1wvi s PRO 4242Cb -0.32 -1.74 0.59 0.00 0.04 0.00 0.00 34.50 33.07 1wvi s PRO 4242CO 0.41 -2.69 1.81 -0.44 0.04 0.00 0.00 177.00 176.13 1wvi h ASP 4243N -1.86 0.33 -4.17 6.66 5.19 -1.86 -3.44 116.42 117.26 1wvi h ASP 4243Ca -0.54 -0.09 -0.20 0.00 -0.62 0.00 0.00 57.03 55.58 1wvi h ASP 4243Cb 1.32 -0.09 -0.25 0.00 0.18 0.00 0.00 39.33 40.49 1wvi h ASP 4243CO 0.57 0.55 -0.68 -0.36 -3.12 0.00 0.00 179.24 176.19 1wvi s PHE 4244N -4.56 0.06 -0.08 4.55 0.08 -0.69 -5.02 117.98 112.33 1wvi s PHE 4244Ca -0.06 -0.13 0.01 0.00 0.12 0.00 0.00 56.93 56.88 1wvi s PHE 4244Cb 0.15 -0.05 0.02 0.00 -0.57 0.00 0.00 43.02 42.56 1wvi s PHE 4244CO 0.76 -0.08 -0.09 0.08 -0.10 0.00 0.00 175.22 175.79 1wvi s VAL 4245N -0.50 0.98 0.05 -0.44 1.01 -1.26 -0.72 120.40 119.52 1wvi s VAL 4245Ca -0.06 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 61.61 1wvi s VAL 4245Cb -0.03 -0.95 -0.02 0.00 0.00 0.00 0.00 36.38 35.37 1wvi s VAL 4245CO -0.00 0.34 -0.10 -0.76 0.00 0.00 0.00 175.10 174.58 1wvi s LEU 4246N 1.08 2.24 0.28 3.92 1.43 0.00 -4.98 118.68 122.67 1wvi s LEU 4246Ca -0.07 -0.54 0.19 0.00 -1.03 0.00 0.00 54.13 52.68 1wvi s LEU 4246Cb -0.14 -0.28 0.11 0.00 0.03 0.00 0.00 46.19 45.90 1wvi s LEU 4246CO -0.01 -0.14 1.33 0.77 0.23 0.00 0.00 176.35 178.53 1wvi h SER 4247N 4.54 0.00 -4.14 2.29 4.64 -1.95 0.46 113.55 119.40 1wvi h SER 4247Ca -0.37 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.83 1wvi h SER 4247Cb 1.20 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.06 1wvi h SER 4247CO 0.41 0.26 -0.23 -0.55 -0.87 0.00 0.00 176.83 175.84 1wvi s SER 4248N -6.07 -0.38 0.62 4.97 0.15 -1.26 -4.39 113.70 107.33 1wvi s SER 4248Ca 0.03 0.67 0.38 0.00 0.70 0.00 0.00 55.95 57.72 1wvi s SER 4248Cb 0.07 0.71 2.03 0.00 -1.71 0.00 0.00 66.02 67.12 1wvi s SER 4248CO 0.74 -0.22 2.26 -0.07 1.20 0.00 0.00 173.24 177.15 1wvi h LEU 4249N 5.09 0.00 -2.40 3.45 -0.00 -1.89 -1.12 115.31 118.44 1wvi h LEU 4249Ca -0.27 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.62 1wvi h LEU 4249Cb 1.18 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 41.84 1wvi h LEU 4249CO 0.29 0.02 0.03 0.00 -0.00 0.00 0.00 178.44 178.78 1wvi h ALA 4250N 1.98 1.60 0.00 1.53 0.00 -1.96 -0.76 119.26 121.65 1wvi h ALA 4250Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1wvi h ALA 4250Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1wvi h ALA 4250CO 0.00 -0.05 0.00 0.39 0.00 0.00 0.00 179.25 179.59 1wvi n GLU 4251N -3.89 0.16 -2.52 0.00 1.02 -0.42 -4.80 120.64 110.19 1wvi n GLU 4251Ca -0.02 0.27 -0.42 0.00 -0.02 0.00 0.00 57.16 56.97 1wvi n GLU 4251Cb 0.12 -1.74 -0.03 0.00 -0.02 0.00 0.00 31.44 29.77 1wvi n GLU 4251CO 0.00 0.00 0.00 -0.46 1.18 0.00 0.00 177.13 177.85 1wvi s TRP 4252N -3.16 3.55 -0.22 -0.32 -0.11 -0.29 -5.03 118.94 113.36 1wvi s TRP 4252Ca 0.08 1.49 -0.00 0.00 1.22 0.00 0.00 56.10 58.89 1wvi s TRP 4252Cb 0.12 -3.30 0.02 0.00 -1.50 0.00 0.00 33.47 28.81 1wvi s TRP 4252CO 0.45 -0.76 -0.12 0.34 -4.62 0.00 0.00 176.95 172.24 1wvi s ASP 4253N 0.62 3.88 0.00 5.86 2.15 -1.26 -5.10 116.67 122.82 1wvi s ASP 4253Ca 0.54 -0.79 0.22 0.00 0.43 0.00 0.00 52.55 52.95 1wvi s ASP 4253Cb -0.28 -1.59 1.33 0.00 -0.30 0.00 0.00 42.92 42.09 1wvi s ASP 4253CO 0.31 -0.07 1.71 0.49 -0.17 0.00 0.00 175.17 177.43