A0A087XQD5_POEFO Loading...

ADAM metallopeptidase domain 11

AlphaFold DB , UniProt , Accession A0A087XQD5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 736 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	P	42.7	Very low	77.8	Confident	153 Å²	153	74.6 Å²	74.6	99%	0.994	42%	0.421	S	S	*	.				0	141	0	-3.8	24	0	0	0	109.2	A3	P1-A3 PolarHBondContact O-N 3.21Å
2	S	45.8	Very low	78	Confident	87 Å²	87	69.9 Å²	69.9	61%	0.608	39%	0.394	S	S	*	.			trans	-58.3	132	175.7	52.1	0	0	0	0	108.9	E4	S2-E4 WeakPolarHBondContact CB-O 3.42Å; S2-E4 PolarHBondContact O-N 2.81Å; S2-E4 PolarHBondContact OG-O 3.49Å
3	A	68.9	Low	77.6	Confident	61 Å²	61	69.1 Å²	69.1	50%	0.504	39%	0.388	S	S	.	.	S	Bend	trans	-67.7	-12.7	178.6	0	0	0	0	0	112.2	P1 Y153 R154	P1-A3 PolarHBondContact O-N 3.21Å; A3-Y153 CarbonylContact O-C 3.53Å; A3-Y153 VanDerWaalsContact O-CA 3.23Å; A3-Y153 WeakPolarHBondContact O-CA 3.2Å; A3-Y153 WeakPolarHBondContact O-CB 3.39Å; A3-R154 PolarHBondContact O-N 2.89Å
4	E	82.4	Confident	76.5	Confident	116 Å²	116	75.1 Å²	75.1	54%	0.542	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	145.9	-173.8	-42.2	-171.8	158.7	0	0	109.8	S2 I151 V152	S2-E4 WeakPolarHBondContact CB-O 3.42Å; S2-E4 PolarHBondContact O-N 2.81Å; S2-E4 PolarHBondContact OG-O 3.49Å; E4-I151 HydrophobicContact CB-CG2 4.07Å; E4-V152 CarbonylContact C-O 3.59Å; E4-V152 WeakPolarHBondContact CA-O 3.49Å
5	E	88.1	Confident	75	Confident	74 Å²	74	75 Å²	75	35%	0.346	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	136.7	177.2	-171	171.2	169.5	0	0	109.6	V7 F54 V152	E5-V7 HydrophobicContact CB-CG1 4.43Å; E5-V7 HydrophobicContact CG-CG1 4.13Å; E5-F54 HydrophobicContact CB-CE1 4.17Å; E5-F54 HydrophobicContact CB-CZ 4.44Å; E5-F54 WeakPolarHBondContact OE2-CA 3.31Å; E5-F54 PolarHBondContact OE2-N 3.47Å; E5-V152 PolarHBondContact N-O 3.32Å; E5-V152 PolarHBondContact O-N 3.31Å
6	V	88.6	Confident	73.5	Confident	96 Å²	96	80.1 Å²	80.1	58%	0.582	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	125.6	173.6	-178.2	0	0	0	0	108.4	D149 H150 I151	V6-D149 HydrophobicContact CG1-CB 4.17Å; V6-H150 CarbonylContact C-O 3.53Å; V6-H150 VanDerWaalsContact CA-O 3.32Å; V6-H150 WeakPolarHBondContact CA-O 3.43Å; V6-I151 HydrophobicContact CG2-CG1 4.4Å
7	V	90.1	Very high	72	Confident	8 Å²	8	86.1 Å²	86.1	5%	0.048	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	160	-173.9	-52.5	0	0	0	0	111.2	E5 P9 V51 E52 A53 H150 V152	E5-V7 HydrophobicContact CB-CG1 4.43Å; E5-V7 HydrophobicContact CG-CG1 4.13Å; V7-P9 HydrophobicContact CG2-CG 4.16Å; V7-V51 HydrophobicContact CG2-CG1 4.3Å; V7-E52 WeakPolarHBondContact CG1-O 3.35Å; V7-A53 HydrophobicContact CG1-CB 3.94Å; V7-H150 HydrophobicContact CG2-CB 4.02Å; V7-H150 PolarHBondContact N-O 3.16Å; V7-H150 PolarHBondContact O-N 3.49Å; V7-V152 HydrophobicContact CG1-CB 4.37Å; V7-V152 HydrophobicContact CG1-CG2 4.29Å; V7-V152 HydrophobicContact CG2-CB 4.31Å; V7-V152 HydrophobicContact CG2-CG2 3.44Å; V7-V152 VanDerWaalsContact CG2-CG2 3.44Å
8	Q	89.4	Confident	70.8	Confident	119 Å²	119	83.5 Å²	83.5	56%	0.556	45%	0.446	S	S	*	.			trans	-118.7	91	172.6	-71.7	-176.5	-14.6	0	0	109.4	D149	Q8-D149 VanDerWaalsContact CG-OD1 3.25Å; Q8-D149 WeakPolarHBondContact CG-OD1 3.42Å; Q8-D149 PolarHBondContact NE2-OD1 3.4Å
9	P	88.9	Confident	70	Confident	4 Å²	4	89.2 Å²	89.2	3%	0.026	47%	0.469	C	S	.	.			trans	-59.3	149.6	177.5	-20.6	33.8	0	0	0	110.8	V7 L27 L50 V51 L117 I130 H150	V7-P9 HydrophobicContact CG2-CG 4.16Å; P9-L27 HydrophobicContact CB-CD1 4.14Å; P9-L27 HydrophobicContact CB-CD2 3.97Å; P9-L27 HydrophobicContact CG-CD1 4.42Å; P9-L27 WeakPolarHBondContact O-CD2 3.28Å; P9-L50 CarbonylContact C-O 3.55Å; P9-L50 VanDerWaalsContact CA-O 3.31Å; P9-L50 WeakPolarHBondContact CA-O 3.3Å; P9-V51 HydrophobicContact CB-CG2 4.21Å; P9-L117 HydrophobicContact CB-CD1 3.63Å; P9-L117 HydrophobicContact CG-CD1 4Å; P9-I130 HydrophobicContact CG-CD1 4.03Å; P9-H150 WeakPolarHBondContact CD-ND1 3.26Å; P9-H150 HydrophobicContact CG-CB 4.05Å
10	K	87.5	Confident	69.4	Low	72 Å²	72	91.5 Å²	91.5	31%	0.313	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	136	177.2	-64	171.6	-172	160.6	0	109.1	L23 F49 L50	K10-L23 HydrophobicContact CB-CD2 3.79Å; K10-L23 HydrophobicContact CD-CB 4.17Å; K10-L23 HydrophobicContact CD-CD1 4.23Å; K10-L23 HydrophobicContact CD-CD2 3.86Å; K10-L23 HydrophobicContact CD-CG 4.33Å; K10-L23 HydrophobicContact CG-CD2 4.48Å; K10-F49 CarbonylContact O-C 3.53Å; K10-F49 WeakPolarHBondContact O-CA 3.4Å; K10-L50 HydrophobicContact CB-CB 4.49Å; K10-L50 PolarHBondContact N-O 3.12Å; K10-L50 PolarHBondContact O-N 2.97Å
11	R	83.4	Confident	69.7	Low	31 Å²	31	90.5 Å²	90.5	12%	0.117	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	136	172.8	-171.7	170.7	174.8	-138.5	-31.5	109.4	L13 H24 L27 D28 L44 S47 F49	R11-L13 HydrophobicContact CG-CD2 4.44Å; R11-H24 PolarHBondContact N-O 3.37Å; R11-H24 PolarHBondContact O-N 2.79Å; R11-L27 HydrophobicContact CB-CD2 4.41Å; R11-D28 PolarHBondContact NH1-O 3.18Å; R11-L44 VanDerWaalsContact CZ-CD1 3.43Å; R11-S47 PolarHBondContact NE-OG 3.34Å; R11-F49 HydrophobicContact CB-CD1 3.89Å; R11-F49 HydrophobicContact CB-CE1 3.78Å; R11-F49 HydrophobicContact CG-CD1 4.06Å; R11-F49 HydrophobicContact CG-CE1 3.72Å; R11-F49 HydrophobicContact CG-CZ 4.26Å
12	L	80.4	Confident	71.1	Confident	18 Å²	18	87.6 Å²	87.6	9%	0.094	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	125.3	176.5	-63	169.6	0	0	0	109	E21 L23 S48 L50 T59	L12-E21 HydrophobicContact CD2-CB 4.28Å; L12-L23 HydrophobicContact CD2-CD2 3.48Å; L12-L23 VanDerWaalsContact CD2-CD2 3.48Å; L12-L23 HydrophobicContact CD2-CG 4.32Å; L12-S48 PolarHBondContact N-O 3.03Å; L12-L50 HydrophobicContact CD1-CB 4.42Å; L12-L50 HydrophobicContact CD2-CB 4.35Å; L12-L50 HydrophobicContact CG-CB 4.36Å; L12-T59 HydrophobicContact CD1-CG2 3.49Å; L12-T59 VanDerWaalsContact CD1-CG2 3.49Å
13	L	72.4	Confident	72.6	Confident	59 Å²	59	88 Å²	88	31%	0.309	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	124.1	176.7	-61.3	177.9	0	0	0	109.3	R11 L22 H24	R11-L13 HydrophobicContact CG-CD2 4.44Å; L13-L22 PolarHBondContact N-O 2.92Å; L13-L22 PolarHBondContact O-N 3.47Å; L13-H24 HydrophobicContact CD1-CB 3.75Å; L13-H24 HydrophobicContact CG-CB 4.1Å
14	Q	62.2	Low	72.8	Confident	153 Å²	153	89.2 Å²	89.2	72%	0.715	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	128.9	177.1	-160.3	168.5	27.6	0	0	110.1
15	Q	54.6	Low	71.9	Confident	74 Å²	74	86.2 Å²	86.2	35%	0.346	44%	0.436	S	S	.	.			trans	-72.7	138	172.7	-78.7	-175.4	0.9	0	0	110.6	H17 S18 E20 L22	Q15-H17 PolarHBondContact O-N 3.09Å; Q15-S18 WeakPolarHBondContact CB-OG 3.42Å; Q15-S18 PolarHBondContact O-N 3.37Å; Q15-S18 PolarHBondContact OE1-OG 3.29Å; Q15-E20 PolarHBondContact N-O 3.5Å; Q15-L22 HydrophobicContact CG-CD1 3.82Å; Q15-L22 HydrophobicContact CG-CG 4.12Å
16	I	50	Low	71.1	Confident	157 Å²	157	84.5 Å²	84.5	81%	0.805	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.1	-177.7	-59.9	168	0	0	0	112.4
17	H	48.1	Very low	70.6	Confident	182 Å²	182	80.7 Å²	80.7	84%	0.843	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127	11.2	-172.6	-62.9	-47.7	0	0	0	114.7	Q15	Q15-H17 PolarHBondContact O-N 3.09Å
18	S	50.4	Low	69.9	Low	39 Å²	39	81.5 Å²	81.5	27%	0.273	41%	0.408	S	S	.	.	S	Bend	trans	-149.7	160.4	175.8	81.4	0	0	0	0	111.2	Q15 E20	Q15-S18 WeakPolarHBondContact CB-OG 3.42Å; Q15-S18 PolarHBondContact O-N 3.37Å; Q15-S18 PolarHBondContact OE1-OG 3.29Å; S18-E20 PolarHBondContact O-N 2.91Å; S18-E20 WeakPolarHBondContact OG-CB 3.35Å; S18-E20 PolarHBondContact OG-N 3.35Å; S18-E20 VanDerWaalsContact OG-N 3.12Å
19	E	56.4	Low	69.2	Low	191 Å²	191	75.9 Å²	75.9	89%	0.893	38%	0.382	S	S	*	.	S	Bend	trans	-79.3	5.4	168.8	-66.2	-162.6	167.1	0	0	112.5
20	E	58.6	Low	68.4	Low	136 Å²	136	78.4 Å²	78.4	64%	0.636	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-79.9	128	179.7	-62.9	-173	163.5	0	0	111.2	Q15 S18	Q15-E20 PolarHBondContact N-O 3.5Å; S18-E20 PolarHBondContact O-N 2.91Å; S18-E20 WeakPolarHBondContact OG-CB 3.35Å; S18-E20 PolarHBondContact OG-N 3.35Å; S18-E20 VanDerWaalsContact OG-N 3.12Å
21	E	74.2	Confident	67.4	Low	71 Å²	71	77.6 Å²	77.6	33%	0.332	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	124.7	175.2	-66	-177.1	145.2	0	0	110.5	L12 R102	L12-E21 HydrophobicContact CD2-CB 4.28Å; E21-R102 IonicContact OE1-CZ 3.78Å; E21-R102 IonicContact OE1-NH1 2.79Å; E21-R102 PolarHBondContact OE1-NH1 2.01Å; E21-R102 IonicContact OE1-NH2 3.82Å; E21-R102 PolarHBondContact OE1-NH2 2.8Å; E21-R102 IonicContact OE2-CZ 2.72Å; E21-R102 IonicContact OE2-NH1 2.77Å; E21-R102 PolarHBondContact OE2-NH1 3.47Å; E21-R102 IonicContact OE2-NH2 3.83Å
22	L	73.6	Confident	66.1	Low	91 Å²	91	85.1 Å²	85.1	48%	0.476	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	131.7	175.1	-71.9	172	0	0	0	110.5	L13 Q15	L13-L22 PolarHBondContact N-O 2.92Å; L13-L22 PolarHBondContact O-N 3.47Å; Q15-L22 HydrophobicContact CG-CD1 3.82Å; Q15-L22 HydrophobicContact CG-CG 4.12Å
23	L	77.4	Confident	64.8	Low	95 Å²	95	91.4 Å²	91.4	50%	0.497	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	120.1	172.4	-70	166.3	0	0	0	110.2	K10 L12 L50	K10-L23 HydrophobicContact CB-CD2 3.79Å; K10-L23 HydrophobicContact CD-CB 4.17Å; K10-L23 HydrophobicContact CD-CD1 4.23Å; K10-L23 HydrophobicContact CD-CD2 3.86Å; K10-L23 HydrophobicContact CD-CG 4.33Å; K10-L23 HydrophobicContact CG-CD2 4.48Å; L12-L23 HydrophobicContact CD2-CD2 3.48Å; L12-L23 VanDerWaalsContact CD2-CD2 3.48Å; L12-L23 HydrophobicContact CD2-CG 4.32Å; L23-L50 HydrophobicContact CD2-CB 4.27Å; L23-L50 HydrophobicContact CD2-CD2 3.62Å
24	H	72.4	Confident	63.8	Low	87 Å²	87	91.4 Å²	91.4	40%	0.403	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.4	177.8	-161.2	61.1	0	0	0	110.7	R11 L13 H26	R11-H24 PolarHBondContact N-O 3.37Å; R11-H24 PolarHBondContact O-N 2.79Å; L13-H24 HydrophobicContact CD1-CB 3.75Å; L13-H24 HydrophobicContact CG-CB 4.1Å; H24-H26 VanDerWaalsContact CD2-CB 3.49Å; H24-H26 WeakPolarHBondContact CD2-CB 3.4Å; H24-H26 WeakPolarHBondContact NE2-CB 3.25Å; H24-H26 PolarHBondContact O-N 3.11Å
25	G	63.5	Low	63	Low	53 Å²	53	88.6 Å²	88.6	55%	0.546	45%	0.449	S	S	.	.	S	Bend	trans	-76.1	-6.6	-178.3	0	0	0	0	0	114.8
26	H	72.2	Confident	62.1	Low	38 Å²	38	93.6 Å²	93.6	18%	0.176	48%	0.478	C	S	.	.			trans	-95.5	118.6	177.9	-160.5	-87.7	0	0	0	109.9	H24 D28 R32	H24-H26 VanDerWaalsContact CD2-CB 3.49Å; H24-H26 WeakPolarHBondContact CD2-CB 3.4Å; H24-H26 WeakPolarHBondContact NE2-CB 3.25Å; H24-H26 PolarHBondContact O-N 3.11Å; H26-D28 WeakPolarHBondContact CE1-CB 3.29Å; H26-D28 IonicContact CE1-OD2 3.27Å; H26-D28 WeakPolarHBondContact ND1-CB 3.43Å; H26-R32 PolarHBondContact CE1-NH2 2.84Å; H26-R32 PolarHBondContact NE2-NH2 3.46Å; H26-R32 VanDerWaalsContact NE2-NH2 3.19Å
27	L	77.8	Confident	61.7	Low	16 Å²	16	89.7 Å²	89.7	8%	0.084	48%	0.477	C	S	.	.			trans	-88	-9	-173.3	-62.9	172.1	0	0	0	114.2	P9 R11 T29 F49 L117 H150	P9-L27 HydrophobicContact CB-CD1 4.14Å; P9-L27 HydrophobicContact CB-CD2 3.97Å; P9-L27 HydrophobicContact CG-CD1 4.42Å; P9-L27 WeakPolarHBondContact O-CD2 3.28Å; R11-L27 HydrophobicContact CB-CD2 4.41Å; L27-T29 PolarHBondContact O-N 2.83Å; L27-F49 HydrophobicContact CB-CE1 4.25Å; L27-F49 HydrophobicContact CD2-CD1 3.62Å; L27-F49 HydrophobicContact CD2-CE1 3.76Å; L27-L117 HydrophobicContact CD1-CG 4.3Å; L27-L117 HydrophobicContact CD2-CD1 4.39Å; L27-H150 WeakPolarHBondContact CD1-CE1 3.38Å
28	D	74.2	Confident	61.7	Low	26 Å²	26	85.2 Å²	85.2	14%	0.139	46%	0.458	C	S	.	.			trans	-60.6	136.7	-178.7	-166.8	11.8	0	0	0	112.1	R11 H26 R30	R11-D28 PolarHBondContact NH1-O 3.18Å; H26-D28 WeakPolarHBondContact CE1-CB 3.29Å; H26-D28 IonicContact CE1-OD2 3.27Å; H26-D28 WeakPolarHBondContact ND1-CB 3.43Å; D28-R30 WeakPolarHBondContact OD1-CB 3.24Å; D28-R30 WeakPolarHBondContact OD1-CD 3.38Å; D28-R30 WeakPolarHBondContact OD1-CG 3.24Å; D28-R30 IonicContact OD1-CZ 3.69Å; D28-R30 PolarHBondContact OD1-N 2.99Å; D28-R30 IonicContact OD1-NE 3.26Å; D28-R30 IonicContact OD1-NH1 3.48Å; D28-R30 PolarHBondContact OD1-NH1 3.45Å; D28-R30 IonicContact OD2-NH1 3.79Å
29	T	74.6	Confident	61.6	Low	0 Å²	0	92.7 Å²	92.7	0%	0	49%	0.489	C	S	.	.			trans	-107.2	2.2	177.8	53.1	0	0	0	0	112	L27 H43 L44 F49 Y97 T113	L27-T29 PolarHBondContact O-N 2.83Å; T29-H43 WeakPolarHBondContact O-CA 3.37Å; T29-H43 PolarHBondContact OG1-ND1 3.5Å; T29-L44 WeakPolarHBondContact O-CG 3.45Å; T29-L44 PolarHBondContact O-N 2.77Å; T29-F49 HydrophobicContact CG2-CE2 4.38Å; T29-F49 HydrophobicContact CG2-CZ 3.75Å; T29-Y97 WeakPolarHBondContact CB-OH 3.39Å; T29-Y97 PolarHBondContact OG1-OH 3.4Å; T29-T113 HydrophobicContact CG2-CG2 4.12Å; T29-T113 PolarHBondContact OG1-OG1 3Å
30	R	73.1	Confident	61.7	Low	57 Å²	57	86 Å²	86	22%	0.215	46%	0.457	C	S	.	.	B	Isolated β-bridge	trans	-66.8	139.6	176.3	-67.1	171	-172.3	93.6	-0.3	112.1	D28 P41 I42 E93 C114	D28-R30 WeakPolarHBondContact OD1-CB 3.24Å; D28-R30 WeakPolarHBondContact OD1-CD 3.38Å; D28-R30 WeakPolarHBondContact OD1-CG 3.24Å; D28-R30 IonicContact OD1-CZ 3.69Å; D28-R30 PolarHBondContact OD1-N 2.99Å; D28-R30 IonicContact OD1-NE 3.26Å; D28-R30 IonicContact OD1-NH1 3.48Å; D28-R30 PolarHBondContact OD1-NH1 3.45Å; D28-R30 IonicContact OD2-NH1 3.79Å; R30-P41 HydrophobicContact CG-CB 4.23Å; R30-I42 WeakPolarHBondContact CA-O 3.14Å; R30-E93 IonicContact CZ-OE1 2.68Å; R30-E93 IonicContact NE-OE1 2.6Å; R30-E93 PolarHBondContact NE-OE1 2.81Å; R30-E93 IonicContact NH2-OE1 3.96Å; R30-E93 PolarHBondContact NH2-OE1 2.69Å; R30-E93 IonicContact NH2-OE2 3.17Å; R30-E93 PolarHBondContact NH2-OE2 2.81Å; R30-C114 PolarHBondContact NH2-O 2.75Å
31	V	66.8	Low	61.9	Low	55 Å²	55	82 Å²	82	33%	0.333	44%	0.443	S	S	.	.			trans	-81.5	118.6	173.9	-177.2	0	0	0	0	109.2	N33 L34 I42 L44	V31-N33 PolarHBondContact O-N 3.03Å; V31-L34 WeakPolarHBondContact O-CD1 3.31Å; V31-I42 HydrophobicContact CG2-CG2 4.29Å; V31-I42 PolarHBondContact N-O 3.09Å; V31-L44 HydrophobicContact CG2-CD2 3.93Å; V31-L44 HydrophobicContact CG2-CG 4.32Å
32	R	55.3	Low	61.6	Low	189 Å²	189	82.3 Å²	82.3	71%	0.713	45%	0.447	S	S	*	.	S	Bend	trans	-77.9	-9.7	-172	-70.3	-175.7	176.3	-173.6	-2.2	115.7	H26	H26-R32 PolarHBondContact CE1-NH2 2.84Å; H26-R32 PolarHBondContact NE2-NH2 3.46Å; H26-R32 VanDerWaalsContact NE2-NH2 3.19Å
33	N	52.9	Low	61.6	Low	151 Å²	151	78.6 Å²	78.6	81%	0.807	43%	0.427	S	S	*	.			trans	-123.7	74.1	-176.8	-68.3	-14.5	0	0	0	111.1	V31	V31-N33 PolarHBondContact O-N 3.03Å
34	L	51.3	Low	61.2	Low	59 Å²	59	77 Å²	77	31%	0.309	42%	0.418	S	S	.	.			trans	-82.3	137	172.1	-79.5	122.4	0	0	0	110.7	V31 I38 I42	V31-L34 WeakPolarHBondContact O-CD1 3.31Å; L34-I38 HydrophobicContact CD2-CB 3.68Å; L34-I38 HydrophobicContact CD2-CD1 3.99Å; L34-I38 HydrophobicContact CD2-CG1 4.42Å; L34-I38 HydrophobicContact CD2-CG2 3.48Å; L34-I38 VanDerWaalsContact CD2-CG2 3.48Å; L34-I42 HydrophobicContact CD2-CB 4.25Å; L34-I42 HydrophobicContact CD2-CD1 3.49Å; L34-I42 VanDerWaalsContact CD2-CD1 3.49Å; L34-I42 HydrophobicContact CD2-CG1 3.75Å
35	P	45.3	Very low	61	Low	93 Å²	93	75.4 Å²	75.4	60%	0.604	42%	0.42	S	S	*	.			trans	-58.7	144.3	170.1	-9.2	15.8	0	0	0	111.5	G37 I38	P35-G37 PolarHBondContact O-N 3.06Å; P35-I38 HydrophobicContact CG-CD1 4.41Å; P35-I38 PolarHBondContact O-N 3.3Å
36	D	35.6	Very low	61.5	Low	180 Å²	180	79.4 Å²	79.4	96%	0.963	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	113.7	176.3	-80.5	-33.6	0	0	0	110.7
37	G	43.1	Very low	61.9	Low	75 Å²	75	77.9 Å²	77.9	77%	0.773	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	132.7	-16.6	177.6	0	0	0	0	0	116	P35	P35-G37 PolarHBondContact O-N 3.06Å
38	I	47	Very low	62.3	Low	87 Å²	87	78.2 Å²	78.2	45%	0.446	42%	0.422	S	S	.	.			trans	-92	110.3	179	-57.2	175.2	0	0	0	109.9	L34 P35 I42	L34-I38 HydrophobicContact CD2-CB 3.68Å; L34-I38 HydrophobicContact CD2-CD1 3.99Å; L34-I38 HydrophobicContact CD2-CG1 4.42Å; L34-I38 HydrophobicContact CD2-CG2 3.48Å; L34-I38 VanDerWaalsContact CD2-CG2 3.48Å; P35-I38 HydrophobicContact CG-CD1 4.41Å; P35-I38 PolarHBondContact O-N 3.3Å; I38-I42 HydrophobicContact CD1-CD1 4.21Å; I38-I42 HydrophobicContact CG2-CD1 4.36Å
39	Q	48.6	Very low	63.1	Low	196 Å²	196	77 Å²	77	92%	0.916	42%	0.416	S	S	*	.			trans	-81.6	-6.5	-177.3	-71.3	-178.4	-0.4	0	0	114.5
40	Q	57.4	Low	63.9	Low	50 Å²	50	78 Å²	78	23%	0.234	42%	0.421	C	S	.	.	S	Bend	trans	-114	138.6	-176.9	-71.9	-178.4	-5.5	0	0	113.1	I42 D89 G90	Q40-I42 PolarHBondContact O-N 3.48Å; Q40-D89 PolarHBondContact NE2-O 3.33Å; Q40-G90 VanDerWaalsContact NE2-C 3.29Å; Q40-G90 PolarHBondContact NE2-O 3.31Å; Q40-G90 PolarHBondContact OE1-O 2.88Å
41	P	63.7	Low	64.8	Low	52 Å²	52	75.3 Å²	75.3	34%	0.338	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-67	119.6	176.9	25.1	-30.5	0	0	0	111	R30 E93	R30-P41 HydrophobicContact CG-CB 4.23Å; P41-E93 HydrophobicContact CG-CB 4.02Å; P41-E93 HydrophobicContact CG-CG 3.86Å; P41-E93 WeakPolarHBondContact CG-OE1 3.49Å
42	I	68.9	Low	66.1	Low	79 Å²	79	77.3 Å²	77.3	41%	0.405	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-86.6	134.5	173.6	-64.6	173.5	0	0	0	109.1	R30 V31 L34 I38 Q40	R30-I42 WeakPolarHBondContact CA-O 3.14Å; V31-I42 HydrophobicContact CG2-CG2 4.29Å; V31-I42 PolarHBondContact N-O 3.09Å; L34-I42 HydrophobicContact CD2-CB 4.25Å; L34-I42 HydrophobicContact CD2-CD1 3.49Å; L34-I42 VanDerWaalsContact CD2-CD1 3.49Å; L34-I42 HydrophobicContact CD2-CG1 3.75Å; I38-I42 HydrophobicContact CD1-CD1 4.21Å; I38-I42 HydrophobicContact CG2-CD1 4.36Å; Q40-I42 PolarHBondContact O-N 3.48Å
43	H	72.3	Confident	67.7	Low	13 Å²	13	68.3 Å²	68.3	6%	0.06	38%	0.383	C	S	.	.	B	Isolated β-bridge	trans	-103.8	157.1	175.8	-70.1	-93.8	0	0	0	111.7	T29 E93 H94 Y97	T29-H43 WeakPolarHBondContact O-CA 3.37Å; T29-H43 PolarHBondContact OG1-ND1 3.5Å; H43-E93 IonicContact CE1-OE1 3.58Å; H43-E93 WeakPolarHBondContact NE2-CG 3.41Å; H43-E93 IonicContact NE2-OE1 2.85Å; H43-E93 PolarHBondContact NE2-OE1 2.92Å; H43-E93 VanDerWaalsContact NE2-OE1 3.15Å; H43-H94 PolarHBondContact CD2-O 2.79Å; H43-Y97 WeakPolarHBondContact CB-OH 3.31Å
44	L	70.2	Confident	69.4	Low	60 Å²	60	64 Å²	64	31%	0.314	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-68.6	136.9	177.5	-65.9	167.6	0	0	0	111.6	R11 T29 V31 Q46 Y97	R11-L44 VanDerWaalsContact CZ-CD1 3.43Å; T29-L44 WeakPolarHBondContact O-CG 3.45Å; T29-L44 PolarHBondContact O-N 2.77Å; V31-L44 HydrophobicContact CG2-CD2 3.93Å; V31-L44 HydrophobicContact CG2-CG 4.32Å; L44-Q46 VanDerWaalsContact C-N 3.28Å; L44-Q46 PolarHBondContact O-N 3.49Å; L44-Y97 VanDerWaalsContact O-CE1 3.29Å; L44-Y97 WeakPolarHBondContact O-CE1 3.35Å; L44-Y97 PolarHBondContact O-OH 3.25Å
45	A	67.4	Low	71	Confident	54 Å²	54	65.3 Å²	65.3	45%	0.446	39%	0.385	S	S	.	.	S	Bend	trans	-62.9	-33.8	-179.7	0	0	0	0	0	113	E63 L64	A45-E63 CarbonylContact O-C 3.52Å; A45-E63 WeakPolarHBondContact O-CA 3.45Å; A45-L64 PolarHBondContact O-N 3.16Å
46	Q	73.6	Confident	73.1	Confident	137 Å²	137	64.2 Å²	64.2	64%	0.64	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.4	142	177.3	-66.5	179.5	-4	0	0	110.5	L44 L62 E63	L44-Q46 VanDerWaalsContact C-N 3.28Å; L44-Q46 PolarHBondContact O-N 3.49Å; Q46-L62 VanDerWaalsContact CA-O 3.32Å; Q46-L62 WeakPolarHBondContact CA-O 3.16Å; Q46-E63 HydrophobicContact CG-CG 4.33Å
47	S	81.1	Confident	75.8	Confident	6 Å²	6	59.1 Å²	59.1	4%	0.042	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	142.4	174.9	-172.7	0	0	0	0	110.7	R11 F49 L62	R11-S47 PolarHBondContact NE-OG 3.34Å; S47-F49 VanDerWaalsContact OG-CE2 3.27Å; S47-F49 WeakPolarHBondContact OG-CE2 3.31Å; S47-F49 WeakPolarHBondContact OG-CZ 3.37Å; S47-L62 PolarHBondContact N-O 3.38Å; S47-L62 WeakPolarHBondContact O-CA 3.24Å; S47-L62 VanDerWaalsContact O-CB 3.26Å; S47-L62 WeakPolarHBondContact O-CB 3.46Å; S47-L62 PolarHBondContact O-N 2.95Å
48	S	86.1	Confident	78.2	Confident	24 Å²	24	55.8 Å²	55.8	17%	0.168	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	142.6	176.3	-60.5	0	0	0	0	111.2	L12 L60 D61	L12-S48 PolarHBondContact N-O 3.03Å; S48-L60 CarbonylContact C-O 3.27Å; S48-L60 WeakPolarHBondContact CA-O 3.33Å; S48-D61 WeakPolarHBondContact CB-OD1 3.5Å; S48-D61 PolarHBondContact OG-OD1 3.48Å
49	F	90.8	Very high	80.4	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	132.8	-179	-63.3	-86.8	0	0	0	111	K10 R11 L27 T29 S47 T59 L60 L62 T113 L117	K10-F49 CarbonylContact O-C 3.53Å; K10-F49 WeakPolarHBondContact O-CA 3.4Å; R11-F49 HydrophobicContact CB-CD1 3.89Å; R11-F49 HydrophobicContact CB-CE1 3.78Å; R11-F49 HydrophobicContact CG-CD1 4.06Å; R11-F49 HydrophobicContact CG-CE1 3.72Å; R11-F49 HydrophobicContact CG-CZ 4.26Å; L27-F49 HydrophobicContact CB-CE1 4.25Å; L27-F49 HydrophobicContact CD2-CD1 3.62Å; L27-F49 HydrophobicContact CD2-CE1 3.76Å; T29-F49 HydrophobicContact CG2-CE2 4.38Å; T29-F49 HydrophobicContact CG2-CZ 3.75Å; S47-F49 VanDerWaalsContact OG-CE2 3.27Å; S47-F49 WeakPolarHBondContact OG-CE2 3.31Å; S47-F49 WeakPolarHBondContact OG-CZ 3.37Å; F49-T59 CarbonylContact O-C 3.24Å; F49-T59 WeakPolarHBondContact O-CA 3.49Å; F49-L60 PolarHBondContact N-O 3.34Å; F49-L60 PolarHBondContact O-N 2.98Å; F49-L62 HydrophobicContact CD2-CD1 3.67Å; F49-L62 HydrophobicContact CD2-CG 4.35Å; F49-L62 HydrophobicContact CE2-CD1 3.88Å; F49-T113 HydrophobicContact CE2-CG2 4.24Å; F49-T113 HydrophobicContact CZ-CG2 4.2Å; F49-L117 HydrophobicContact CB-CD1 4.2Å; F49-L117 HydrophobicContact CD1-CD1 4.04Å; F49-L117 HydrophobicContact CD1-CD2 4.1Å; F49-L117 HydrophobicContact CD2-CD2 4.28Å; F49-L117 HydrophobicContact CE1-CD2 3.95Å; F49-L117 HydrophobicContact CE2-CD2 4.15Å; F49-L117 HydrophobicContact CG-CD1 4.12Å; F49-L117 HydrophobicContact CG-CD2 4.24Å; F49-L117 HydrophobicContact CZ-CD2 3.97Å
50	L	92.1	Very high	82.5	Confident	22 Å²	22	43.6 Å²	43.6	12%	0.115	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	123.4	169.8	-178.6	66.5	0	0	0	109.5	P9 K10 L12 L23 E52 F58	P9-L50 CarbonylContact C-O 3.55Å; P9-L50 VanDerWaalsContact CA-O 3.31Å; P9-L50 WeakPolarHBondContact CA-O 3.3Å; K10-L50 HydrophobicContact CB-CB 4.49Å; K10-L50 PolarHBondContact N-O 3.12Å; K10-L50 PolarHBondContact O-N 2.97Å; L12-L50 HydrophobicContact CD1-CB 4.42Å; L12-L50 HydrophobicContact CD2-CB 4.35Å; L12-L50 HydrophobicContact CG-CB 4.36Å; L23-L50 HydrophobicContact CD2-CB 4.27Å; L23-L50 HydrophobicContact CD2-CD2 3.62Å; L50-E52 HydrophobicContact CD1-CG 4.44Å; L50-E52 HydrophobicContact CD2-CG 4.24Å; L50-E52 HydrophobicContact CG-CG 4.09Å; L50-F58 WeakPolarHBondContact CA-O 3.44Å
51	V	92.6	Very high	83.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	113.9	174.9	-177.7	0	0	0	0	108	V7 P9 F58 L60 F121 I130 V152	V7-V51 HydrophobicContact CG2-CG1 4.3Å; P9-V51 HydrophobicContact CB-CG2 4.21Å; V51-F58 HydrophobicContact CB-CB 4.43Å; V51-F58 PolarHBondContact N-O 3.45Å; V51-F58 PolarHBondContact O-N 3.5Å; V51-L60 HydrophobicContact CG2-CD1 4.01Å; V51-L60 HydrophobicContact CG2-CG 4.43Å; V51-F121 HydrophobicContact CG1-CZ 4.43Å; V51-I130 HydrophobicContact CG1-CD1 4.39Å; V51-I130 HydrophobicContact CG2-CD1 4.22Å; V51-V152 HydrophobicContact CG1-CG2 3.86Å
52	E	92	Very high	85	Confident	96 Å²	96	41.5 Å²	41.5	45%	0.449	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	108.7	178.3	-59.2	-177.1	123.3	0	0	108.3	V7 L50 T56	V7-E52 WeakPolarHBondContact CG1-O 3.35Å; L50-E52 HydrophobicContact CD1-CG 4.44Å; L50-E52 HydrophobicContact CD2-CG 4.24Å; L50-E52 HydrophobicContact CG-CG 4.09Å; E52-T56 WeakPolarHBondContact CA-O 3.34Å
53	A	90.1	Very high	85.7	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.008	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	146.9	-176.1	0	0	0	0	0	110.7	V7 G55 T56 F58 V152	V7-A53 HydrophobicContact CG1-CB 3.94Å; A53-G55 PolarHBondContact O-N 3.47Å; A53-T56 PolarHBondContact N-O 2.89Å; A53-T56 PolarHBondContact O-N 2.93Å; A53-F58 HydrophobicContact CB-CE2 4.34Å; A53-V152 HydrophobicContact CB-CB 4.1Å; A53-V152 HydrophobicContact CB-CG1 3.89Å
54	F	88.8	Confident	86.1	Confident	60 Å²	60	43 Å²	43	26%	0.263	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	37.6	178.8	-50.2	-68.4	0	0	0	113.2	E5 T56 Y128 V152 R154	E5-F54 HydrophobicContact CB-CE1 4.17Å; E5-F54 HydrophobicContact CB-CZ 4.44Å; E5-F54 WeakPolarHBondContact OE2-CA 3.31Å; E5-F54 PolarHBondContact OE2-N 3.47Å; F54-T56 PolarHBondContact O-N 3.49Å; F54-T56 PolarHBondContact O-OG1 3.31Å; F54-Y128 HydrophobicContact CD2-CD1 4.05Å; F54-Y128 AromaticContact CD2-CE1 3.73Å; F54-Y128 HydrophobicContact CD2-CE1 3.73Å; F54-Y128 AromaticContact CE2-CD1 3.8Å; F54-Y128 HydrophobicContact CE2-CD1 3.8Å; F54-Y128 AromaticContact CE2-CE1 3.91Å; F54-Y128 HydrophobicContact CE2-CE1 3.91Å; F54-V152 HydrophobicContact CE2-CG1 3.9Å; F54-R154 HydrophobicContact CE2-CB 4.19Å; F54-R154 HydrophobicContact CZ-CB 4.07Å
55	G	85.3	Confident	86.8	Confident	87 Å²	87	40.4 Å²	40.4	90%	0.897	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.6	13.8	-176.2	0	0	0	0	0	114.7	A53	A53-G55 PolarHBondContact O-N 3.47Å
56	T	88.8	Confident	87.2	Confident	69 Å²	69	39.6 Å²	39.6	42%	0.423	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	141.4	-179.9	-52.3	0	0	0	0	110.3	E52 A53 F54 F58	E52-T56 WeakPolarHBondContact CA-O 3.34Å; A53-T56 PolarHBondContact N-O 2.89Å; A53-T56 PolarHBondContact O-N 2.93Å; F54-T56 PolarHBondContact O-N 3.49Å; F54-T56 PolarHBondContact O-OG1 3.31Å; T56-F58 HydrophobicContact CG2-CD1 4.24Å; T56-F58 HydrophobicContact CG2-CE1 3.71Å; T56-F58 HydrophobicContact CG2-CE2 4.15Å; T56-F58 HydrophobicContact CG2-CZ 3.66Å
57	S	91.7	Very high	87.3	Confident	74 Å²	74	34.5 Å²	34.5	52%	0.517	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	111.7	176.1	-57.2	0	0	0	0	110
58	F	93.1	Very high	87.5	Confident	4 Å²	4	34.2 Å²	34.2	2%	0.018	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	118	177	-54.8	-76.9	0	0	0	109.8	L50 V51 A53 T56 L60 I101 F121 D123 Y128	L50-F58 WeakPolarHBondContact CA-O 3.44Å; V51-F58 HydrophobicContact CB-CB 4.43Å; V51-F58 PolarHBondContact N-O 3.45Å; V51-F58 PolarHBondContact O-N 3.5Å; A53-F58 HydrophobicContact CB-CE2 4.34Å; T56-F58 HydrophobicContact CG2-CD1 4.24Å; T56-F58 HydrophobicContact CG2-CE1 3.71Å; T56-F58 HydrophobicContact CG2-CE2 4.15Å; T56-F58 HydrophobicContact CG2-CZ 3.66Å; F58-L60 HydrophobicContact CB-CD2 4.42Å; F58-I101 HydrophobicContact CD1-CD1 3.96Å; F58-F121 HydrophobicContact CB-CE2 4.09Å; F58-F121 HydrophobicContact CD1-CE2 4.14Å; F58-F121 AromaticContact CD2-CE2 3.94Å; F58-F121 HydrophobicContact CD2-CE2 3.94Å; F58-F121 HydrophobicContact CD2-CZ 4.24Å; F58-F121 HydrophobicContact CE2-CE2 4.41Å; F58-F121 AromaticContact CG-CE2 3.78Å; F58-F121 HydrophobicContact CG-CE2 3.78Å; F58-F121 HydrophobicContact CG-CZ 4.44Å; F58-D123 HydrophobicContact CE1-CB 4.33Å; F58-Y128 HydrophobicContact CE1-CE2 4.08Å; F58-Y128 HydrophobicContact CZ-CE1 4.22Å; F58-Y128 AromaticContact CZ-CE2 3.93Å; F58-Y128 HydrophobicContact CZ-CE2 3.93Å; F58-Y128 AromaticContact CZ-CZ 3.69Å
59	T	93.5	Very high	87.3	Confident	27 Å²	27	33.2 Å²	33.2	17%	0.166	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	108.2	171.1	-59	0	0	0	0	109	L12 F49 I101 R102	L12-T59 HydrophobicContact CD1-CG2 3.49Å; L12-T59 VanDerWaalsContact CD1-CG2 3.49Å; F49-T59 CarbonylContact O-C 3.24Å; F49-T59 WeakPolarHBondContact O-CA 3.49Å; T59-I101 CarbonylContact O-C 3.51Å; T59-I101 VanDerWaalsContact O-CA 3.31Å; T59-I101 WeakPolarHBondContact O-CA 3.5Å; T59-R102 HydrophobicContact CG2-CB 3.99Å; T59-R102 PolarHBondContact O-N 3.31Å
60	L	92.7	Very high	86.6	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	111.5	179.4	-51.6	-177.2	0	0	0	108.9	S48 F49 V51 F58 L62 I101 I111 F121	S48-L60 CarbonylContact C-O 3.27Å; S48-L60 WeakPolarHBondContact CA-O 3.33Å; F49-L60 PolarHBondContact N-O 3.34Å; F49-L60 PolarHBondContact O-N 2.98Å; V51-L60 HydrophobicContact CG2-CD1 4.01Å; V51-L60 HydrophobicContact CG2-CG 4.43Å; F58-L60 HydrophobicContact CB-CD2 4.42Å; L60-L62 HydrophobicContact CB-CD2 4.08Å; L60-L62 HydrophobicContact CB-CG 4.21Å; L60-I101 HydrophobicContact CD2-CG1 3.88Å; L60-I111 HydrophobicContact CD1-CG1 4.47Å; L60-F121 HydrophobicContact CD1-CD1 4.15Å; L60-F121 HydrophobicContact CD1-CG 4.36Å; L60-F121 HydrophobicContact CD2-CB 4.07Å; L60-F121 HydrophobicContact CD2-CD1 4.45Å; L60-F121 HydrophobicContact CD2-CD2 3.88Å; L60-F121 HydrophobicContact CD2-CE2 4.43Å; L60-F121 HydrophobicContact CD2-CG 3.89Å
61	D	87.5	Confident	85.3	Confident	51 Å²	51	34.9 Å²	34.9	27%	0.273	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	111.5	170.6	-68.7	-35.5	0	0	0	108.2	S48 G99 R100 R102	S48-D61 WeakPolarHBondContact CB-OD1 3.5Å; S48-D61 PolarHBondContact OG-OD1 3.48Å; D61-G99 CarbonylContact O-C 3.55Å; D61-G99 WeakPolarHBondContact O-CA 3.45Å; D61-R100 PolarHBondContact N-O 3.4Å; D61-R100 PolarHBondContact O-N 2.98Å; D61-R102 IonicContact OD1-CZ 3.9Å; D61-R102 IonicContact OD1-NE 2.79Å; D61-R102 PolarHBondContact OD1-NE 3.1Å; D61-R102 IonicContact OD1-NH2 3.22Å; D61-R102 PolarHBondContact OD1-NH2 3.35Å; D61-R102 VanDerWaalsContact OD2-CB 3.3Å; D61-R102 WeakPolarHBondContact OD2-CB 3.25Å; D61-R102 WeakPolarHBondContact OD2-CG 3.01Å; D61-R102 IonicContact OD2-CZ 3.78Å; D61-R102 IonicContact OD2-NE 2.79Å; D61-R102 PolarHBondContact OD2-NE 3.29Å; D61-R102 IonicContact OD2-NH2 3.41Å
62	L	87.1	Confident	84.1	Confident	6 Å²	6	40.2 Å²	40.2	3%	0.031	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	141.4	-170.8	-54.6	-177.3	0	0	0	111.9	Q46 S47 F49 L60 Y97 A109 I111	Q46-L62 VanDerWaalsContact CA-O 3.32Å; Q46-L62 WeakPolarHBondContact CA-O 3.16Å; S47-L62 PolarHBondContact N-O 3.38Å; S47-L62 WeakPolarHBondContact O-CA 3.24Å; S47-L62 VanDerWaalsContact O-CB 3.26Å; S47-L62 WeakPolarHBondContact O-CB 3.46Å; S47-L62 PolarHBondContact O-N 2.95Å; F49-L62 HydrophobicContact CD2-CD1 3.67Å; F49-L62 HydrophobicContact CD2-CG 4.35Å; F49-L62 HydrophobicContact CE2-CD1 3.88Å; L60-L62 HydrophobicContact CB-CD2 4.08Å; L60-L62 HydrophobicContact CB-CG 4.21Å; L62-Y97 HydrophobicContact CB-CD1 3.97Å; L62-Y97 HydrophobicContact CB-CG 4.19Å; L62-A109 HydrophobicContact CD2-CB 3.7Å; L62-I111 HydrophobicContact CD1-CB 3.89Å; L62-I111 HydrophobicContact CD1-CG1 4.14Å; L62-I111 HydrophobicContact CD1-CG2 4.17Å; L62-I111 HydrophobicContact CD2-CG1 4.26Å
63	E	83.9	Confident	83.5	Confident	109 Å²	109	36 Å²	36	51%	0.509	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	135.2	176.2	-175.1	177.3	-157.3	0	0	109.5	A45 Q46 N65 Y97 H98	A45-E63 CarbonylContact O-C 3.52Å; A45-E63 WeakPolarHBondContact O-CA 3.45Å; Q46-E63 HydrophobicContact CG-CG 4.33Å; E63-N65 PolarHBondContact O-N 3Å; E63-Y97 VanDerWaalsContact C-CD1 3.4Å; E63-Y97 CarbonylContact O-C 3.59Å; E63-Y97 VanDerWaalsContact O-CA 3.22Å; E63-Y97 WeakPolarHBondContact O-CA 3.05Å; E63-Y97 WeakPolarHBondContact O-CB 2.97Å; E63-H98 PolarHBondContact N-O 2.9Å; E63-H98 PolarHBondContact O-N 3.04Å; E63-H98 VanDerWaalsContact O-O 3.06Å
64	L	80.3	Confident	83	Confident	14 Å²	14	38 Å²	38	7%	0.073	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	133.7	-176.3	-169.6	71.1	0	0	0	109.7	A45 H66 Y97	A45-L64 PolarHBondContact O-N 3.16Å; L64-H66 PolarHBondContact O-CD2 3Å; L64-H66 PolarHBondContact O-N 2.67Å; L64-Y97 HydrophobicContact CB-CD1 4.09Å; L64-Y97 HydrophobicContact CB-CE1 3.87Å; L64-Y97 HydrophobicContact CD1-CD1 4.25Å; L64-Y97 HydrophobicContact CD1-CD2 4.07Å; L64-Y97 HydrophobicContact CD1-CE1 3.85Å; L64-Y97 HydrophobicContact CD1-CE2 3.63Å; L64-Y97 HydrophobicContact CD1-CG 4.34Å; L64-Y97 HydrophobicContact CG-CE1 4.48Å; L64-Y97 VanDerWaalsContact N-CD1 3.32Å
65	N	84.3	Confident	82.7	Confident	7 Å²	7	35.6 Å²	35.6	4%	0.037	22%	0.219	C	C	.	.			trans	-83.1	82.7	-179.2	-174.6	9.1	0	0	0	110.5	E63 N67 L68 H94 Y96 H98 N236 D239 R249	E63-N65 PolarHBondContact O-N 3Å; N65-N67 PolarHBondContact O-N 3.09Å; N65-N67 VanDerWaalsContact O-N 3.12Å; N65-N67 PolarHBondContact OD1-N 3.43Å; N65-L68 HydrophobicContact CB-CB 4.42Å; N65-L68 PolarHBondContact O-N 3.19Å; N65-H94 PolarHBondContact O-CE1 3.39Å; N65-H94 PolarHBondContact O-NE2 2.83Å; N65-Y96 WeakPolarHBondContact CB-O 3.29Å; N65-Y96 PolarHBondContact N-O 3.18Å; N65-H98 PolarHBondContact ND2-CE1 2.95Å; N65-H98 PolarHBondContact ND2-NE2 3.12Å; N65-N236 PolarHBondContact ND2-OD1 3.38Å; N65-D239 PolarHBondContact ND2-OD2 2.84Å; N65-R249 PolarHBondContact OD1-NH2 3.15Å
66	H	75.9	Confident	82.4	Confident	36 Å²	36	33.3 Å²	33.3	17%	0.167	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.8	-177.5	-61.9	-83.3	0	0	0	114.7	L64 K405 D408	L64-H66 PolarHBondContact O-CD2 3Å; L64-H66 PolarHBondContact O-N 2.67Å; H66-K405 HydrophobicContact CB-CD 4.23Å; H66-D408 IonicContact CE1-OD1 3.73Å; H66-D408 PolarHBondContact CE1-OD1 2.99Å; H66-D408 IonicContact CG-OD1 3.73Å; H66-D408 IonicContact CG-OD2 3.64Å; H66-D408 IonicContact ND1-OD1 2.77Å; H66-D408 PolarHBondContact ND1-OD1 3.02Å; H66-D408 IonicContact ND1-OD2 2.78Å; H66-D408 PolarHBondContact ND1-OD2 2.02Å
67	N	76.6	Confident	81.8	Confident	31 Å²	31	31.3 Å²	31.3	17%	0.166	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	5.8	-178.3	-56.8	-44	0	0	0	113.6	N65 R249 V251 K405 Y416	N65-N67 PolarHBondContact O-N 3.09Å; N65-N67 VanDerWaalsContact O-N 3.12Å; N65-N67 PolarHBondContact OD1-N 3.43Å; N67-R249 PolarHBondContact ND2-NH1 3.38Å; N67-R249 VanDerWaalsContact ND2-NH1 3.15Å; N67-V251 WeakPolarHBondContact O-CG2 3.4Å; N67-K405 WeakPolarHBondContact OD1-CD 3.35Å; N67-K405 WeakPolarHBondContact OD1-CE 3.49Å; N67-Y416 PolarHBondContact OD1-OH 3.27Å
68	L	84.3	Confident	80.6	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	-73.4	-36.7	-177	-174.1	62.2	0	0	0	112.8	N65 Y96 V235 N236 L252	N65-L68 HydrophobicContact CB-CB 4.42Å; N65-L68 PolarHBondContact O-N 3.19Å; L68-Y96 HydrophobicContact CD2-CD1 4.35Å; L68-Y96 HydrophobicContact CD2-CD2 3.78Å; L68-Y96 HydrophobicContact CD2-CG 3.62Å; L68-V235 HydrophobicContact CD1-CB 4.48Å; L68-V235 HydrophobicContact CD1-CG1 3.96Å; L68-N236 HydrophobicContact CD1-CB 4.26Å; L68-N236 HydrophobicContact CD2-CB 3.87Å; L68-L252 WeakPolarHBondContact O-CB 3.18Å; L68-L252 PolarHBondContact O-N 2.95Å
69	L	82.5	Confident	79.1	Confident	3 Å²	3	33.3 Å²	33.3	2%	0.016	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	130.7	-175	-54.5	179.8	0	0	0	110.4	Y73 H94 K232 L252 L406	L69-Y73 HydrophobicContact CD2-CD2 4.45Å; L69-Y73 HydrophobicContact CD2-CE1 4.39Å; L69-Y73 HydrophobicContact CD2-CE2 4.36Å; L69-H94 HydrophobicContact CD1-CB 4.12Å; L69-K232 HydrophobicContact CD2-CD 4.4Å; L69-L252 HydrophobicContact CD2-CB 3.92Å; L69-L252 HydrophobicContact CD2-CD1 3.95Å; L69-L406 HydrophobicContact CB-CB 4.27Å; L69-L406 HydrophobicContact CB-CD2 3.69Å; L69-L406 HydrophobicContact CD1-CD2 3.85Å; L69-L406 HydrophobicContact CG-CD2 4.43Å; L69-L406 PolarHBondContact O-N 2.82Å
70	S	74.8	Confident	77.3	Confident	9 Å²	9	38.5 Å²	38.5	6%	0.063	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	152.5	173.2	178.1	0	0	0	0	112	D72 Y73 L252 T404 L406	S70-D72 PolarHBondContact O-N 2.87Å; S70-D72 PolarHBondContact OG-N 2.62Å; S70-Y73 WeakPolarHBondContact O-CB 3.35Å; S70-Y73 PolarHBondContact O-N 3.1Å; S70-L252 PolarHBondContact N-O 3.04Å; S70-T404 CarbonylContact C-O 3.52Å; S70-T404 WeakPolarHBondContact CA-O 3.49Å; S70-L406 WeakPolarHBondContact O-CD1 3.39Å
71	T	65.9	Low	75.4	Confident	47 Å²	47	47 Å²	47	29%	0.288	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.3	-40.1	171.7	47.6	0	0	0	0	112.7	Y73 T404 K405 L406	T71-Y73 PolarHBondContact O-N 3.46Å; T71-T404 PolarHBondContact N-O 3.23Å; T71-T404 WeakPolarHBondContact OG1-CB 3.41Å; T71-T404 PolarHBondContact OG1-OG1 3.34Å; T71-K405 WeakPolarHBondContact CG2-O 3.24Å; T71-L406 WeakPolarHBondContact O-CD1 3.38Å
72	D	67.8	Low	73.7	Confident	113 Å²	113	52 Å²	52	60%	0.604	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	23.3	-173.4	-57.5	-4.8	0	0	0	110.1	S70 V74	S70-D72 PolarHBondContact O-N 2.87Å; S70-D72 PolarHBondContact OG-N 2.62Å; D72-V74 WeakPolarHBondContact O-CG2 3.35Å; D72-V74 PolarHBondContact O-N 3.38Å
73	Y	77.8	Confident	72	Confident	6 Å²	6	55.3 Å²	55.3	2%	0.024	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	121.9	-175.5	170.3	-96.9	0	0	0	110.9	L69 S70 T71 E75 G91 K232 L252 V253 M255	L69-Y73 HydrophobicContact CD2-CD2 4.45Å; L69-Y73 HydrophobicContact CD2-CE1 4.39Å; L69-Y73 HydrophobicContact CD2-CE2 4.36Å; S70-Y73 WeakPolarHBondContact O-CB 3.35Å; S70-Y73 PolarHBondContact O-N 3.1Å; T71-Y73 PolarHBondContact O-N 3.46Å; Y73-E75 HydrophobicContact CD1-CG 4.18Å; Y73-E75 HydrophobicContact CE1-CG 3.26Å; Y73-E75 WeakPolarHBondContact CE1-OE1 3.08Å; Y73-E75 WeakPolarHBondContact OH-CG 3.26Å; Y73-E75 PolarHBondContact OH-OE1 3.36Å; Y73-G91 WeakPolarHBondContact CE1-O 3.27Å; Y73-K232 WeakPolarHBondContact OH-CE 3.47Å; Y73-L252 HydrophobicContact CD2-CB 3.95Å; Y73-L252 WeakPolarHBondContact CD2-O 3.39Å; Y73-L252 HydrophobicContact CE2-CB 3.83Å; Y73-V253 WeakPolarHBondContact CA-O 3.19Å; Y73-M255 HydrophobicContact CE2-CB 4.12Å; Y73-M255 VanDerWaalsContact OH-CB 3.22Å; Y73-M255 WeakPolarHBondContact OH-CB 3.19Å
74	V	80.3	Confident	70.4	Confident	43 Å²	43	51.7 Å²	51.7	26%	0.261	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	129.7	-175.9	177.2	0	0	0	0	110.9	D72 R76 V253 A254 M255	D72-V74 WeakPolarHBondContact O-CG2 3.35Å; D72-V74 PolarHBondContact O-N 3.38Å; V74-R76 HydrophobicContact CG1-CG 4Å; V74-V253 PolarHBondContact N-O 3.47Å; V74-A254 CarbonylContact O-C 3.56Å; V74-A254 WeakPolarHBondContact O-CA 3.31Å; V74-M255 PolarHBondContact O-N 3.09Å
75	E	81.8	Confident	68.8	Low	11 Å²	11	56.7 Å²	56.7	5%	0.051	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	133.4	171.1	-59.8	-167.2	156.8	0	0	111.2	Y73 K228 K232 M255	Y73-E75 HydrophobicContact CD1-CG 4.18Å; Y73-E75 HydrophobicContact CE1-CG 3.26Å; Y73-E75 WeakPolarHBondContact CE1-OE1 3.08Å; Y73-E75 WeakPolarHBondContact OH-CG 3.26Å; Y73-E75 PolarHBondContact OH-OE1 3.36Å; E75-K228 WeakPolarHBondContact OE2-CD 3.44Å; E75-K228 WeakPolarHBondContact OE2-CE 3.36Å; E75-K228 IonicContact OE2-NZ 3.95Å; E75-K228 PolarHBondContact OE2-NZ 2.79Å; E75-K232 WeakPolarHBondContact OE1-CE 3.38Å; E75-K232 IonicContact OE1-NZ 2.85Å; E75-K232 PolarHBondContact OE1-NZ 2.63Å; E75-M255 CarbonylContact C-O 3.48Å; E75-M255 WeakPolarHBondContact CA-O 3.41Å
76	R	80.2	Confident	67	Low	38 Å²	38	61.2 Å²	61.2	14%	0.143	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	141.2	178.8	-59.1	-179.9	-170.2	162.5	6.3	110.3	V74 L83 M255 E256 T257	V74-R76 HydrophobicContact CG1-CG 4Å; R76-L83 HydrophobicContact CB-CD1 4.41Å; R76-M255 PolarHBondContact N-O 2.96Å; R76-E256 HydrophobicContact CB-CB 4.48Å; R76-E256 HydrophobicContact CB-CG 4.22Å; R76-E256 WeakPolarHBondContact O-CA 3.43Å; R76-T257 PolarHBondContact O-N 3.26Å
77	H	75	Confident	65.4	Low	27 Å²	27	64.3 Å²	64.3	13%	0.125	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	152.4	168.1	66.6	-61	0	0	0	108.4	S84 N86 T224	H77-S84 PolarHBondContact CD2-OG 2.81Å; H77-S84 PolarHBondContact CE1-O 2.84Å; H77-S84 VanDerWaalsContact CE1-O 3.24Å; H77-S84 PolarHBondContact CE1-OG 2.9Å; H77-S84 PolarHBondContact ND1-O 3.13Å; H77-S84 PolarHBondContact NE2-OG 2.79Å; H77-S84 PolarHBondContact O-N 3.24Å; H77-S84 PolarHBondContact O-OG 2.79Å; H77-S84 VanDerWaalsContact O-OG 3.1Å; H77-N86 PolarHBondContact CE1-ND2 2.94Å; H77-T224 HydrophobicContact CB-CG2 4.26Å
78	F	68.4	Low	63.9	Low	32 Å²	32	65 Å²	65	14%	0.14	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	111.4	177.1	-75.8	-84.2	0	0	0	108.9	L83 E256 T257 S259 S260	F78-L83 HydrophobicContact CD1-CB 4.23Å; F78-L83 HydrophobicContact CD1-CD1 3.97Å; F78-L83 HydrophobicContact CD2-CD1 4.39Å; F78-L83 HydrophobicContact CE1-CB 3.78Å; F78-L83 HydrophobicContact CE1-CD1 3.35Å; F78-L83 HydrophobicContact CE1-CG 4.17Å; F78-L83 HydrophobicContact CE2-CD1 3.79Å; F78-L83 HydrophobicContact CG-CD1 4.49Å; F78-L83 HydrophobicContact CZ-CD1 3.26Å; F78-L83 HydrophobicContact CZ-CG 4.45Å; F78-E256 HydrophobicContact CD2-CG 4.36Å; F78-E256 HydrophobicContact CE2-CG 4.07Å; F78-E256 VanDerWaalsContact CE2-OE1 3.31Å; F78-E256 WeakPolarHBondContact CE2-OE1 3.45Å; F78-T257 PolarHBondContact N-O 3.3Å; F78-S259 PolarHBondContact O-OG 2.94Å; F78-S260 PolarHBondContact O-OG 3.27Å; F78-S260 VanDerWaalsContact O-OG 3.11Å
79	D	60	Low	61.8	Low	89 Å²	89	72.6 Å²	72.6	48%	0.476	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127.6	171.6	-152.2	-0.7	0	0	0	108.9	R81 E82	D79-R81 PolarHBondContact O-N 2.61Å; D79-E82 PolarHBondContact O-N 2.95Å
80	N	55.5	Low	60.3	Low	135 Å²	135	73.2 Å²	73.2	72%	0.722	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	49.1	178.8	-67.4	-35.6	0	0	0	116.1	E82 S260	N80-E82 PolarHBondContact O-N 2.68Å; N80-S260 PolarHBondContact N-OG 2.99Å
81	R	53.5	Low	59.3	Low	179 Å²	179	72.8 Å²	72.8	68%	0.675	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	-9	176.5	-67.9	-175.5	169.4	169.4	3.3	116.8	D79 E261	D79-R81 PolarHBondContact O-N 2.61Å; R81-E261 IonicContact CZ-OE1 3.5Å; R81-E261 IonicContact NE-OE1 3.53Å; R81-E261 PolarHBondContact NE-OE1 3.04Å; R81-E261 IonicContact NH2-OE1 2.99Å; R81-E261 PolarHBondContact NH2-OE1 2.82Å; R81-E261 IonicContact NH2-OE2 3.63Å
82	E	51.5	Low	59.2	Low	158 Å²	158	71.4 Å²	71.4	74%	0.738	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	144.6	167.3	-66.9	-170.1	163.6	0	0	110.4	D79 N80 S84	D79-E82 PolarHBondContact O-N 2.95Å; N80-E82 PolarHBondContact O-N 2.68Å; E82-S84 PolarHBondContact O-N 3.29Å; E82-S84 VanDerWaalsContact O-N 3.09Å
83	L	52.8	Low	59.5	Low	75 Å²	75	68.2 Å²	68.2	39%	0.393	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	96.9	171.8	-177.8	78.4	0	0	0	107.3	R76 F78 Q85	R76-L83 HydrophobicContact CB-CD1 4.41Å; F78-L83 HydrophobicContact CD1-CB 4.23Å; F78-L83 HydrophobicContact CD1-CD1 3.97Å; F78-L83 HydrophobicContact CD2-CD1 4.39Å; F78-L83 HydrophobicContact CE1-CB 3.78Å; F78-L83 HydrophobicContact CE1-CD1 3.35Å; F78-L83 HydrophobicContact CE1-CG 4.17Å; F78-L83 HydrophobicContact CE2-CD1 3.79Å; F78-L83 HydrophobicContact CG-CD1 4.49Å; F78-L83 HydrophobicContact CZ-CD1 3.26Å; F78-L83 HydrophobicContact CZ-CG 4.45Å; L83-Q85 VanDerWaalsContact C-N 3.27Å; L83-Q85 HydrophobicContact CD2-CG 3.74Å; L83-Q85 HydrophobicContact CG-CG 4.09Å; L83-Q85 PolarHBondContact O-N 3.5Å
84	S	48.4	Very low	59.6	Low	33 Å²	33	68.2 Å²	68.2	23%	0.231	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	89	166.7	48.5	0	0	0	0	108.4	H77 E82 N86	H77-S84 PolarHBondContact CD2-OG 2.81Å; H77-S84 PolarHBondContact CE1-O 2.84Å; H77-S84 VanDerWaalsContact CE1-O 3.24Å; H77-S84 PolarHBondContact CE1-OG 2.9Å; H77-S84 PolarHBondContact ND1-O 3.13Å; H77-S84 PolarHBondContact NE2-OG 2.79Å; H77-S84 PolarHBondContact O-N 3.24Å; H77-S84 PolarHBondContact O-OG 2.79Å; H77-S84 VanDerWaalsContact O-OG 3.1Å; E82-S84 PolarHBondContact O-N 3.29Å; E82-S84 VanDerWaalsContact O-N 3.09Å; S84-N86 PolarHBondContact O-N 3.19Å
85	Q	47.6	Very low	59.8	Low	118 Å²	118	66.2 Å²	66.2	55%	0.551	34%	0.342	S	S	*	.			trans	-67.2	86.3	164.2	-85	-179.8	-4.4	0	0	108.3	L83 T87	L83-Q85 VanDerWaalsContact C-N 3.27Å; L83-Q85 HydrophobicContact CD2-CG 3.74Å; L83-Q85 HydrophobicContact CG-CG 4.09Å; L83-Q85 PolarHBondContact O-N 3.5Å; Q85-T87 HydrophobicContact CB-CG2 4.39Å; Q85-T87 PolarHBondContact O-N 2.91Å
86	N	46	Very low	60.2	Low	103 Å²	103	65.8 Å²	65.8	55%	0.551	34%	0.34	S	S	*	.			trans	-73.9	82.2	146.6	-74	-5.3	0	0	0	105.4	H77 S84 S88	H77-N86 PolarHBondContact CE1-ND2 2.94Å; S84-N86 PolarHBondContact O-N 3.19Å; N86-S88 PolarHBondContact O-N 3.23Å
87	T	42	Very low	60.6	Low	101 Å²	101	64 Å²	64	62%	0.62	33%	0.333	S	S	*	.			trans	-64	77.2	157.4	39.6	0	0	0	0	106.7	Q85 D89	Q85-T87 HydrophobicContact CB-CG2 4.39Å; Q85-T87 PolarHBondContact O-N 2.91Å; T87-D89 PolarHBondContact O-N 3.21Å
88	S	45.4	Very low	61.4	Low	45 Å²	45	63.2 Å²	63.2	32%	0.315	33%	0.33	S	S	.	.			trans	-69.4	94.5	158.5	54.5	0	0	0	0	105.3	N86 G90 G91	N86-S88 PolarHBondContact O-N 3.23Å; S88-G90 PolarHBondContact O-N 3.38Å; S88-G90 VanDerWaalsContact O-N 3.11Å; S88-G91 PolarHBondContact O-N 2.9Å
89	D	40.7	Very low	62.5	Low	160 Å²	160	62.4 Å²	62.4	86%	0.856	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	116.2	165.2	-146.5	12.8	0	0	0	106.3	Q40 T87	Q40-D89 PolarHBondContact NE2-O 3.33Å; T87-D89 PolarHBondContact O-N 3.21Å
90	G	50.8	Low	64	Low	15 Å²	15	64.2 Å²	64.2	16%	0.155	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	104.9	16.7	-179.2	0	0	0	0	0	118	Q40 S88 G92 L406	Q40-G90 VanDerWaalsContact NE2-C 3.29Å; Q40-G90 PolarHBondContact NE2-O 3.31Å; Q40-G90 PolarHBondContact OE1-O 2.88Å; S88-G90 PolarHBondContact O-N 3.38Å; S88-G90 VanDerWaalsContact O-N 3.11Å; G90-G92 VanDerWaalsContact C-N 3.25Å; G90-G92 PolarHBondContact O-N 2.63Å; G90-L406 WeakPolarHBondContact O-CD2 3.37Å
91	G	54	Low	65.7	Low	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.298	C	S	.	.			trans	65	10.3	162.7	0	0	0	0	0	120.3	Y73 S88 K232	Y73-G91 WeakPolarHBondContact CE1-O 3.27Å; S88-G91 PolarHBondContact O-N 2.9Å; G91-K232 PolarHBondContact O-NZ 3.42Å
92	G	64.2	Low	67.4	Low	19 Å²	19	54.2 Å²	54.2	20%	0.196	28%	0.283	C	S	.	.	S	Bend	trans	75	-168.9	179.5	0	0	0	0	0	113.2	G90 H94	G90-G92 VanDerWaalsContact C-N 3.25Å; G90-G92 PolarHBondContact O-N 2.63Å; G92-H94 PolarHBondContact O-N 2.73Å
93	E	74.6	Confident	69.1	Low	46 Å²	46	50.2 Å²	50.2	22%	0.215	29%	0.285	C	S	.	.			trans	-65.8	132	179.9	-178	170.9	-120.6	0	0	111.9	R30 P41 H43	R30-E93 IonicContact CZ-OE1 2.68Å; R30-E93 IonicContact NE-OE1 2.6Å; R30-E93 PolarHBondContact NE-OE1 2.81Å; R30-E93 IonicContact NH2-OE1 3.96Å; R30-E93 PolarHBondContact NH2-OE1 2.69Å; R30-E93 IonicContact NH2-OE2 3.17Å; R30-E93 PolarHBondContact NH2-OE2 2.81Å; P41-E93 HydrophobicContact CG-CB 4.02Å; P41-E93 HydrophobicContact CG-CG 3.86Å; P41-E93 WeakPolarHBondContact CG-OE1 3.49Å; H43-E93 IonicContact CE1-OE1 3.58Å; H43-E93 WeakPolarHBondContact NE2-CG 3.41Å; H43-E93 IonicContact NE2-OE1 2.85Å; H43-E93 PolarHBondContact NE2-OE1 2.92Å; H43-E93 VanDerWaalsContact NE2-OE1 3.15Å
94	H	78.8	Confident	70.7	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.028	29%	0.285	C	S	.	.			trans	-117.6	105.8	177.4	-178.2	58	0	0	0	111.4	H43 N65 L69 G92 Y96 L407	H43-H94 PolarHBondContact CD2-O 2.79Å; N65-H94 PolarHBondContact O-CE1 3.39Å; N65-H94 PolarHBondContact O-NE2 2.83Å; L69-H94 HydrophobicContact CD1-CB 4.12Å; G92-H94 PolarHBondContact O-N 2.73Å; H94-Y96 AromaticContact ND1-CD2 3.46Å; H94-Y96 WeakPolarHBondContact ND1-CD2 3.12Å; H94-L407 HydrophobicContact CB-CD1 3.08Å; H94-L407 HydrophobicContact CB-CG 4.43Å; H94-L407 WeakPolarHBondContact CD2-CD1 3.33Å
95	C	85.3	Confident	72.1	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.311	C	S	.	.			trans	-131.8	24.1	-169.2	67	0	0	0	0	111	Y97 S112 T113 C114	C95-Y97 VanDerWaalsContact C-CE2 3.44Å; C95-Y97 WeakPolarHBondContact O-CD2 3.37Å; C95-Y97 VanDerWaalsContact O-CE2 3.22Å; C95-Y97 WeakPolarHBondContact O-CE2 3.23Å; C95-S112 WeakPolarHBondContact O-CA 3.13Å; C95-S112 PolarHBondContact SG-OG 2.81Å; C95-T113 PolarHBondContact O-N 3.43Å; C95-T113 PolarHBondContact O-OG1 3.48Å; C95-C114 HydrophobicContact CB-CB 3.93Å; C95-C114 WeakPolarHBondContact CB-SG 2.99Å; C95-C114 WeakPolarHBondContact SG-CA 3.49Å; C95-C114 WeakPolarHBondContact SG-CB 3.09Å; C95-C114 PolarHBondContact SG-N 2.84Å; C95-C114 CovalentContact SG-SG 1.99Å; C95-C114 PolarHBondContact SG-SG 2.83Å
96	Y	89.5	Confident	73.5	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.008	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	125.1	-169.5	-57	-84.3	0	0	0	109.9	N65 L68 H94 I229 K232 S233 N236	N65-Y96 WeakPolarHBondContact CB-O 3.29Å; N65-Y96 PolarHBondContact N-O 3.18Å; L68-Y96 HydrophobicContact CD2-CD1 4.35Å; L68-Y96 HydrophobicContact CD2-CD2 3.78Å; L68-Y96 HydrophobicContact CD2-CG 3.62Å; H94-Y96 AromaticContact ND1-CD2 3.46Å; H94-Y96 WeakPolarHBondContact ND1-CD2 3.12Å; Y96-I229 WeakPolarHBondContact OH-CA 3.5Å; Y96-I229 PolarHBondContact OH-O 3.03Å; Y96-K232 HydrophobicContact CD1-CB 4.27Å; Y96-K232 HydrophobicContact CD2-CB 4.41Å; Y96-K232 HydrophobicContact CE1-CB 3.51Å; Y96-K232 HydrophobicContact CE2-CB 3.7Å; Y96-K232 HydrophobicContact CE2-CD 3.57Å; Y96-K232 HydrophobicContact CE2-CG 4.24Å; Y96-K232 VanDerWaalsContact OH-CB 3.23Å; Y96-K232 WeakPolarHBondContact OH-CB 3.5Å; Y96-K232 WeakPolarHBondContact OH-CD 3.44Å; Y96-S233 WeakPolarHBondContact CE1-OG 3.21Å; Y96-N236 HydrophobicContact CD1-CB 4.26Å
97	Y	88.6	Confident	75.6	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	152.1	-171.3	-63	-108.4	0	0	0	111.4	T29 H43 L44 L62 E63 L64 C95 A110 I111 T113 N236	T29-Y97 WeakPolarHBondContact CB-OH 3.39Å; T29-Y97 PolarHBondContact OG1-OH 3.4Å; H43-Y97 WeakPolarHBondContact CB-OH 3.31Å; L44-Y97 VanDerWaalsContact O-CE1 3.29Å; L44-Y97 WeakPolarHBondContact O-CE1 3.35Å; L44-Y97 PolarHBondContact O-OH 3.25Å; L62-Y97 HydrophobicContact CB-CD1 3.97Å; L62-Y97 HydrophobicContact CB-CG 4.19Å; E63-Y97 VanDerWaalsContact C-CD1 3.4Å; E63-Y97 CarbonylContact O-C 3.59Å; E63-Y97 VanDerWaalsContact O-CA 3.22Å; E63-Y97 WeakPolarHBondContact O-CA 3.05Å; E63-Y97 WeakPolarHBondContact O-CB 2.97Å; L64-Y97 HydrophobicContact CB-CD1 4.09Å; L64-Y97 HydrophobicContact CB-CE1 3.87Å; L64-Y97 HydrophobicContact CD1-CD1 4.25Å; L64-Y97 HydrophobicContact CD1-CD2 4.07Å; L64-Y97 HydrophobicContact CD1-CE1 3.85Å; L64-Y97 HydrophobicContact CD1-CE2 3.63Å; L64-Y97 HydrophobicContact CD1-CG 4.34Å; L64-Y97 HydrophobicContact CG-CE1 4.48Å; L64-Y97 VanDerWaalsContact N-CD1 3.32Å; C95-Y97 VanDerWaalsContact C-CE2 3.44Å; C95-Y97 WeakPolarHBondContact O-CD2 3.37Å; C95-Y97 VanDerWaalsContact O-CE2 3.22Å; C95-Y97 WeakPolarHBondContact O-CE2 3.23Å; Y97-A110 WeakPolarHBondContact O-CA 3.5Å; Y97-I111 PolarHBondContact N-O 2.92Å; Y97-I111 PolarHBondContact O-N 3.11Å; Y97-T113 HydrophobicContact CD2-CG2 3.86Å; Y97-T113 HydrophobicContact CE2-CG2 3.74Å; Y97-T113 WeakPolarHBondContact CE2-OG1 3.49Å; Y97-N236 PolarHBondContact O-ND2 3.01Å
98	H	92.3	Very high	77.9	Confident	11 Å²	11	44.2 Å²	44.2	5%	0.051	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	154.1	162.7	-69.3	169.2	0	0	0	109.3	E63 N65 A109 N236 D239 L240	E63-H98 PolarHBondContact N-O 2.9Å; E63-H98 PolarHBondContact O-N 3.04Å; E63-H98 VanDerWaalsContact O-O 3.06Å; N65-H98 PolarHBondContact ND2-CE1 2.95Å; N65-H98 PolarHBondContact ND2-NE2 3.12Å; H98-A109 CarbonylContact C-O 3.51Å; H98-A109 VanDerWaalsContact CA-O 3.3Å; H98-A109 WeakPolarHBondContact CA-O 3.23Å; H98-N236 PolarHBondContact CD2-OD1 3.16Å; H98-N236 PolarHBondContact NE2-O 2.81Å; H98-N236 PolarHBondContact NE2-OD1 3.49Å; H98-D239 IonicContact CE1-OD2 2.63Å; H98-D239 PolarHBondContact CE1-OD2 3.26Å; H98-D239 VanDerWaalsContact CE1-OD2 3.31Å; H98-L240 HydrophobicContact CB-CD1 4.28Å
99	G	90.5	Very high	80.1	Confident	16 Å²	16	42 Å²	42	17%	0.165	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.5	-168.1	-178.3	0	0	0	0	0	114.1	D61 W108 A109	D61-G99 CarbonylContact O-C 3.55Å; D61-G99 WeakPolarHBondContact O-CA 3.45Å; G99-W108 CarbonylContact O-C 3.54Å; G99-W108 WeakPolarHBondContact O-CA 3.15Å; G99-A109 PolarHBondContact N-O 2.84Å; G99-A109 PolarHBondContact O-N 3.27Å
100	R	91.4	Very high	82.6	Confident	127 Å²	127	34.7 Å²	34.7	48%	0.479	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	163.2	178.7	-61.3	-167.9	174.6	-175.4	-4	110.5	D61 S107 E244	D61-R100 PolarHBondContact N-O 3.4Å; D61-R100 PolarHBondContact O-N 2.98Å; R100-S107 WeakPolarHBondContact CG-O 3.43Å; R100-E244 IonicContact NH2-OE2 2.9Å
101	I	92.9	Very high	84.6	Confident	7 Å²	7	34 Å²	34	4%	0.036	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	125.6	169.6	-50.4	-178.9	0	0	0	108.2	F58 T59 L60 G103 L104 S107 F121 S122 D123	F58-I101 HydrophobicContact CD1-CD1 3.96Å; T59-I101 CarbonylContact O-C 3.51Å; T59-I101 VanDerWaalsContact O-CA 3.31Å; T59-I101 WeakPolarHBondContact O-CA 3.5Å; L60-I101 HydrophobicContact CD2-CG1 3.88Å; I101-G103 PolarHBondContact O-N 2.98Å; I101-L104 HydrophobicContact CB-CB 4.38Å; I101-L104 HydrophobicContact CB-CD1 4.26Å; I101-L104 HydrophobicContact CG2-CD1 3.93Å; I101-L104 PolarHBondContact O-N 2.98Å; I101-L104 VanDerWaalsContact O-N 3.13Å; I101-S107 WeakPolarHBondContact CA-OG 3.35Å; I101-S107 PolarHBondContact N-OG 2.92Å; I101-S107 PolarHBondContact O-OG 3.33Å; I101-F121 HydrophobicContact CD1-CD2 3.9Å; I101-S122 WeakPolarHBondContact CD1-O 3.43Å; I101-D123 HydrophobicContact CD1-CB 3.87Å
102	R	89.3	Confident	86.3	Confident	97 Å²	97	34.1 Å²	34.1	37%	0.366	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	132.2	-177.9	-168.1	176.9	-68.9	175.9	-3.3	111.2	E21 T59 D61 L104	E21-R102 IonicContact OE1-CZ 3.78Å; E21-R102 IonicContact OE1-NH1 2.79Å; E21-R102 PolarHBondContact OE1-NH1 2.01Å; E21-R102 IonicContact OE1-NH2 3.82Å; E21-R102 PolarHBondContact OE1-NH2 2.8Å; E21-R102 IonicContact OE2-CZ 2.72Å; E21-R102 IonicContact OE2-NH1 2.77Å; E21-R102 PolarHBondContact OE2-NH1 3.47Å; E21-R102 IonicContact OE2-NH2 3.83Å; T59-R102 HydrophobicContact CG2-CB 3.99Å; T59-R102 PolarHBondContact O-N 3.31Å; D61-R102 IonicContact OD1-CZ 3.9Å; D61-R102 IonicContact OD1-NE 2.79Å; D61-R102 PolarHBondContact OD1-NE 3.1Å; D61-R102 IonicContact OD1-NH2 3.22Å; D61-R102 PolarHBondContact OD1-NH2 3.35Å; D61-R102 VanDerWaalsContact OD2-CB 3.3Å; D61-R102 WeakPolarHBondContact OD2-CB 3.25Å; D61-R102 WeakPolarHBondContact OD2-CG 3.01Å; D61-R102 IonicContact OD2-CZ 3.78Å; D61-R102 IonicContact OD2-NE 2.79Å; D61-R102 PolarHBondContact OD2-NE 3.29Å; D61-R102 IonicContact OD2-NH2 3.41Å; R102-L104 PolarHBondContact O-N 3.2Å
103	G	85.4	Confident	87.4	Confident	74 Å²	74	33.4 Å²	33.4	76%	0.763	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.1	-2.8	178.3	0	0	0	0	0	115.5	I101 P105	I101-G103 PolarHBondContact O-N 2.98Å; G103-P105 WeakPolarHBondContact O-CD 3.41Å
104	L	87.4	Confident	87.8	Confident	78 Å²	78	31.3 Å²	31.3	41%	0.408	19%	0.187	S	C	.	.			trans	-112.9	95.1	179.6	-69.7	176.2	0	0	0	111.4	I101 R102 G106 S107 D123	I101-L104 HydrophobicContact CB-CB 4.38Å; I101-L104 HydrophobicContact CB-CD1 4.26Å; I101-L104 HydrophobicContact CG2-CD1 3.93Å; I101-L104 PolarHBondContact O-N 2.98Å; I101-L104 VanDerWaalsContact O-N 3.13Å; R102-L104 PolarHBondContact O-N 3.2Å; L104-G106 PolarHBondContact O-N 3.02Å; L104-S107 WeakPolarHBondContact O-CB 2.99Å; L104-S107 PolarHBondContact O-N 2.93Å; L104-S107 PolarHBondContact O-OG 2.89Å; L104-D123 HydrophobicContact CD1-CB 4.17Å
105	P	78	Confident	88	Confident	120 Å²	120	35.8 Å²	35.8	78%	0.779	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	127	175.9	28	-32.8	0	0	0	110.2	G103	G103-P105 WeakPolarHBondContact O-CD 3.41Å
106	G	77.1	Confident	87.9	Confident	50 Å²	50	36.6 Å²	36.6	52%	0.515	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	100.2	-9.2	-176.2	0	0	0	0	0	114.6	L104 S124	L104-G106 PolarHBondContact O-N 3.02Å; G106-S124 PolarHBondContact O-OG 2.76Å
107	S	88.9	Confident	87.9	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.014	21%	0.211	C	C	.	.			trans	-70.7	159.8	168.2	66.7	0	0	0	0	111.8	R100 I101 L104 S122	R100-S107 WeakPolarHBondContact CG-O 3.43Å; I101-S107 WeakPolarHBondContact CA-OG 3.35Å; I101-S107 PolarHBondContact N-OG 2.92Å; I101-S107 PolarHBondContact O-OG 3.33Å; L104-S107 WeakPolarHBondContact O-CB 2.99Å; L104-S107 PolarHBondContact O-N 2.93Å; L104-S107 PolarHBondContact O-OG 2.89Å; S107-S122 WeakPolarHBondContact CA-O 3.36Å; S107-S122 WeakPolarHBondContact CB-O 3.39Å
108	W	90.2	Very high	87.9	Confident	53 Å²	53	38.6 Å²	38.6	20%	0.201	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	157.4	177.1	60.9	-97.1	0	0	0	111.2	G99 M120 F121 S122 M237 L240	G99-W108 CarbonylContact O-C 3.54Å; G99-W108 WeakPolarHBondContact O-CA 3.15Å; W108-M120 HydrophobicContact CH2-CB 4.14Å; W108-M120 HydrophobicContact CZ3-CB 4.05Å; W108-F121 CarbonylContact O-C 2.95Å; W108-F121 VanDerWaalsContact O-CA 3.26Å; W108-F121 WeakPolarHBondContact O-CA 3.05Å; W108-S122 VanDerWaalsContact CE2-CB 3.4Å; W108-S122 PolarHBondContact N-O 3.27Å; W108-S122 VanDerWaalsContact N-O 3.14Å; W108-S122 PolarHBondContact O-N 2.89Å; W108-M237 HydrophobicContact CH2-CE 4.14Å; W108-L240 HydrophobicContact CB-CD2 4.23Å; W108-L240 HydrophobicContact CD2-CD2 4.24Å; W108-L240 HydrophobicContact CE3-CD2 3.67Å; W108-L240 HydrophobicContact CG-CD2 4.5Å; W108-L240 HydrophobicContact CZ3-CD2 4.45Å
109	A	92.4	Very high	87.7	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	139.4	175.5	0	0	0	0	0	110.5	L62 H98 G99 I111 M120 F121	L62-A109 HydrophobicContact CD2-CB 3.7Å; H98-A109 CarbonylContact C-O 3.51Å; H98-A109 VanDerWaalsContact CA-O 3.3Å; H98-A109 WeakPolarHBondContact CA-O 3.23Å; G99-A109 PolarHBondContact N-O 2.84Å; G99-A109 PolarHBondContact O-N 3.27Å; A109-I111 HydrophobicContact CB-CG1 4.29Å; A109-M120 WeakPolarHBondContact CA-O 3.08Å; A109-F121 HydrophobicContact CB-CB 3.77Å
110	A	92.8	Very high	87.5	Confident	5 Å²	5	37.8 Å²	37.8	4%	0.041	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	104.8	170.4	0	0	0	0	0	108.1	Y97 G119 M120 M237 L240	Y97-A110 WeakPolarHBondContact O-CA 3.5Å; A110-G119 WeakPolarHBondContact O-CA 3.38Å; A110-M120 PolarHBondContact N-O 2.7Å; A110-M120 PolarHBondContact O-N 3.33Å; A110-M237 HydrophobicContact CB-CB 4.22Å; A110-M237 HydrophobicContact CB-CG 4.45Å; A110-L240 HydrophobicContact CB-CD2 3.88Å
111	I	92.7	Very high	87.5	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	136.3	-166.7	-56.2	-66.4	0	0	0	110	L60 L62 Y97 A109 L117 F121 I130	L60-I111 HydrophobicContact CD1-CG1 4.47Å; L62-I111 HydrophobicContact CD1-CB 3.89Å; L62-I111 HydrophobicContact CD1-CG1 4.14Å; L62-I111 HydrophobicContact CD1-CG2 4.17Å; L62-I111 HydrophobicContact CD2-CG1 4.26Å; Y97-I111 PolarHBondContact N-O 2.92Å; Y97-I111 PolarHBondContact O-N 3.11Å; A109-I111 HydrophobicContact CB-CG1 4.29Å; I111-L117 HydrophobicContact CG2-CB 4.3Å; I111-L117 HydrophobicContact CG2-CD2 3.97Å; I111-F121 HydrophobicContact CD1-CD1 4.47Å; I111-I130 HydrophobicContact CD1-CG2 3.71Å
112	S	90.4	Very high	87.2	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.014	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	138.3	165.6	177.1	0	0	0	0	109.4	C95 C114 L117 Q118 S233	C95-S112 WeakPolarHBondContact O-CA 3.13Å; C95-S112 PolarHBondContact SG-OG 2.81Å; S112-C114 PolarHBondContact OG-N 2.76Å; S112-L117 WeakPolarHBondContact O-CA 3.07Å; S112-Q118 PolarHBondContact N-O 3.45Å; S112-Q118 PolarHBondContact O-N 2.9Å; S112-S233 WeakPolarHBondContact CB-OG 3.16Å
113	T	88.3	Confident	87	Confident	4 Å²	4	28.1 Å²	28.1	3%	0.025	18%	0.18	C	C	.	.			trans	-113.6	10	175.2	71.3	0	0	0	0	112.7	T29 F49 C95 Y97 R115 G116 L117	T29-T113 HydrophobicContact CG2-CG2 4.12Å; T29-T113 PolarHBondContact OG1-OG1 3Å; F49-T113 HydrophobicContact CE2-CG2 4.24Å; F49-T113 HydrophobicContact CZ-CG2 4.2Å; C95-T113 PolarHBondContact O-N 3.43Å; C95-T113 PolarHBondContact O-OG1 3.48Å; Y97-T113 HydrophobicContact CD2-CG2 3.86Å; Y97-T113 HydrophobicContact CE2-CG2 3.74Å; Y97-T113 WeakPolarHBondContact CE2-OG1 3.49Å; T113-R115 VanDerWaalsContact C-N 3.32Å; T113-R115 PolarHBondContact O-N 3.14Å; T113-G116 CarbonylContact C-O 3.57Å; T113-G116 WeakPolarHBondContact CA-O 3.28Å; T113-L117 HydrophobicContact CG2-CD2 3.91Å
114	C	83.1	Confident	86.6	Confident	3 Å²	3	27.4 Å²	27.4	2%	0.02	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-40.9	-174.9	-82.5	0	0	0	0	112.1	R30 C95 S112 I229	R30-C114 PolarHBondContact NH2-O 2.75Å; C95-C114 HydrophobicContact CB-CB 3.93Å; C95-C114 WeakPolarHBondContact CB-SG 2.99Å; C95-C114 WeakPolarHBondContact SG-CA 3.49Å; C95-C114 WeakPolarHBondContact SG-CB 3.09Å; C95-C114 PolarHBondContact SG-N 2.84Å; C95-C114 CovalentContact SG-SG 1.99Å; C95-C114 PolarHBondContact SG-SG 2.83Å; S112-C114 PolarHBondContact OG-N 2.76Å; C114-I229 HydrophobicContact CB-CD1 4.06Å; C114-I229 HydrophobicContact CB-CG1 4.29Å; C114-I229 HydrophobicContact CB-CG2 4.4Å
115	R	81.3	Confident	86	Confident	99 Å²	99	29 Å²	29	37%	0.374	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-139.7	63.5	-176.4	-66.9	-173.9	-179.6	-158.2	3.9	110.1	T113 P132 S225 I229	T113-R115 VanDerWaalsContact C-N 3.32Å; T113-R115 PolarHBondContact O-N 3.14Å; R115-P132 WeakPolarHBondContact O-CG 3.42Å; R115-S225 PolarHBondContact NH2-OG 2.98Å; R115-I229 HydrophobicContact CG-CD1 3.99Å
116	G	84.5	Confident	86	Confident	17 Å²	17	24.6 Å²	24.6	18%	0.175	14%	0.141	C	C	.	.	S	Bend	trans	80.1	-177.9	-167.5	0	0	0	0	0	111.8	T113 Q118	T113-G116 CarbonylContact C-O 3.57Å; T113-G116 WeakPolarHBondContact CA-O 3.28Å; G116-Q118 PolarHBondContact O-N 2.91Å
117	L	88.6	Confident	86.1	Confident	1 Å²	1	22.4 Å²	22.4	1%	0.005	12%	0.117	C	C	.	.			trans	-81	116	179.1	-59.5	-177.7	0	0	0	109.5	P9 L27 F49 I111 S112 T113 I130 H150	P9-L117 HydrophobicContact CB-CD1 3.63Å; P9-L117 HydrophobicContact CG-CD1 4Å; L27-L117 HydrophobicContact CD1-CG 4.3Å; L27-L117 HydrophobicContact CD2-CD1 4.39Å; F49-L117 HydrophobicContact CB-CD1 4.2Å; F49-L117 HydrophobicContact CD1-CD1 4.04Å; F49-L117 HydrophobicContact CD1-CD2 4.1Å; F49-L117 HydrophobicContact CD2-CD2 4.28Å; F49-L117 HydrophobicContact CE1-CD2 3.95Å; F49-L117 HydrophobicContact CE2-CD2 4.15Å; F49-L117 HydrophobicContact CG-CD1 4.12Å; F49-L117 HydrophobicContact CG-CD2 4.24Å; F49-L117 HydrophobicContact CZ-CD2 3.97Å; I111-L117 HydrophobicContact CG2-CB 4.3Å; I111-L117 HydrophobicContact CG2-CD2 3.97Å; S112-L117 WeakPolarHBondContact O-CA 3.07Å; T113-L117 HydrophobicContact CG2-CD2 3.91Å; L117-I130 HydrophobicContact CB-CD1 3.83Å; L117-I130 HydrophobicContact CB-CG1 4.31Å; L117-I130 HydrophobicContact CD1-CD1 4.08Å; L117-H150 PolarHBondContact N-NE2 3.34Å; L117-H150 PolarHBondContact O-CD2 3.06Å
118	Q	88.3	Confident	86	Confident	44 Å²	44	22.8 Å²	22.8	21%	0.206	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	128.1	175.1	-171.5	-179.1	30.9	0	0	110.5	S112 G116 I130 E131	S112-Q118 PolarHBondContact N-O 3.45Å; S112-Q118 PolarHBondContact O-N 2.9Å; G116-Q118 PolarHBondContact O-N 2.91Å; Q118-I130 CarbonylContact C-O 3.54Å; Q118-I130 VanDerWaalsContact CA-O 3.3Å; Q118-I130 WeakPolarHBondContact CA-O 2.86Å; Q118-E131 HydrophobicContact CG-CB 4.49Å
119	G	87.6	Confident	85.8	Confident	6 Å²	6	20.2 Å²	20.2	6%	0.062	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151	-147.8	175.9	0	0	0	0	0	112.2	A110 I130	A110-G119 WeakPolarHBondContact O-CA 3.38Å; G119-I130 PolarHBondContact N-O 2.83Å; G119-I130 PolarHBondContact O-N 2.99Å
120	M	88.1	Confident	85.6	Confident	4 Å²	4	20.4 Å²	20.4	2%	0.02	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	149.9	-176.5	-67.3	-173.5	70.4	0	0	112.9	W108 A109 A110 Y128 M155 M237 G329 L375	W108-M120 HydrophobicContact CH2-CB 4.14Å; W108-M120 HydrophobicContact CZ3-CB 4.05Å; A109-M120 WeakPolarHBondContact CA-O 3.08Å; A110-M120 PolarHBondContact N-O 2.7Å; A110-M120 PolarHBondContact O-N 3.33Å; M120-Y128 VanDerWaalsContact CA-O 3.27Å; M120-Y128 WeakPolarHBondContact CA-O 3.22Å; M120-M155 HydrophobicContact CE-CG 3.76Å; M120-M155 HydrophobicContact CE-SD 4.14Å; M120-M237 HydrophobicContact CB-CE 4.43Å; M120-M237 HydrophobicContact CB-SD 4.18Å; M120-M237 HydrophobicContact CE-CE 4.22Å; M120-M237 HydrophobicContact CG-CE 4.45Å; M120-M237 HydrophobicContact CG-SD 4.09Å; M120-M237 HydrophobicContact SD-CE 3.39Å; M120-M237 WeakPolarHBondContact SD-CE 3.48Å; M120-M237 HydrophobicContact SD-SD 3.53Å; M120-G329 WeakPolarHBondContact SD-CA 2.95Å; M120-L375 HydrophobicContact CE-CD1 4.07Å; M120-L375 HydrophobicContact SD-CD1 4.48Å
121	F	90.4	Very high	85.3	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	160.3	170.6	63.3	-84.8	0	0	0	111	V51 F58 L60 I101 W108 A109 I111 S127 Y128 I130 V152	V51-F121 HydrophobicContact CG1-CZ 4.43Å; F58-F121 HydrophobicContact CB-CE2 4.09Å; F58-F121 HydrophobicContact CD1-CE2 4.14Å; F58-F121 AromaticContact CD2-CE2 3.94Å; F58-F121 HydrophobicContact CD2-CE2 3.94Å; F58-F121 HydrophobicContact CD2-CZ 4.24Å; F58-F121 HydrophobicContact CE2-CE2 4.41Å; F58-F121 AromaticContact CG-CE2 3.78Å; F58-F121 HydrophobicContact CG-CE2 3.78Å; F58-F121 HydrophobicContact CG-CZ 4.44Å; L60-F121 HydrophobicContact CD1-CD1 4.15Å; L60-F121 HydrophobicContact CD1-CG 4.36Å; L60-F121 HydrophobicContact CD2-CB 4.07Å; L60-F121 HydrophobicContact CD2-CD1 4.45Å; L60-F121 HydrophobicContact CD2-CD2 3.88Å; L60-F121 HydrophobicContact CD2-CE2 4.43Å; L60-F121 HydrophobicContact CD2-CG 3.89Å; I101-F121 HydrophobicContact CD1-CD2 3.9Å; W108-F121 CarbonylContact O-C 2.95Å; W108-F121 VanDerWaalsContact O-CA 3.26Å; W108-F121 WeakPolarHBondContact O-CA 3.05Å; A109-F121 HydrophobicContact CB-CB 3.77Å; I111-F121 HydrophobicContact CD1-CD1 4.47Å; F121-S127 WeakPolarHBondContact O-CA 3.29Å; F121-Y128 AromaticContact CD2-CD2 3.84Å; F121-Y128 HydrophobicContact CD2-CD2 3.84Å; F121-Y128 HydrophobicContact CD2-CG 4.33Å; F121-Y128 AromaticContact CE2-CD2 3.52Å; F121-Y128 HydrophobicContact CE2-CD2 3.52Å; F121-Y128 HydrophobicContact CE2-CE2 4.36Å; F121-Y128 AromaticContact CE2-CG 3.74Å; F121-Y128 HydrophobicContact CE2-CG 3.74Å; F121-Y128 VanDerWaalsContact CZ-CB 3.44Å; F121-Y128 HydrophobicContact CZ-CD2 4.17Å; F121-Y128 AromaticContact CZ-CG 3.89Å; F121-Y128 HydrophobicContact CZ-CG 3.89Å; F121-Y128 PolarHBondContact N-O 2.89Å; F121-Y128 PolarHBondContact O-N 2.01Å; F121-I130 HydrophobicContact CD1-CG2 4.45Å; F121-I130 HydrophobicContact CE1-CB 4.36Å; F121-I130 HydrophobicContact CE1-CG2 4.41Å; F121-V152 HydrophobicContact CZ-CG1 4.39Å
122	S	86.3	Confident	85	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	136.4	-179.7	-174.8	0	0	0	0	111.5	I101 S107 W108 S124 F126 R377	I101-S122 WeakPolarHBondContact CD1-O 3.43Å; S107-S122 WeakPolarHBondContact CA-O 3.36Å; S107-S122 WeakPolarHBondContact CB-O 3.39Å; W108-S122 VanDerWaalsContact CE2-CB 3.4Å; W108-S122 PolarHBondContact N-O 3.27Å; W108-S122 VanDerWaalsContact N-O 3.14Å; W108-S122 PolarHBondContact O-N 2.89Å; S122-S124 PolarHBondContact O-N 2.72Å; S122-S124 PolarHBondContact OG-N 2.69Å; S122-F126 VanDerWaalsContact CA-O 3.23Å; S122-F126 WeakPolarHBondContact CA-O 3.46Å; S122-F126 WeakPolarHBondContact CB-O 3.41Å; S122-F126 PolarHBondContact OG-O 3.23Å; S122-R377 PolarHBondContact OG-NH1 3.41Å
123	D	84.9	Confident	84.6	Confident	27 Å²	27	26.3 Å²	26.3	14%	0.144	14%	0.141	C	C	.	.			trans	-88.1	13.4	173.4	72.3	-13.2	0	0	0	112.8	F58 I101 L104 N125 F126 Y128	F58-D123 HydrophobicContact CE1-CB 4.33Å; I101-D123 HydrophobicContact CD1-CB 3.87Å; L104-D123 HydrophobicContact CD1-CB 4.17Å; D123-N125 VanDerWaalsContact C-N 3.28Å; D123-N125 PolarHBondContact O-N 3.02Å; D123-N125 WeakPolarHBondContact OD1-CA 3.21Å; D123-N125 PolarHBondContact OD1-N 2.95Å; D123-F126 PolarHBondContact N-O 3.34Å; D123-F126 PolarHBondContact OD1-N 3.21Å; D123-Y128 HydrophobicContact CB-CE2 4.39Å
124	S	77.5	Confident	83.4	Confident	59 Å²	59	28.1 Å²	28.1	41%	0.413	16%	0.161	S	C	.	.	S	Bend	trans	82.9	-29.9	-169.7	-39.2	0	0	0	0	115.1	G106 S122	G106-S124 PolarHBondContact O-OG 2.76Å; S122-S124 PolarHBondContact O-N 2.72Å; S122-S124 PolarHBondContact OG-N 2.69Å
125	N	74.7	Confident	81.6	Confident	111 Å²	111	32.8 Å²	32.8	59%	0.594	19%	0.186	S	C	*	.	S	Bend	trans	-90.8	-57.3	178.6	-66.3	-31	0	0	0	109.6	D123 R377	D123-N125 VanDerWaalsContact C-N 3.28Å; D123-N125 PolarHBondContact O-N 3.02Å; D123-N125 WeakPolarHBondContact OD1-CA 3.21Å; D123-N125 PolarHBondContact OD1-N 2.95Å; N125-R377 PolarHBondContact O-NH1 3.36Å; N125-R377 PolarHBondContact O-NH2 3.31Å
126	F	77.2	Confident	79.7	Confident	29 Å²	29	31.9 Å²	31.9	13%	0.127	21%	0.207	C	C	.	.			trans	-112.2	156.7	-176.3	-57.6	-76.6	0	0	0	111.2	S122 D123 Y128 R154 D157	S122-F126 VanDerWaalsContact CA-O 3.23Å; S122-F126 WeakPolarHBondContact CA-O 3.46Å; S122-F126 WeakPolarHBondContact CB-O 3.41Å; S122-F126 PolarHBondContact OG-O 3.23Å; D123-F126 PolarHBondContact N-O 3.34Å; D123-F126 PolarHBondContact OD1-N 3.21Å; F126-Y128 HydrophobicContact CB-CE1 4.31Å; F126-Y128 HydrophobicContact CB-CE2 3.81Å; F126-R154 HydrophobicContact CB-CG 4.34Å; F126-R154 VanDerWaalsContact CD1-NH2 3.26Å; F126-D157 HydrophobicContact CD1-CB 4.15Å; F126-D157 HydrophobicContact CE1-CB 4.21Å
127	S	80.8	Confident	77.5	Confident	4 Å²	4	36.9 Å²	36.9	3%	0.028	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	138.9	169.6	-78.3	0	0	0	0	108.6	F121 M155 R377	F121-S127 WeakPolarHBondContact O-CA 3.29Å; S127-M155 WeakPolarHBondContact O-CB 3.39Å; S127-M155 PolarHBondContact O-N 3.42Å; S127-R377 PolarHBondContact OG-NE 2.91Å; S127-R377 PolarHBondContact OG-NH1 2.86Å; S127-R377 PolarHBondContact OG-NH2 3.26Å
128	Y	85.7	Confident	75	Confident	9 Å²	9	41.9 Å²	41.9	4%	0.035	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	129.4	-176.4	-56.4	-83.7	0	0	0	107.9	F54 F58 M120 F121 D123 F126 V152 Y153 R154	F54-Y128 HydrophobicContact CD2-CD1 4.05Å; F54-Y128 AromaticContact CD2-CE1 3.73Å; F54-Y128 HydrophobicContact CD2-CE1 3.73Å; F54-Y128 AromaticContact CE2-CD1 3.8Å; F54-Y128 HydrophobicContact CE2-CD1 3.8Å; F54-Y128 AromaticContact CE2-CE1 3.91Å; F54-Y128 HydrophobicContact CE2-CE1 3.91Å; F58-Y128 HydrophobicContact CE1-CE2 4.08Å; F58-Y128 HydrophobicContact CZ-CE1 4.22Å; F58-Y128 AromaticContact CZ-CE2 3.93Å; F58-Y128 HydrophobicContact CZ-CE2 3.93Å; F58-Y128 AromaticContact CZ-CZ 3.69Å; M120-Y128 VanDerWaalsContact CA-O 3.27Å; M120-Y128 WeakPolarHBondContact CA-O 3.22Å; F121-Y128 AromaticContact CD2-CD2 3.84Å; F121-Y128 HydrophobicContact CD2-CD2 3.84Å; F121-Y128 HydrophobicContact CD2-CG 4.33Å; F121-Y128 AromaticContact CE2-CD2 3.52Å; F121-Y128 HydrophobicContact CE2-CD2 3.52Å; F121-Y128 HydrophobicContact CE2-CE2 4.36Å; F121-Y128 AromaticContact CE2-CG 3.74Å; F121-Y128 HydrophobicContact CE2-CG 3.74Å; F121-Y128 VanDerWaalsContact CZ-CB 3.44Å; F121-Y128 HydrophobicContact CZ-CD2 4.17Å; F121-Y128 AromaticContact CZ-CG 3.89Å; F121-Y128 HydrophobicContact CZ-CG 3.89Å; F121-Y128 PolarHBondContact N-O 2.89Å; F121-Y128 PolarHBondContact O-N 2.01Å; D123-Y128 HydrophobicContact CB-CE2 4.39Å; F126-Y128 HydrophobicContact CB-CE1 4.31Å; F126-Y128 HydrophobicContact CB-CE2 3.81Å; Y128-V152 HydrophobicContact CD1-CG1 4.48Å; Y128-Y153 WeakPolarHBondContact CA-O 3.2Å; Y128-R154 HydrophobicContact CD1-CB 4.47Å; Y128-R154 HydrophobicContact CD1-CG 4.28Å; Y128-R154 HydrophobicContact CE1-CB 4.48Å; Y128-R154 HydrophobicContact CE1-CG 4Å
129	G	86.3	Confident	72.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	141.6	164.1	0	0	0	0	0	109.2	V152 Y153	G129-V152 VanDerWaalsContact O-CA 3.3Å; G129-V152 WeakPolarHBondContact O-CA 3.47Å; G129-Y153 PolarHBondContact N-O 3.11Å; G129-Y153 PolarHBondContact O-N 2.82Å
130	I	88.3	Confident	70.1	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.015	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	133.2	169.8	-174	168.7	0	0	0	108.8	P9 V51 I111 L117 Q118 G119 F121 H150 I151 V152	P9-I130 HydrophobicContact CG-CD1 4.03Å; V51-I130 HydrophobicContact CG1-CD1 4.39Å; V51-I130 HydrophobicContact CG2-CD1 4.22Å; I111-I130 HydrophobicContact CD1-CG2 3.71Å; L117-I130 HydrophobicContact CB-CD1 3.83Å; L117-I130 HydrophobicContact CB-CG1 4.31Å; L117-I130 HydrophobicContact CD1-CD1 4.08Å; Q118-I130 CarbonylContact C-O 3.54Å; Q118-I130 VanDerWaalsContact CA-O 3.3Å; Q118-I130 WeakPolarHBondContact CA-O 2.86Å; G119-I130 PolarHBondContact N-O 2.83Å; G119-I130 PolarHBondContact O-N 2.99Å; F121-I130 HydrophobicContact CD1-CG2 4.45Å; F121-I130 HydrophobicContact CE1-CB 4.36Å; F121-I130 HydrophobicContact CE1-CG2 4.41Å; I130-H150 HydrophobicContact CD1-CB 4.3Å; I130-H150 HydrophobicContact CG1-CB 4.09Å; I130-I151 WeakPolarHBondContact CA-O 3.32Å; I130-V152 HydrophobicContact CB-CG2 4.14Å; I130-V152 HydrophobicContact CD1-CG2 3.94Å; I130-V152 HydrophobicContact CG1-CG2 3.83Å
131	E	86.5	Confident	67.5	Low	68 Å²	68	51.2 Å²	51.2	32%	0.318	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	149.2	175.3	61.2	-175.9	-164.2	0	0	111.8	Q118 H150 I151 Y153	Q118-E131 HydrophobicContact CG-CB 4.49Å; E131-H150 CarbonylContact O-C 3.44Å; E131-H150 VanDerWaalsContact O-CA 3.26Å; E131-H150 WeakPolarHBondContact O-CA 3.08Å; E131-H150 WeakPolarHBondContact O-CB 3.17Å; E131-I151 HydrophobicContact CG-CB 4.38Å; E131-I151 PolarHBondContact N-O 2.97Å; E131-I151 PolarHBondContact O-N 3.04Å; E131-Y153 HydrophobicContact CG-CE1 4.2Å
132	P	86.3	Confident	65	Low	28 Å²	28	56.8 Å²	56.8	18%	0.182	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	143.6	178.4	30.1	-36.5	0	0	0	111.6	R115 G134 Q147	R115-P132 WeakPolarHBondContact O-CG 3.42Å; P132-G134 PolarHBondContact O-N 2.87Å; P132-Q147 HydrophobicContact CB-CB 4.18Å; P132-Q147 HydrophobicContact CB-CG 4.32Å
133	V	81.6	Confident	62.7	Low	36 Å²	36	62.9 Å²	62.9	22%	0.218	40%	0.404	C	S	.	.			trans	-70	117.6	174.4	178.9	0	0	0	0	109.8	N135 Q147 D149 I151	V133-N135 PolarHBondContact O-N 2.87Å; V133-Q147 PolarHBondContact O-NE2 2.01Å; V133-D149 HydrophobicContact CB-CB 4.26Å; V133-D149 HydrophobicContact CG2-CB 3.92Å; V133-D149 PolarHBondContact N-O 3.25Å; V133-I151 HydrophobicContact CG2-CD1 4.19Å; V133-I151 HydrophobicContact CG2-CG1 3.77Å
134	G	63.8	Low	60.7	Low	43 Å²	43	65.1 Å²	65.1	44%	0.443	41%	0.413	S	S	.	.			trans	-77.9	85.9	178.8	0	0	0	0	0	112.6	P132 G136	P132-G134 PolarHBondContact O-N 2.87Å; G134-G136 PolarHBondContact O-N 2.94Å
135	N	45.1	Very low	59.2	Low	101 Å²	101	67.6 Å²	67.6	54%	0.54	42%	0.421	S	S	.	.			trans	-63.8	124	167.4	-67.4	-12.4	0	0	0	108.7	V133 E137	V133-N135 PolarHBondContact O-N 2.87Å; N135-E137 PolarHBondContact O-N 2.04Å
136	G	41.1	Very low	58.1	Low	79 Å²	79	67.4 Å²	67.4	81%	0.814	42%	0.416	S	S	*	.			trans	-66.9	34.2	-175.4	0	0	0	0	0	115.8	G134	G134-G136 PolarHBondContact O-N 2.94Å
137	E	37.4	Very low	57.3	Low	123 Å²	123	68.4 Å²	68.4	58%	0.575	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-76.7	150	174.9	-72.1	-164.8	162.8	0	0	111.3	N135 F144	N135-E137 PolarHBondContact O-N 2.04Å; E137-F144 HydrophobicContact CB-CE1 4.37Å; E137-F144 HydrophobicContact CB-CE2 3.99Å; E137-F144 HydrophobicContact CB-CZ 3.47Å; E137-F144 VanDerWaalsContact CB-CZ 3.47Å; E137-F144 VanDerWaalsContact O-CZ 3.3Å; E137-F144 WeakPolarHBondContact O-CZ 3.35Å
138	P	37	Very low	56.6	Low	105 Å²	105	73.2 Å²	73.2	68%	0.682	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-73.4	139.2	179.2	-9.9	26.2	0	0	0	111.7	G140 F144	P138-G140 PolarHBondContact O-N 3.22Å; P138-F144 WeakPolarHBondContact O-CE2 3.39Å; P138-F144 WeakPolarHBondContact O-CZ 3.3Å
139	C	35.5	Very low	56.6	Low	108 Å²	108	75.7 Å²	75.7	73%	0.73	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	121	174.5	-73.8	0	0	0	0	111.5
140	G	38.3	Very low	56.7	Low	75 Å²	75	75.7 Å²	75.7	77%	0.773	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	143.2	-4.7	171.1	0	0	0	0	0	117.1	P138	P138-G140 PolarHBondContact O-N 3.22Å
141	T	33.7	Very low	56.7	Low	68 Å²	68	77.3 Å²	77.3	42%	0.417	46%	0.464	S	S	.	.			trans	-87.6	144.3	175.4	56.6	0	0	0	0	111.7	N143 F144	T141-N143 PolarHBondContact O-N 3.32Å; T141-F144 PolarHBondContact O-N 3.08Å; T141-F144 WeakPolarHBondContact OG1-CD2 3.36Å; T141-F144 WeakPolarHBondContact OG1-CE2 3.4Å
142	P	36.5	Very low	56.8	Low	116 Å²	116	74.1 Å²	74.1	75%	0.753	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-11.9	-176.9	-19.5	31.3	0	0	0	115
143	N	39.1	Very low	56.7	Low	129 Å²	129	74.5 Å²	74.5	69%	0.69	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	7.1	-174.4	-70.1	-5.3	0	0	0	114.3	T141 L145 E146	T141-N143 PolarHBondContact O-N 3.32Å; N143-L145 PolarHBondContact O-N 2.72Å; N143-L145 VanDerWaalsContact O-N 3.09Å; N143-E146 PolarHBondContact O-N 3.05Å
144	F	43.4	Very low	56.7	Low	73 Å²	73	75.9 Å²	75.9	32%	0.32	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-8.4	175.3	-98.7	-86.1	0	0	0	115	E137 P138 T141 E146	E137-F144 HydrophobicContact CB-CE1 4.37Å; E137-F144 HydrophobicContact CB-CE2 3.99Å; E137-F144 HydrophobicContact CB-CZ 3.47Å; E137-F144 VanDerWaalsContact CB-CZ 3.47Å; E137-F144 VanDerWaalsContact O-CZ 3.3Å; E137-F144 WeakPolarHBondContact O-CZ 3.35Å; P138-F144 WeakPolarHBondContact O-CE2 3.39Å; P138-F144 WeakPolarHBondContact O-CZ 3.3Å; T141-F144 PolarHBondContact O-N 3.08Å; T141-F144 WeakPolarHBondContact OG1-CD2 3.36Å; T141-F144 WeakPolarHBondContact OG1-CE2 3.4Å; F144-E146 VanDerWaalsContact C-N 3.29Å; F144-E146 PolarHBondContact O-N 3.19Å
145	L	44.1	Very low	56.9	Low	112 Å²	112	75.1 Å²	75.1	59%	0.586	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-2.8	-177.7	-74.1	155.8	0	0	0	113.8	N143	N143-L145 PolarHBondContact O-N 2.72Å; N143-L145 VanDerWaalsContact O-N 3.09Å
146	E	52.8	Low	57.4	Low	106 Å²	106	72.3 Å²	72.3	50%	0.495	42%	0.421	S	S	.	.			trans	-114.5	53.2	-176.4	-64.9	-166.4	-170.2	0	0	113.5	N143 F144 K148	N143-E146 PolarHBondContact O-N 3.05Å; F144-E146 VanDerWaalsContact C-N 3.29Å; F144-E146 PolarHBondContact O-N 3.19Å; E146-K148 VanDerWaalsContact C-N 3.32Å; E146-K148 PolarHBondContact O-N 3.38Å; E146-K148 WeakPolarHBondContact OE2-CE 3.32Å; E146-K148 IonicContact OE2-NZ 2.95Å; E146-K148 PolarHBondContact OE2-NZ 3.13Å
147	Q	60.5	Low	57.5	Low	51 Å²	51	70.4 Å²	70.4	24%	0.238	39%	0.392	C	S	.	.			trans	-70.4	92.5	164.4	-95.2	161.6	-9.2	0	0	109.1	P132 V133 H150	P132-Q147 HydrophobicContact CB-CB 4.18Å; P132-Q147 HydrophobicContact CB-CG 4.32Å; V133-Q147 PolarHBondContact O-NE2 2.01Å; Q147-H150 PolarHBondContact O-CE1 2.81Å
148	K	65.7	Low	57.5	Low	105 Å²	105	69.1 Å²	69.1	46%	0.457	39%	0.388	S	S	.	.			trans	-78.3	-37.3	178.2	-68.3	176	-176	157.9	0	111.4	E146 H150	E146-K148 VanDerWaalsContact C-N 3.32Å; E146-K148 PolarHBondContact O-N 3.38Å; E146-K148 WeakPolarHBondContact OE2-CE 3.32Å; E146-K148 IonicContact OE2-NZ 2.95Å; E146-K148 PolarHBondContact OE2-NZ 3.13Å; K148-H150 PolarHBondContact O-ND1 3.02Å; K148-H150 VanDerWaalsContact O-ND1 3.15Å
149	D	84.6	Confident	57.1	Low	60 Å²	60	68.5 Å²	68.5	32%	0.321	38%	0.379	S	S	.	.			trans	-91	133.2	-174.8	-57.8	-24.2	0	0	0	111	V6 Q8 V133	V6-D149 HydrophobicContact CG1-CB 4.17Å; Q8-D149 VanDerWaalsContact CG-OD1 3.25Å; Q8-D149 WeakPolarHBondContact CG-OD1 3.42Å; Q8-D149 PolarHBondContact NE2-OD1 3.4Å; V133-D149 HydrophobicContact CB-CB 4.26Å; V133-D149 HydrophobicContact CG2-CB 3.92Å; V133-D149 PolarHBondContact N-O 3.25Å
150	H	89.1	Confident	57.1	Low	0 Å²	0	70.9 Å²	70.9	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	149.8	178.3	-64	66	0	0	0	109	V6 V7 P9 L27 L117 I130 E131 Q147 K148	V6-H150 CarbonylContact C-O 3.53Å; V6-H150 VanDerWaalsContact CA-O 3.32Å; V6-H150 WeakPolarHBondContact CA-O 3.43Å; V7-H150 HydrophobicContact CG2-CB 4.02Å; V7-H150 PolarHBondContact N-O 3.16Å; V7-H150 PolarHBondContact O-N 3.49Å; P9-H150 WeakPolarHBondContact CD-ND1 3.26Å; P9-H150 HydrophobicContact CG-CB 4.05Å; L27-H150 WeakPolarHBondContact CD1-CE1 3.38Å; L117-H150 PolarHBondContact N-NE2 3.34Å; L117-H150 PolarHBondContact O-CD2 3.06Å; I130-H150 HydrophobicContact CD1-CB 4.3Å; I130-H150 HydrophobicContact CG1-CB 4.09Å; E131-H150 CarbonylContact O-C 3.44Å; E131-H150 VanDerWaalsContact O-CA 3.26Å; E131-H150 WeakPolarHBondContact O-CA 3.08Å; E131-H150 WeakPolarHBondContact O-CB 3.17Å; Q147-H150 PolarHBondContact O-CE1 2.81Å; K148-H150 PolarHBondContact O-ND1 3.02Å; K148-H150 VanDerWaalsContact O-ND1 3.15Å
151	I	89.1	Confident	56.7	Low	38 Å²	38	75.6 Å²	75.6	20%	0.195	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	123.1	167.4	-61.3	168.1	0	0	0	106.3	E4 V6 I130 E131 V133 Y153	E4-I151 HydrophobicContact CB-CG2 4.07Å; V6-I151 HydrophobicContact CG2-CG1 4.4Å; I130-I151 WeakPolarHBondContact CA-O 3.32Å; E131-I151 HydrophobicContact CG-CB 4.38Å; E131-I151 PolarHBondContact N-O 2.97Å; E131-I151 PolarHBondContact O-N 3.04Å; V133-I151 HydrophobicContact CG2-CD1 4.19Å; V133-I151 HydrophobicContact CG2-CG1 3.77Å; I151-Y153 HydrophobicContact CG2-CD1 4.26Å
152	V	88.4	Confident	56.6	Low	0 Å²	0	77.5 Å²	77.5	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.9	166.4	178	0	0	0	0	107.3	E4 E5 V7 V51 A53 F54 F121 Y128 G129 I130	E4-V152 CarbonylContact C-O 3.59Å; E4-V152 WeakPolarHBondContact CA-O 3.49Å; E5-V152 PolarHBondContact N-O 3.32Å; E5-V152 PolarHBondContact O-N 3.31Å; V7-V152 HydrophobicContact CG1-CB 4.37Å; V7-V152 HydrophobicContact CG1-CG2 4.29Å; V7-V152 HydrophobicContact CG2-CB 4.31Å; V7-V152 HydrophobicContact CG2-CG2 3.44Å; V7-V152 VanDerWaalsContact CG2-CG2 3.44Å; V51-V152 HydrophobicContact CG1-CG2 3.86Å; A53-V152 HydrophobicContact CB-CB 4.1Å; A53-V152 HydrophobicContact CB-CG1 3.89Å; F54-V152 HydrophobicContact CE2-CG1 3.9Å; F121-V152 HydrophobicContact CZ-CG1 4.39Å; Y128-V152 HydrophobicContact CD1-CG1 4.48Å; G129-V152 VanDerWaalsContact O-CA 3.3Å; G129-V152 WeakPolarHBondContact O-CA 3.47Å; I130-V152 HydrophobicContact CB-CG2 4.14Å; I130-V152 HydrophobicContact CD1-CG2 3.94Å; I130-V152 HydrophobicContact CG1-CG2 3.83Å
153	Y	84.7	Confident	56.2	Low	36 Å²	36	79.7 Å²	79.7	14%	0.141	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	138.2	177.1	56.7	-88.7	0	0	0	110.1	A3 Y128 G129 E131 I151 M155	A3-Y153 CarbonylContact O-C 3.53Å; A3-Y153 VanDerWaalsContact O-CA 3.23Å; A3-Y153 WeakPolarHBondContact O-CA 3.2Å; A3-Y153 WeakPolarHBondContact O-CB 3.39Å; Y128-Y153 WeakPolarHBondContact CA-O 3.2Å; G129-Y153 PolarHBondContact N-O 3.11Å; G129-Y153 PolarHBondContact O-N 2.82Å; E131-Y153 HydrophobicContact CG-CE1 4.2Å; I151-Y153 HydrophobicContact CG2-CD1 4.26Å; Y153-M155 HydrophobicContact CD2-SD 4.02Å; Y153-M155 HydrophobicContact CE2-SD 3.54Å; Y153-M155 VanDerWaalsContact CE2-SD 3.54Å; Y153-M155 PolarHBondContact O-N 3.27Å
154	R	79.9	Confident	55.8	Low	65 Å²	65	79 Å²	79	25%	0.245	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	122.9	169.4	-157.7	-169.2	-153.6	174.4	13.9	106.1	A3 F54 F126 Y128	A3-R154 PolarHBondContact O-N 2.89Å; F54-R154 HydrophobicContact CE2-CB 4.19Å; F54-R154 HydrophobicContact CZ-CB 4.07Å; F126-R154 HydrophobicContact CB-CG 4.34Å; F126-R154 VanDerWaalsContact CD1-NH2 3.26Å; Y128-R154 HydrophobicContact CD1-CB 4.47Å; Y128-R154 HydrophobicContact CD1-CG 4.28Å; Y128-R154 HydrophobicContact CE1-CB 4.48Å; Y128-R154 HydrophobicContact CE1-CG 4Å
155	M	69	Low	55	Low	27 Å²	27	80.6 Å²	80.6	13%	0.133	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-55.4	133.9	164.3	-63.1	-60.2	-53.9	0	0	106.6	M120 S127 Y153 D157 L375	M120-M155 HydrophobicContact CE-CG 3.76Å; M120-M155 HydrophobicContact CE-SD 4.14Å; S127-M155 WeakPolarHBondContact O-CB 3.39Å; S127-M155 PolarHBondContact O-N 3.42Å; Y153-M155 HydrophobicContact CD2-SD 4.02Å; Y153-M155 HydrophobicContact CE2-SD 3.54Å; Y153-M155 VanDerWaalsContact CE2-SD 3.54Å; Y153-M155 PolarHBondContact O-N 3.27Å; M155-D157 PolarHBondContact O-N 2.83Å; M155-L375 HydrophobicContact CE-CD1 3.27Å; M155-L375 HydrophobicContact CE-CG 3.7Å; M155-L375 HydrophobicContact SD-CD1 4.17Å
156	P	54.6	Low	54.4	Low	43 Å²	43	81.8 Å²	81.8	28%	0.279	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-53.2	124.3	-173.5	-10	12.6	0	0	0	108.8	Y373 Y374	P156-Y373 HydrophobicContact CB-CD1 3.79Å; P156-Y373 HydrophobicContact CB-CE1 3.09Å; P156-Y373 HydrophobicContact CG-CD1 3.99Å; P156-Y373 HydrophobicContact CG-CE1 3.31Å; P156-Y373 HydrophobicContact CG-CE2 4.18Å; P156-Y373 WeakPolarHBondContact CG-OH 3.27Å; P156-Y374 HydrophobicContact CB-CE1 4.39Å; P156-Y374 WeakPolarHBondContact O-CD1 3.45Å; P156-Y374 WeakPolarHBondContact O-CE1 3.49Å
157	D	45.2	Very low	53.4	Low	38 Å²	38	80.2 Å²	80.2	20%	0.203	45%	0.453	C	S	.	.			trans	-151.5	146.9	161.7	-132.1	-17	0	0	0	109.9	F126 M155 L364 Y374	F126-D157 HydrophobicContact CD1-CB 4.15Å; F126-D157 HydrophobicContact CE1-CB 4.21Å; M155-D157 PolarHBondContact O-N 2.83Å; D157-L364 WeakPolarHBondContact OD2-CD2 3.39Å; D157-Y374 WeakPolarHBondContact OD1-CE1 3.5Å
158	I	35.7	Very low	51.9	Low	96 Å²	96	83.6 Å²	83.6	49%	0.492	48%	0.481	S	S	.	.			trans	-61.5	134.6	-163.2	-66.6	166.6	0	0	0	111.3	L160 Y374	I158-L160 PolarHBondContact O-N 3.33Å; I158-Y374 WeakPolarHBondContact CG1-OH 3.2Å
159	D	29.3	Very low	50.2	Low	92 Å²	92	86.6 Å²	86.6	49%	0.492	50%	0.501	S	S	.	.			trans	-55.3	108.3	165.5	-90.5	-28.6	0	0	0	109.4	F161	D159-F161 VanDerWaalsContact C-N 3.26Å; D159-F161 HydrophobicContact CB-CD2 4.22Å; D159-F161 PolarHBondContact O-N 2.77Å
160	L	34.9	Very low	47.4	Very low	159 Å²	159	92 Å²	92	83%	0.832	53%	0.528	S	S	*	.			trans	-69.1	83	170.2	-93	126.7	0	0	0	109.7	I158	I158-L160 PolarHBondContact O-N 3.33Å
161	F	29.9	Very low	44.3	Very low	173 Å²	173	96.8 Å²	96.8	76%	0.759	56%	0.561	S	S	*	*			trans	-95.5	112.5	157.1	-81.9	-76.4	0	0	0	110.1	D159 L163	D159-F161 VanDerWaalsContact C-N 3.26Å; D159-F161 HydrophobicContact CB-CD2 4.22Å; D159-F161 PolarHBondContact O-N 2.77Å; F161-L163 PolarHBondContact O-N 3.45Å
162	S	33.1	Very low	41.4	Very low	109 Å²	109	103.2 Å²	103.2	76%	0.762	59%	0.594	S	S	*	*			trans	-40.4	118.2	163.9	48.1	0	0	0	0	112.9
163	L	26.2	Very low	38.4	Very low	161 Å²	161	107.6 Å²	107.6	84%	0.843	63%	0.625	S	S	*	*			trans	-122.6	123.6	153.8	-93.9	150.1	0	0	0	107.9	F161 C165	F161-L163 PolarHBondContact O-N 3.45Å; L163-C165 PolarHBondContact O-N 2.85Å
164	P	31.1	Very low	35.5	Very low	114 Å²	114	111.5 Å²	111.5	74%	0.74	66%	0.657	S	S	*	*			trans	-73.4	121.9	-177.4	28.6	-31.2	0	0	0	109.6	P166	P164-P166 VanDerWaalsContact O-CD 3.24Å; P164-P166 WeakPolarHBondContact O-CD 3.21Å
165	C	26.9	Very low	32.9	Very low	108 Å²	108	112.6 Å²	112.6	73%	0.73	68%	0.68	S	S	*	*			trans	-64.6	116.6	166	-69.7	0	0	0	0	109.1	L163 G167	L163-C165 PolarHBondContact O-N 2.85Å; C165-G167 PolarHBondContact O-N 2.95Å; C165-G167 VanDerWaalsContact O-N 3.16Å
166	P	32.6	Very low	30.8	Very low	137 Å²	137	121.2 Å²	121.2	89%	0.89	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	104.5	169.1	8.6	8.4	0	0	0	107.2	P164	P164-P166 VanDerWaalsContact O-CD 3.24Å; P164-P166 WeakPolarHBondContact O-CD 3.21Å
167	G	31.7	Very low	29.3	Very low	73 Å²	73	127.6 Å²	127.6	75%	0.753	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	154.3	-11.6	170.9	0	0	0	0	0	117.2	C165 L169	C165-G167 PolarHBondContact O-N 2.95Å; C165-G167 VanDerWaalsContact O-N 3.16Å; G167-L169 PolarHBondContact O-N 2.99Å
168	C	27.9	Very low	28.4	Very low	122 Å²	122	135.9 Å²	135.9	82%	0.824	77%	0.767	S	S	*	*			trans	-93.5	74.4	176.5	-69.7	0	0	0	0	111.3
169	L	30	Very low	27.9	Very low	168 Å²	168	137.5 Å²	137.5	88%	0.88	78%	0.782	S	S	*	*			trans	-116.8	93.3	159.5	-88.4	168.1	0	0	0	108.2	G167	G167-L169 PolarHBondContact O-N 2.99Å
170	I	26	Very low	27.7	Very low	173 Å²	173	141.7 Å²	141.7	89%	0.887	80%	0.796	S	S	*	*			trans	-132.2	123.8	155.6	-56.5	-179.1	0	0	0	108.8
171	S	23.3	Very low	27.3	Very low	100 Å²	100	141.1 Å²	141.1	70%	0.699	79%	0.792	S	S	*	*			trans	-59.3	137.6	-170.1	-174.2	0	0	0	0	114.4	S173	S171-S173 PolarHBondContact O-N 2.79Å
172	I	29.5	Very low	27.2	Very low	173 Å²	173	141.2 Å²	141.2	89%	0.887	80%	0.795	S	S	*	*			trans	-67.1	103.5	162.8	-64.6	168	0	0	0	107.9
173	S	24.8	Very low	27	Very low	93 Å²	93	147.2 Å²	147.2	65%	0.65	80%	0.8	S	S	*	*			trans	-166.4	110.6	153.7	49.2	0	0	0	0	112.1	S171	S171-S173 PolarHBondContact O-N 2.79Å
174	S	24.3	Very low	27.1	Very low	118 Å²	118	143.5 Å²	143.5	83%	0.825	80%	0.801	S	S	*	*			trans	170.7	101.7	141.5	40.7	0	0	0	0	108.4
175	A	25.2	Very low	26.9	Very low	88 Å²	88	148.9 Å²	148.9	73%	0.727	81%	0.807	S	S	*	*				74.9	86	96.8	0	0	0	0	0	112.5	Q177	A175-Q177 PolarHBondContact O-N 2.84Å; A175-Q177 VanDerWaalsContact O-N 3.09Å
176	Y	25.3	Very low	27.1	Very low	207 Å²	207	155.6 Å²	155.6	81%	0.812	82%	0.817	S	S	*	*			trans	-57.8	101.3	160.5	-130.7	-98.5	0	0	0	109.2
177	Q	23.4	Very low	27	Very low	177 Å²	177	160 Å²	160	83%	0.827	82%	0.816	S	S	*	*			trans	-117.7	94.3	165.6	-85.8	-174.3	-8.9	0	0	110.1	A175 T179	A175-Q177 PolarHBondContact O-N 2.84Å; A175-Q177 VanDerWaalsContact O-N 3.09Å; Q177-T179 PolarHBondContact O-N 2.81Å
178	R	26.1	Very low	26.9	Very low	212 Å²	212	161.8 Å²	161.8	80%	0.8	82%	0.817	S	S	*	*			trans	-69.8	108.7	162.8	-85.9	178	167.7	172	-3.3	108.9	K180	R178-K180 PolarHBondContact O-N 3.49Å
179	T	24.6	Very low	26.9	Very low	130 Å²	130	165.7 Å²	165.7	80%	0.798	82%	0.82	S	S	*	*			trans	-71.3	111.7	166.5	38.1	0	0	0	0	109.8	Q177	Q177-T179 PolarHBondContact O-N 2.81Å
180	K	24.9	Very low	26.7	Very low	181 Å²	181	169.2 Å²	169.2	79%	0.787	82%	0.821	S	S	*	*			trans	-81.1	110	170.3	-80.3	179.8	177.2	173.1	0	109.2	R178	R178-K180 PolarHBondContact O-N 3.49Å
181	I	27.4	Very low	26.7	Very low	147 Å²	147	169.2 Å²	169.2	75%	0.754	82%	0.818	S	S	*	*			trans	-91.2	109.4	164.9	-63.1	175.6	0	0	0	107.8	R183	I181-R183 PolarHBondContact O-N 3.19Å
182	H	26	Very low	26.9	Very low	175 Å²	175	171 Å²	171	81%	0.81	82%	0.823	S	S	*	*			trans	-77.5	112	172.5	-81.2	-78.8	0	0	0	110.2
183	R	30.2	Very low	26.9	Very low	234 Å²	234	172.7 Å²	172.7	88%	0.883	82%	0.819	S	S	*	*			trans	-121.8	135	160.5	-82.9	-172.7	174.1	-175.1	-0.6	110.4	I181	I181-R183 PolarHBondContact O-N 3.19Å
184	G	27.7	Very low	27.7	Very low	84 Å²	84	177.3 Å²	177.3	87%	0.866	82%	0.822	S	S	*	*			trans	-57.4	141.3	-163.9	0	0	0	0	0	115.9	R186	G184-R186 PolarHBondContact O-N 3.23Å
185	R	27.2	Very low	28.2	Very low	227 Å²	227	175.2 Å²	175.2	86%	0.857	82%	0.819	S	S	*	*			trans	-90.9	93.9	-172.3	-157.3	176.8	-175	-176.9	2.1	110
186	R	31	Very low	28.9	Very low	249 Å²	249	177.2 Å²	177.2	94%	0.94	81%	0.813	S	S	*	*			trans	-82.6	114.8	160.2	-82.9	-174.6	175.4	-179.7	-0.7	108.6	G184 S188	G184-R186 PolarHBondContact O-N 3.23Å; R186-S188 PolarHBondContact O-N 2.82Å
187	R	30.3	Very low	30.1	Very low	230 Å²	230	174.9 Å²	174.9	87%	0.868	80%	0.803	S	S	*	*			trans	-73.4	99.4	178.3	-79.5	177.7	166.9	162.8	-4.8	109.7
188	S	29.1	Very low	31.9	Very low	110 Å²	110	169.6 Å²	169.6	77%	0.769	78%	0.783	S	S	*	*			trans	-93.2	135.1	156.5	-175.2	0	0	0	0	108.7	R186 R190	R186-S188 PolarHBondContact O-N 2.82Å; S188-R190 PolarHBondContact O-N 2.83Å; S188-R190 VanDerWaalsContact O-N 3.1Å
189	K	27.8	Very low	33.7	Very low	204 Å²	204	160.3 Å²	160.3	89%	0.887	75%	0.75	S	S	*	*			trans	-59.1	112	179.1	-71.7	178.4	177.1	176.8	0	108.7	Q191	K189-Q191 PolarHBondContact O-N 2.79Å
190	R	25.7	Very low	35.8	Very low	241 Å²	241	158.2 Å²	158.2	91%	0.909	73%	0.731	S	S	*	*			trans	-67	99.7	171.6	-81.5	179.7	173	179.2	-5	108.6	S188 V192	S188-R190 PolarHBondContact O-N 2.83Å; S188-R190 VanDerWaalsContact O-N 3.1Å; R190-V192 PolarHBondContact O-N 2.79Å
191	Q	27.6	Very low	38	Very low	174 Å²	174	153.3 Å²	153.3	81%	0.813	72%	0.716	S	S	*	*			trans	-60.2	123.7	146.9	-80.2	179.9	-23	0	0	106.7	K189 R193	K189-Q191 PolarHBondContact O-N 2.79Å; Q191-R193 VanDerWaalsContact C-N 3.28Å; Q191-R193 PolarHBondContact O-N 3.23Å
192	V	26.9	Very low	40.4	Very low	136 Å²	136	147.9 Å²	147.9	82%	0.824	69%	0.688	S	S	*	*			trans	-67.3	91.8	172.2	178.4	0	0	0	0	106.6	R190 R194	R190-V192 PolarHBondContact O-N 2.79Å; V192-R194 PolarHBondContact O-N 3.39Å; V192-R194 VanDerWaalsContact O-N 3.16Å
193	R	29	Very low	43.1	Very low	210 Å²	210	142 Å²	142	79%	0.792	67%	0.665	S	S	*	*			trans	-66.3	108.2	163.1	-77.2	-173.7	173.4	-174.1	-3.3	106.4	Q191 G195	Q191-R193 VanDerWaalsContact C-N 3.28Å; Q191-R193 PolarHBondContact O-N 3.23Å; R193-G195 PolarHBondContact O-N 3.01Å
194	R	41.2	Very low	45.9	Very low	190 Å²	190	131 Å²	131	72%	0.717	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-50.4	135.7	159	-81.4	177	167.3	178.4	-8	107	V192 Q196	V192-R194 PolarHBondContact O-N 3.39Å; V192-R194 VanDerWaalsContact O-N 3.16Å; R194-Q196 PolarHBondContact O-N 3.45Å; R194-Q196 VanDerWaalsContact O-N 3.16Å
195	G	34.8	Very low	48.8	Very low	74 Å²	74	128.3 Å²	128.3	76%	0.763	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-54.6	121.8	-176.5	0	0	0	0	0	110.4	R193 R197	R193-G195 PolarHBondContact O-N 3.01Å; G195-R197 PolarHBondContact O-N 2.99Å
196	Q	40.9	Very low	52.1	Low	130 Å²	130	117.5 Å²	117.5	61%	0.607	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-58.2	122.9	171.4	-79.3	169.4	-71.9	0	0	107.5	R194 T198 D470	R194-Q196 PolarHBondContact O-N 3.45Å; R194-Q196 VanDerWaalsContact O-N 3.16Å; Q196-T198 PolarHBondContact O-N 3.05Å; Q196-D470 PolarHBondContact NE2-OD2 3.49Å
197	R	51.1	Low	55	Low	157 Å²	157	107.1 Å²	107.1	59%	0.592	51%	0.508	S	S	*	.			trans	-67.3	115.4	172.2	-76	-168.5	179.3	169.6	-4.4	107.1	G195 T201 E202	G195-R197 PolarHBondContact O-N 2.99Å; R197-T201 WeakPolarHBondContact CA-OG1 3.44Å; R197-T201 WeakPolarHBondContact CB-OG1 3.23Å; R197-E202 HydrophobicContact CB-CG 4.13Å
198	T	60.2	Low	58.1	Low	67 Å²	67	96.1 Å²	96.1	41%	0.411	47%	0.467	S	S	.	.			trans	-87.8	164.2	170.8	62.6	0	0	0	0	108.2	Q196 Q200 T201 E202	Q196-T198 PolarHBondContact O-N 3.05Å; T198-Q200 PolarHBondContact O-N 3.34Å; T198-Q200 PolarHBondContact OG1-N 3.15Å; T198-T201 PolarHBondContact N-OG1 2.85Å; T198-T201 PolarHBondContact O-N 3.2Å; T198-T201 PolarHBondContact O-OG1 3.08Å; T198-E202 PolarHBondContact O-N 3.11Å
199	V	64.9	Low	61.2	Low	16 Å²	16	91 Å²	91	10%	0.097	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.2	-21.7	169	168.3	0	0	0	0	113.2	K204 L391 F400 V472	V199-K204 WeakPolarHBondContact O-CE 3.36Å; V199-K204 PolarHBondContact O-NZ 2.92Å; V199-L391 HydrophobicContact CG1-CB 3.48Å; V199-L391 VanDerWaalsContact CG1-CB 3.48Å; V199-L391 HydrophobicContact CG1-CD1 3.88Å; V199-L391 HydrophobicContact CG1-CG 4.25Å; V199-F400 HydrophobicContact CG1-CE1 4.44Å; V199-F400 HydrophobicContact CG1-CZ 3.9Å; V199-V472 HydrophobicContact CG2-CG1 3.58Å
200	Q	67.9	Low	64.5	Low	87 Å²	87	81.2 Å²	81.2	41%	0.407	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-32.2	177.8	-50.4	-173.6	-36.1	0	0	113.6	T198 K204 L388	T198-Q200 PolarHBondContact O-N 3.34Å; T198-Q200 PolarHBondContact OG1-N 3.15Å; Q200-K204 PolarHBondContact O-NZ 2.93Å; Q200-L388 HydrophobicContact CB-CD2 4.19Å; Q200-L388 HydrophobicContact CG-CD2 3.95Å
201	T	71.8	Confident	67.8	Low	77 Å²	77	69.8 Å²	69.8	47%	0.472	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-20.6	-173	56	0	0	0	0	114.2	R197 T198 N247	R197-T201 WeakPolarHBondContact CA-OG1 3.44Å; R197-T201 WeakPolarHBondContact CB-OG1 3.23Å; T198-T201 PolarHBondContact N-OG1 2.85Å; T198-T201 PolarHBondContact O-N 3.2Å; T198-T201 PolarHBondContact O-OG1 3.08Å; T201-N247 PolarHBondContact O-ND2 2.84Å
202	E	77.7	Confident	71.1	Confident	33 Å²	33	61.5 Å²	61.5	15%	0.154	31%	0.306	C	S	.	.	S	Bend	trans	-76.8	146.3	177.2	-66.1	-177.4	171.2	0	0	110.8	R197 T198 K204 N247 F400	R197-E202 HydrophobicContact CB-CG 4.13Å; T198-E202 PolarHBondContact O-N 3.11Å; E202-K204 VanDerWaalsContact O-CD 3.28Å; E202-K204 WeakPolarHBondContact O-CD 3.32Å; E202-K204 WeakPolarHBondContact O-CE 3.41Å; E202-K204 PolarHBondContact O-NZ 2.91Å; E202-N247 PolarHBondContact O-ND2 3.42Å; E202-F400 HydrophobicContact CB-CE1 4.48Å
203	T	82.4	Confident	74.3	Confident	53 Å²	53	55 Å²	55	33%	0.325	27%	0.267	S	S	.	.			trans	-79	136.8	172.3	-57	0	0	0	0	109.2	Y205 N247 R249	T203-Y205 HydrophobicContact CG2-CE1 4.46Å; T203-Y205 HydrophobicContact CG2-CE2 4.2Å; T203-N247 VanDerWaalsContact CA-O 3.31Å; T203-N247 WeakPolarHBondContact CA-O 3.09Å; T203-N247 PolarHBondContact OG1-ND2 3.05Å; T203-N247 PolarHBondContact OG1-OD1 2.81Å; T203-R249 HydrophobicContact CG2-CG 4.17Å
204	K	88.6	Confident	77.4	Confident	1 Å²	1	48.5 Å²	48.5	0%	0.004	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	155.8	-178.9	-68.8	85.3	179.3	-176.3	0	110	V199 Q200 E202 N247 T248 R249 Y387 L399 F400	V199-K204 WeakPolarHBondContact O-CE 3.36Å; V199-K204 PolarHBondContact O-NZ 2.92Å; Q200-K204 PolarHBondContact O-NZ 2.93Å; E202-K204 VanDerWaalsContact O-CD 3.28Å; E202-K204 WeakPolarHBondContact O-CD 3.32Å; E202-K204 WeakPolarHBondContact O-CE 3.41Å; E202-K204 PolarHBondContact O-NZ 2.91Å; K204-N247 PolarHBondContact N-O 3.05Å; K204-T248 HydrophobicContact CB-CG2 3.95Å; K204-T248 CarbonylContact O-C 3.51Å; K204-T248 VanDerWaalsContact O-CA 3.31Å; K204-T248 WeakPolarHBondContact O-CA 3.3Å; K204-R249 PolarHBondContact O-N 3.41Å; K204-Y387 WeakPolarHBondContact CD-OH 3.26Å; K204-L399 CarbonylContact C-O 3.59Å; K204-L399 VanDerWaalsContact CA-O 3.25Å; K204-L399 WeakPolarHBondContact CA-O 3.44Å; K204-L399 HydrophobicContact CB-CB 4.03Å; K204-L399 HydrophobicContact CG-CB 4.19Å; K204-F400 HydrophobicContact CG-CE1 4.22Å; K204-F400 HydrophobicContact CG-CZ 4.3Å
205	Y	89.8	Confident	79.9	Confident	29 Å²	29	41.3 Å²	41.3	11%	0.114	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	127.1	179.7	-59.4	-88.8	0	0	0	108.5	T203 R249 V251 L399 N401 K402	T203-Y205 HydrophobicContact CG2-CE1 4.46Å; T203-Y205 HydrophobicContact CG2-CE2 4.2Å; Y205-R249 CarbonylContact C-O 3.54Å; Y205-R249 WeakPolarHBondContact CA-O 3.16Å; Y205-R249 HydrophobicContact CD1-CB 3.81Å; Y205-R249 HydrophobicContact CD1-CG 4.22Å; Y205-R249 HydrophobicContact CE1-CB 4.05Å; Y205-R249 HydrophobicContact CE1-CG 3.94Å; Y205-V251 HydrophobicContact CD1-CG2 4.18Å; Y205-L399 PolarHBondContact N-O 2.67Å; Y205-L399 VanDerWaalsContact O-CA 3.29Å; Y205-L399 WeakPolarHBondContact O-CA 3.33Å; Y205-L399 VanDerWaalsContact O-CD2 3.22Å; Y205-L399 WeakPolarHBondContact O-CD2 3.01Å; Y205-N401 WeakPolarHBondContact CB-O 3.4Å; Y205-K402 HydrophobicContact CD2-CB 3.99Å; Y205-K402 HydrophobicContact CD2-CG 4.3Å; Y205-K402 HydrophobicContact CE1-CG 3.97Å; Y205-K402 HydrophobicContact CE2-CB 3.72Å; Y205-K402 HydrophobicContact CE2-CD 4.38Å; Y205-K402 HydrophobicContact CE2-CG 3.75Å; Y205-K402 WeakPolarHBondContact OH-CE 3.46Å
206	I	94.8	Very high	82.6	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	109.1	172.3	-63.3	169.8	0	0	0	106.8	L208 Y242 T248 R249 I250 V251 A291 I313 L339 I343 L399	I206-L208 PolarHBondContact O-N 3.01Å; I206-Y242 HydrophobicContact CD1-CD1 3.98Å; I206-Y242 HydrophobicContact CD1-CE1 3.79Å; I206-T248 HydrophobicContact CD1-CG2 3.74Å; I206-T248 HydrophobicContact CG1-CG2 3.85Å; I206-R249 PolarHBondContact N-O 2.91Å; I206-I250 HydrophobicContact CD1-CG1 4.42Å; I206-V251 PolarHBondContact O-N 2.98Å; I206-A291 HydrophobicContact CG2-CB 4.48Å; I206-I313 HydrophobicContact CG2-CD1 4.33Å; I206-L339 HydrophobicContact CG2-CD2 4.18Å; I206-I343 HydrophobicContact CD1-CG2 4.25Å; I206-L399 HydrophobicContact CB-CD2 4.36Å; I206-L399 HydrophobicContact CG1-CD2 3.73Å
207	E	92.9	Very high	85	Confident	30 Å²	30	32.4 Å²	32.4	14%	0.14	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	99.1	171.3	-66.4	-179.9	169.8	0	0	109.7	V253 D290 A291 N401 P403	E207-V253 HydrophobicContact CB-CG1 3.67Å; E207-V253 HydrophobicContact CB-CG2 4.27Å; E207-V253 HydrophobicContact CG-CG1 3.88Å; E207-D290 HydrophobicContact CB-CB 4.34Å; E207-D290 WeakPolarHBondContact CB-OD2 3.31Å; E207-D290 PolarHBondContact N-OD2 3.32Å; E207-D290 PolarHBondContact O-N 2.83Å; E207-A291 PolarHBondContact O-N 3.05Å; E207-N401 VanDerWaalsContact CD-ND2 3.34Å; E207-N401 PolarHBondContact OE1-ND2 2.85Å; E207-P403 HydrophobicContact CG-CG 3.87Å
208	L	95.4	Very high	87	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	134.2	-172.5	-177.7	61.7	0	0	0	111.8	I206 I210 V235 I250 V251 L252 V253 A291 H293 L335 L339	I206-L208 PolarHBondContact O-N 3.01Å; L208-I210 HydrophobicContact CD1-CD1 4.23Å; L208-I210 HydrophobicContact CD2-CD1 3.8Å; L208-I210 HydrophobicContact CD2-CG1 4.33Å; L208-I210 HydrophobicContact CG-CD1 3.94Å; L208-I210 HydrophobicContact CG-CG1 4.34Å; L208-V235 HydrophobicContact CD2-CG1 4.22Å; L208-V235 HydrophobicContact CD2-CG2 4.15Å; L208-I250 HydrophobicContact CB-CG2 4.01Å; L208-I250 HydrophobicContact CD2-CG2 3.6Å; L208-I250 HydrophobicContact CG-CG2 4.47Å; L208-V251 PolarHBondContact N-O 2.74Å; L208-L252 HydrophobicContact CG-CD2 4.46Å; L208-L252 WeakPolarHBondContact O-CA 3.35Å; L208-V253 WeakPolarHBondContact O-CG2 3.42Å; L208-V253 PolarHBondContact O-N 2.85Å; L208-A291 HydrophobicContact CD1-CB 4.12Å; L208-H293 HydrophobicContact CD1-CB 4.35Å; L208-H293 VanDerWaalsContact CD1-CD2 3.49Å; L208-H293 WeakPolarHBondContact CD1-CD2 3.31Å; L208-L335 HydrophobicContact CD2-CD1 4.47Å; L208-L335 HydrophobicContact CD2-CD2 4.41Å; L208-L339 HydrophobicContact CD1-CD2 4.33Å; L208-L339 HydrophobicContact CD2-CD1 4.38Å
209	M	94.8	Very high	88.3	Confident	1 Å²	1	28 Å²	28	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	134.5	163.7	174.2	177.1	174.4	0	0	110.6	V211 A254 E256 I285 Q287 C289 A291 V292 H293	M209-V211 HydrophobicContact CE-CG2 4.05Å; M209-A254 VanDerWaalsContact CA-O 3.29Å; M209-A254 WeakPolarHBondContact CA-O 3.38Å; M209-A254 HydrophobicContact CB-CB 4.26Å; M209-A254 HydrophobicContact CG-CB 3.84Å; M209-A254 HydrophobicContact SD-CB 4.01Å; M209-E256 HydrophobicContact CE-CB 3.97Å; M209-I285 HydrophobicContact CE-CD1 4Å; M209-I285 HydrophobicContact CE-CG1 4.25Å; M209-I285 HydrophobicContact CE-CG2 4.05Å; M209-I285 HydrophobicContact SD-CD1 4.29Å; M209-I285 HydrophobicContact SD-CG2 3.54Å; M209-I285 VanDerWaalsContact SD-CG2 3.54Å; M209-Q287 HydrophobicContact SD-CB 4.44Å; M209-C289 HydrophobicContact CB-CB 4.24Å; M209-A291 PolarHBondContact N-O 2.78Å; M209-V292 HydrophobicContact CB-CG1 4.25Å; M209-V292 HydrophobicContact CB-CG2 4.17Å; M209-V292 HydrophobicContact CG-CG1 4.16Å; M209-V292 CarbonylContact O-C 3.48Å; M209-V292 VanDerWaalsContact O-CA 3.32Å; M209-V292 WeakPolarHBondContact O-CA 3.28Å; M209-V292 HydrophobicContact SD-CG1 4.44Å; M209-H293 PolarHBondContact O-N 3.47Å
210	I	96.1	Very high	89.4	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.7	175.7	-63.4	-59	0	0	0	110.4	L208 A231 V235 L252 A254 M255 E256 H293 F295	L208-I210 HydrophobicContact CD1-CD1 4.23Å; L208-I210 HydrophobicContact CD2-CD1 3.8Å; L208-I210 HydrophobicContact CD2-CG1 4.33Å; L208-I210 HydrophobicContact CG-CD1 3.94Å; L208-I210 HydrophobicContact CG-CG1 4.34Å; I210-A231 HydrophobicContact CG2-CB 4.26Å; I210-V235 HydrophobicContact CD1-CG2 4.26Å; I210-V235 HydrophobicContact CG1-CG2 4.03Å; I210-L252 HydrophobicContact CG1-CD2 3.73Å; I210-A254 PolarHBondContact N-O 3.5Å; I210-A254 VanDerWaalsContact N-O 3.13Å; I210-M255 HydrophobicContact CB-CE 4.35Å; I210-M255 HydrophobicContact CB-CG 4.45Å; I210-M255 CarbonylContact O-C 3.5Å; I210-M255 VanDerWaalsContact O-CA 3.31Å; I210-M255 WeakPolarHBondContact O-CA 3.41Å; I210-E256 PolarHBondContact O-N 2.84Å; I210-H293 WeakPolarHBondContact CA-O 3.47Å; I210-H293 HydrophobicContact CD1-CB 3.88Å; I210-F295 HydrophobicContact CD1-CD1 4.44Å; I210-F295 HydrophobicContact CD1-CE1 3.86Å; I210-F295 HydrophobicContact CD1-CE2 4.2Å; I210-F295 HydrophobicContact CD1-CZ 3.72Å; I210-F295 HydrophobicContact CG1-CE2 4.44Å; I210-F295 HydrophobicContact CG1-CZ 4.4Å; I210-F295 HydrophobicContact CG2-CD1 4.46Å; I210-F295 HydrophobicContact CG2-CD2 3.62Å; I210-F295 HydrophobicContact CG2-CE2 3.87Å; I210-F295 HydrophobicContact CG2-CG 3.95Å; I210-F295 HydrophobicContact CG2-CZ 4.4Å
211	V	95.8	Very high	90.3	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.4	169.7	-176.7	0	0	0	0	108.2	M209 E256 W258 F277 I285 V292 H293 L294 F295	M209-V211 HydrophobicContact CE-CG2 4.05Å; V211-E256 CarbonylContact C-O 3.01Å; V211-E256 WeakPolarHBondContact CA-O 3.39Å; V211-E256 HydrophobicContact CG2-CB 4.34Å; V211-W258 HydrophobicContact CG1-CD2 4.13Å; V211-W258 VanDerWaalsContact CG1-CE2 3.48Å; V211-W258 HydrophobicContact CG1-CH2 4.21Å; V211-W258 HydrophobicContact CG1-CZ2 3.55Å; V211-F277 HydrophobicContact CB-CE2 3.99Å; V211-F277 HydrophobicContact CB-CZ 4Å; V211-F277 HydrophobicContact CG1-CE2 4.25Å; V211-F277 HydrophobicContact CG2-CE2 3.99Å; V211-F277 HydrophobicContact CG2-CZ 3.86Å; V211-I285 HydrophobicContact CG2-CD1 4.33Å; V211-V292 HydrophobicContact CG2-CG1 4.03Å; V211-H293 PolarHBondContact N-O 3.05Å; V211-L294 HydrophobicContact CB-CD1 4.07Å; V211-L294 HydrophobicContact CG1-CD1 3.9Å; V211-L294 CarbonylContact O-C 3.44Å; V211-L294 WeakPolarHBondContact O-CA 3.48Å; V211-F295 PolarHBondContact O-N 3.34Å
212	N	95.7	Very high	91.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	123.9	176.4	-56.3	-73	0	0	0	109	L216 T227 E256 T257 W258	N212-L216 HydrophobicContact CB-CD2 4.02Å; N212-L216 WeakPolarHBondContact OD1-CD2 2.89Å; N212-T227 HydrophobicContact CB-CG2 3.63Å; N212-E256 PolarHBondContact N-O 3.08Å; N212-E256 PolarHBondContact ND2-O 2.85Å; N212-T257 HydrophobicContact CB-CG2 4.23Å; N212-T257 PolarHBondContact ND2-OG1 2.95Å; N212-W258 PolarHBondContact O-N 2.86Å
213	D	94.8	Very high	91.4	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	16%	0.159	C	C	.	.			trans	-74.6	172.9	178.5	80.8	-9.1	0	0	0	113.2	E215 L216 F217 W258 I266 L294 F295 S296 G297	D213-E215 PolarHBondContact OD1-N 3.21Å; D213-L216 WeakPolarHBondContact OD1-CB 3.17Å; D213-L216 PolarHBondContact OD1-N 3.34Å; D213-F217 PolarHBondContact O-N 3.48Å; D213-F217 VanDerWaalsContact O-N 3.15Å; D213-W258 HydrophobicContact CB-CE3 4.03Å; D213-W258 HydrophobicContact CB-CZ3 4.35Å; D213-I266 HydrophobicContact CB-CD1 3.48Å; D213-I266 VanDerWaalsContact CB-CD1 3.48Å; D213-I266 WeakPolarHBondContact OD2-CD1 3.05Å; D213-L294 HydrophobicContact CB-CD1 4.25Å; D213-F295 PolarHBondContact N-O 3.02Å; D213-S296 VanDerWaalsContact CG-CA 3.45Å; D213-S296 WeakPolarHBondContact OD2-CA 3.19Å; D213-S296 VanDerWaalsContact OD2-CB 3.27Å; D213-S296 WeakPolarHBondContact OD2-CB 3.27Å; D213-S296 PolarHBondContact OD2-OG 2.84Å; D213-G297 PolarHBondContact OD1-N 3.39Å; D213-G297 PolarHBondContact OD2-N 1.99Å
214	Y	93.8	Very high	91.5	Very high	73 Å²	73	34.8 Å²	34.8	29%	0.286	15%	0.154	S	C	.	.	H	α-helix	trans	-66.5	-39.7	-179	-179.4	-104.9	0	0	0	112.1	L216 F217 V218 W258 S259 S260 N262	Y214-L216 PolarHBondContact O-N 3.47Å; Y214-F217 HydrophobicContact CD2-CD1 4.26Å; Y214-F217 HydrophobicContact CE2-CD1 4.25Å; Y214-F217 WeakPolarHBondContact O-CB 3.38Å; Y214-F217 PolarHBondContact O-N 3.29Å; Y214-V218 HydrophobicContact CD1-CG2 4.1Å; Y214-V218 HydrophobicContact CE1-CG2 3.64Å; Y214-V218 HydrophobicContact CE2-CG2 4.19Å; Y214-V218 WeakPolarHBondContact O-CG2 3.01Å; Y214-V218 PolarHBondContact O-N 2.78Å; Y214-W258 VanDerWaalsContact CA-O 3.26Å; Y214-W258 WeakPolarHBondContact CA-O 3.48Å; Y214-W258 WeakPolarHBondContact CD2-O 3.43Å; Y214-S259 VanDerWaalsContact CE2-O 3.26Å; Y214-S259 WeakPolarHBondContact CE2-O 3.3Å; Y214-S260 VanDerWaalsContact CE2-O 3.29Å; Y214-S260 WeakPolarHBondContact CE2-O 3.49Å; Y214-N262 WeakPolarHBondContact CB-OD1 2.96Å; Y214-N262 PolarHBondContact N-OD1 3.06Å
215	E	93	Very high	91.2	Very high	39 Å²	39	37.2 Å²	37.2	18%	0.182	17%	0.172	C	C	.	.	H	α-helix	trans	-61.1	-42.4	177.9	-77.5	80.6	173.7	0	0	112.2	D213 F217 V218 Q219 N262 R298	D213-E215 PolarHBondContact OD1-N 3.21Å; E215-F217 VanDerWaalsContact C-N 3.35Å; E215-V218 PolarHBondContact O-N 2.03Å; E215-Q219 WeakPolarHBondContact O-CG 3.32Å; E215-Q219 PolarHBondContact O-N 3.07Å; E215-N262 PolarHBondContact OE2-ND2 2.99Å; E215-R298 HydrophobicContact CB-CG 4.27Å; E215-R298 HydrophobicContact CG-CG 3.85Å; E215-R298 IonicContact OE1-CZ 2.98Å; E215-R298 VanDerWaalsContact OE1-CZ 3.27Å; E215-R298 IonicContact OE1-NE 2.7Å; E215-R298 PolarHBondContact OE1-NE 3.48Å; E215-R298 IonicContact OE1-NH2 3.7Å; E215-R298 PolarHBondContact OE1-NH2 3.26Å
216	L	92.2	Very high	90.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.3	-41.6	175.6	-179.8	60.5	0	0	0	111.2	N212 D213 Y214 V218 Q219 L220 T227 F230 F295 F325	N212-L216 HydrophobicContact CB-CD2 4.02Å; N212-L216 WeakPolarHBondContact OD1-CD2 2.89Å; D213-L216 WeakPolarHBondContact OD1-CB 3.17Å; D213-L216 PolarHBondContact OD1-N 3.34Å; Y214-L216 PolarHBondContact O-N 3.47Å; L216-V218 VanDerWaalsContact C-N 3.3Å; L216-V218 PolarHBondContact O-N 2.89Å; L216-Q219 PolarHBondContact O-N 3.2Å; L216-L220 HydrophobicContact CD1-CD1 3.86Å; L216-L220 HydrophobicContact CD1-CG 4.27Å; L216-L220 HydrophobicContact CG-CD1 4.09Å; L216-L220 WeakPolarHBondContact O-CB 3.32Å; L216-L220 WeakPolarHBondContact O-CG 3.42Å; L216-L220 PolarHBondContact O-N 3.13Å; L216-T227 HydrophobicContact CG-CG2 4.48Å; L216-F230 HydrophobicContact CD1-CD1 4.43Å; L216-F230 HydrophobicContact CD1-CE1 4.09Å; L216-F295 HydrophobicContact CD2-CB 3.58Å; L216-F325 HydrophobicContact CD1-CD2 3.36Å; L216-F325 HydrophobicContact CD1-CE2 3.85Å; L216-F325 HydrophobicContact CD1-CG 4.23Å
217	F	92.4	Very high	90.6	Very high	17 Å²	17	38.3 Å²	38.3	8%	0.075	18%	0.178	C	C	.	.	H	α-helix	trans	-58.9	-41.9	173.5	171.3	-105.8	0	0	0	111.7	D213 Y214 E215 L220 R222 T257 S259	D213-F217 PolarHBondContact O-N 3.48Å; D213-F217 VanDerWaalsContact O-N 3.15Å; Y214-F217 HydrophobicContact CD2-CD1 4.26Å; Y214-F217 HydrophobicContact CE2-CD1 4.25Å; Y214-F217 WeakPolarHBondContact O-CB 3.38Å; Y214-F217 PolarHBondContact O-N 3.29Å; E215-F217 VanDerWaalsContact C-N 3.35Å; F217-L220 CarbonylContact O-C 3.49Å; F217-L220 PolarHBondContact O-N 3.45Å; F217-R222 HydrophobicContact CD1-CB 4.42Å; F217-R222 HydrophobicContact CD1-CG 4.42Å; F217-R222 HydrophobicContact CE1-CB 3.74Å; F217-R222 HydrophobicContact CE1-CG 4.01Å; F217-R222 HydrophobicContact CE2-CB 4.49Å; F217-R222 WeakPolarHBondContact CE2-O 3.31Å; F217-R222 VanDerWaalsContact CZ-CA 3.48Å; F217-R222 HydrophobicContact CZ-CB 3.78Å; F217-R222 WeakPolarHBondContact CZ-O 3.39Å; F217-R222 VanDerWaalsContact O-CA 3.23Å; F217-R222 WeakPolarHBondContact O-CA 3.17Å; F217-R222 PolarHBondContact O-N 2.78Å; F217-T257 HydrophobicContact CB-CG2 4.32Å; F217-T257 HydrophobicContact CD2-CG2 4.11Å; F217-S259 WeakPolarHBondContact CE1-O 3.29Å
218	V	91.3	Very high	90.3	Very high	47 Å²	47	38.6 Å²	38.6	29%	0.285	18%	0.179	S	C	.	.	H	α-helix	trans	-66.2	-43.3	176.1	171.9	0	0	0	0	111.8	Y214 E215 L216 L220 R221 R222	Y214-V218 HydrophobicContact CD1-CG2 4.1Å; Y214-V218 HydrophobicContact CE1-CG2 3.64Å; Y214-V218 HydrophobicContact CE2-CG2 4.19Å; Y214-V218 WeakPolarHBondContact O-CG2 3.01Å; Y214-V218 PolarHBondContact O-N 2.78Å; E215-V218 PolarHBondContact O-N 2.03Å; L216-V218 VanDerWaalsContact C-N 3.3Å; L216-V218 PolarHBondContact O-N 2.89Å; V218-L220 VanDerWaalsContact C-N 3.28Å; V218-L220 PolarHBondContact O-N 2.95Å; V218-R221 PolarHBondContact O-N 3.32Å; V218-R222 HydrophobicContact CG2-CG 4.38Å
219	Q	87.7	Confident	89.9	Confident	85 Å²	85	39.3 Å²	39.3	40%	0.397	18%	0.182	S	C	.	.	H	α-helix	trans	-60.7	-38	176.5	-77.4	176.6	-14.8	0	0	112.2	E215 L216 R221 G297	E215-Q219 WeakPolarHBondContact O-CG 3.32Å; E215-Q219 PolarHBondContact O-N 3.07Å; L216-Q219 PolarHBondContact O-N 3.2Å; Q219-R221 PolarHBondContact O-N 2.97Å; Q219-G297 PolarHBondContact NE2-O 3.3Å
220	L	88	Confident	89.6	Confident	27 Å²	27	39.8 Å²	39.8	14%	0.141	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	43.4	175.4	-61.7	173.4	0	0	0	111.8	L216 F217 V218 R222 S223 Q226 T227 F230	L216-L220 HydrophobicContact CD1-CD1 3.86Å; L216-L220 HydrophobicContact CD1-CG 4.27Å; L216-L220 HydrophobicContact CG-CD1 4.09Å; L216-L220 WeakPolarHBondContact O-CB 3.32Å; L216-L220 WeakPolarHBondContact O-CG 3.42Å; L216-L220 PolarHBondContact O-N 3.13Å; F217-L220 CarbonylContact O-C 3.49Å; F217-L220 PolarHBondContact O-N 3.45Å; V218-L220 VanDerWaalsContact C-N 3.28Å; V218-L220 PolarHBondContact O-N 2.95Å; L220-R222 PolarHBondContact O-N 3.35Å; L220-R222 VanDerWaalsContact O-N 3.09Å; L220-S223 PolarHBondContact O-N 3.38Å; L220-S223 VanDerWaalsContact O-N 3.08Å; L220-Q226 HydrophobicContact CB-CB 4.4Å; L220-Q226 PolarHBondContact O-OE1 2.81Å; L220-T227 HydrophobicContact CD1-CG2 4.23Å; L220-F230 HydrophobicContact CD1-CB 3.73Å; L220-F230 HydrophobicContact CD1-CD1 3.7Å; L220-F230 HydrophobicContact CD1-CE1 4.5Å; L220-F230 HydrophobicContact CD1-CG 3.78Å; L220-F230 HydrophobicContact CD2-CB 4.48Å; L220-F230 HydrophobicContact CD2-CG 4.39Å
221	R	87.4	Confident	89.4	Confident	161 Å²	161	39.8 Å²	39.8	61%	0.608	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	30.2	172.1	-53.6	-178.5	-179.4	-176	0.2	114.5	V218 Q219 S223	V218-R221 PolarHBondContact O-N 3.32Å; Q219-R221 PolarHBondContact O-N 2.97Å; R221-S223 PolarHBondContact O-N 3.39Å
222	R	87.6	Confident	89.2	Confident	157 Å²	157	40.1 Å²	40.1	59%	0.592	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.5	34.5	-177.5	-59	-179.5	170.9	87.9	1.6	112.8	F217 V218 L220	F217-R222 HydrophobicContact CD1-CB 4.42Å; F217-R222 HydrophobicContact CD1-CG 4.42Å; F217-R222 HydrophobicContact CE1-CB 3.74Å; F217-R222 HydrophobicContact CE1-CG 4.01Å; F217-R222 HydrophobicContact CE2-CB 4.49Å; F217-R222 WeakPolarHBondContact CE2-O 3.31Å; F217-R222 VanDerWaalsContact CZ-CA 3.48Å; F217-R222 HydrophobicContact CZ-CB 3.78Å; F217-R222 WeakPolarHBondContact CZ-O 3.39Å; F217-R222 VanDerWaalsContact O-CA 3.23Å; F217-R222 WeakPolarHBondContact O-CA 3.17Å; F217-R222 PolarHBondContact O-N 2.78Å; V218-R222 HydrophobicContact CG2-CG 4.38Å; L220-R222 PolarHBondContact O-N 3.35Å; L220-R222 VanDerWaalsContact O-N 3.09Å
223	S	85.4	Confident	89	Confident	25 Å²	25	40.4 Å²	40.4	18%	0.175	19%	0.187	C	C	.	.			trans	-113.1	110.6	179.6	-176.3	0	0	0	0	111	L220 R221 S225 Q226 T227	L220-S223 PolarHBondContact O-N 3.38Å; L220-S223 VanDerWaalsContact O-N 3.08Å; R221-S223 PolarHBondContact O-N 3.39Å; S223-S225 PolarHBondContact O-N 3.29Å; S223-Q226 PolarHBondContact O-N 3.31Å; S223-Q226 PolarHBondContact OG-N 3.35Å; S223-T227 PolarHBondContact O-N 2.92Å; S223-T227 PolarHBondContact O-OG1 2.97Å; S223-T227 VanDerWaalsContact O-OG1 3.11Å
224	T	83.3	Confident	88.9	Confident	38 Å²	38	40.4 Å²	40.4	23%	0.233	19%	0.187	C	C	.	.	H	α-helix	trans	-58.5	-34.6	178.4	-41.3	0	0	0	0	111.3	H77 K228	H77-T224 HydrophobicContact CB-CG2 4.26Å; T224-K228 HydrophobicContact CG2-CD 4.33Å; T224-K228 WeakPolarHBondContact O-CB 3.16Å; T224-K228 WeakPolarHBondContact O-CD 3.31Å; T224-K228 WeakPolarHBondContact O-CG 3.02Å; T224-K228 PolarHBondContact O-N 2.83Å
225	S	82.3	Confident	89	Confident	53 Å²	53	36.9 Å²	36.9	37%	0.371	17%	0.174	S	C	.	.	H	α-helix	trans	-66.2	-43.2	175.6	178.5	0	0	0	0	112.1	R115 S223 K228 I229	R115-S225 PolarHBondContact NH2-OG 2.98Å; S223-S225 PolarHBondContact O-N 3.29Å; S225-K228 PolarHBondContact O-N 2.93Å; S225-I229 VanDerWaalsContact O-CG1 3.25Å; S225-I229 WeakPolarHBondContact O-CG1 3.19Å; S225-I229 PolarHBondContact O-N 3.01Å
226	Q	83.9	Confident	89	Confident	51 Å²	51	35.1 Å²	35.1	24%	0.238	17%	0.166	C	C	.	.	H	α-helix	trans	-67.5	-40.5	177	-67.6	-174.1	-33.3	0	0	111.9	L220 S223 K228 I229 F230	L220-Q226 HydrophobicContact CB-CB 4.4Å; L220-Q226 PolarHBondContact O-OE1 2.81Å; S223-Q226 PolarHBondContact O-N 3.31Å; S223-Q226 PolarHBondContact OG-N 3.35Å; Q226-K228 PolarHBondContact O-N 2.95Å; Q226-I229 PolarHBondContact O-N 3.49Å; Q226-F230 VanDerWaalsContact O-CB 3.3Å; Q226-F230 WeakPolarHBondContact O-CB 3.15Å; Q226-F230 PolarHBondContact O-N 2.89Å
227	T	88.5	Confident	88.9	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.2	-46.6	175.1	-50.5	0	0	0	0	112.2	N212 L216 L220 S223 F230 A231 T257	N212-T227 HydrophobicContact CB-CG2 3.63Å; L216-T227 HydrophobicContact CG-CG2 4.48Å; L220-T227 HydrophobicContact CD1-CG2 4.23Å; S223-T227 PolarHBondContact O-N 2.92Å; S223-T227 PolarHBondContact O-OG1 2.97Å; S223-T227 VanDerWaalsContact O-OG1 3.11Å; T227-F230 PolarHBondContact O-N 3.22Å; T227-A231 WeakPolarHBondContact O-CB 3.41Å; T227-A231 PolarHBondContact O-N 3.42Å; T227-T257 HydrophobicContact CG2-CG2 4.06Å
228	K	86.8	Confident	89	Confident	37 Å²	37	34.7 Å²	34.7	16%	0.161	16%	0.164	C	C	.	.	H	α-helix	trans	-62.8	-46	176.5	-71.2	169	174.6	-166.9	0	112.1	E75 T224 S225 Q226 F230 A231 K232 M255	E75-K228 WeakPolarHBondContact OE2-CD 3.44Å; E75-K228 WeakPolarHBondContact OE2-CE 3.36Å; E75-K228 IonicContact OE2-NZ 3.95Å; E75-K228 PolarHBondContact OE2-NZ 2.79Å; T224-K228 HydrophobicContact CG2-CD 4.33Å; T224-K228 WeakPolarHBondContact O-CB 3.16Å; T224-K228 WeakPolarHBondContact O-CD 3.31Å; T224-K228 WeakPolarHBondContact O-CG 3.02Å; T224-K228 PolarHBondContact O-N 2.83Å; S225-K228 PolarHBondContact O-N 2.93Å; Q226-K228 PolarHBondContact O-N 2.95Å; K228-F230 VanDerWaalsContact C-N 3.33Å; K228-F230 PolarHBondContact O-N 2.91Å; K228-A231 PolarHBondContact O-N 3.18Å; K228-K232 WeakPolarHBondContact O-CB 3.14Å; K228-K232 WeakPolarHBondContact O-CG 3.31Å; K228-K232 PolarHBondContact O-N 3.29Å; K228-M255 HydrophobicContact CB-SD 4.2Å; K228-M255 HydrophobicContact CG-SD 3.96Å
229	I	86.4	Confident	89.1	Confident	14 Å²	14	32.5 Å²	32.5	7%	0.072	15%	0.15	C	C	.	.	H	α-helix	trans	-60.4	-47.2	-179.6	-71	165.8	0	0	0	110.5	Y96 C114 R115 S225 Q226 S233	Y96-I229 WeakPolarHBondContact OH-CA 3.5Å; Y96-I229 PolarHBondContact OH-O 3.03Å; C114-I229 HydrophobicContact CB-CD1 4.06Å; C114-I229 HydrophobicContact CB-CG1 4.29Å; C114-I229 HydrophobicContact CB-CG2 4.4Å; R115-I229 HydrophobicContact CG-CD1 3.99Å; S225-I229 VanDerWaalsContact O-CG1 3.25Å; S225-I229 WeakPolarHBondContact O-CG1 3.19Å; S225-I229 PolarHBondContact O-N 3.01Å; Q226-I229 PolarHBondContact O-N 3.49Å; I229-S233 WeakPolarHBondContact O-CB 3.22Å; I229-S233 PolarHBondContact O-N 3.48Å; I229-S233 PolarHBondContact O-OG 3.28Å
230	F	89.3	Confident	89.2	Confident	12 Å²	12	29 Å²	29	5%	0.053	13%	0.134	C	C	.	.	H	α-helix	trans	-58.7	-51.9	177.9	173.7	-99.1	0	0	0	112	L216 L220 Q226 T227 K228 K232 S233 V234 F325 G326 V328 M331	L216-F230 HydrophobicContact CD1-CD1 4.43Å; L216-F230 HydrophobicContact CD1-CE1 4.09Å; L220-F230 HydrophobicContact CD1-CB 3.73Å; L220-F230 HydrophobicContact CD1-CD1 3.7Å; L220-F230 HydrophobicContact CD1-CE1 4.5Å; L220-F230 HydrophobicContact CD1-CG 3.78Å; L220-F230 HydrophobicContact CD2-CB 4.48Å; L220-F230 HydrophobicContact CD2-CG 4.39Å; Q226-F230 VanDerWaalsContact O-CB 3.3Å; Q226-F230 WeakPolarHBondContact O-CB 3.15Å; Q226-F230 PolarHBondContact O-N 2.89Å; T227-F230 PolarHBondContact O-N 3.22Å; K228-F230 VanDerWaalsContact C-N 3.33Å; K228-F230 PolarHBondContact O-N 2.91Å; F230-K232 PolarHBondContact O-N 3.48Å; F230-S233 WeakPolarHBondContact O-CB 3.45Å; F230-S233 PolarHBondContact O-N 2.82Å; F230-S233 VanDerWaalsContact O-N 3.15Å; F230-V234 HydrophobicContact CE1-CG2 4.18Å; F230-V234 HydrophobicContact CE2-CG2 4.31Å; F230-V234 HydrophobicContact CZ-CG2 4.03Å; F230-V234 WeakPolarHBondContact O-CG2 3.36Å; F230-V234 PolarHBondContact O-N 3.32Å; F230-F325 HydrophobicContact CE1-CD2 4.23Å; F230-F325 HydrophobicContact CE1-CE2 4.23Å; F230-F325 HydrophobicContact CE2-CE2 4.21Å; F230-F325 AromaticContact CZ-CD2 3.99Å; F230-F325 HydrophobicContact CZ-CD2 3.99Å; F230-F325 AromaticContact CZ-CE2 3.77Å; F230-F325 HydrophobicContact CZ-CE2 3.77Å; F230-G326 VanDerWaalsContact CZ-O 3.29Å; F230-G326 WeakPolarHBondContact CZ-O 3.41Å; F230-V328 HydrophobicContact CD2-CG2 3.87Å; F230-V328 HydrophobicContact CE2-CG2 3.88Å; F230-M331 HydrophobicContact CE1-CE 4.49Å; F230-M331 HydrophobicContact CE1-SD 3.39Å; F230-M331 WeakPolarHBondContact CE1-SD 3.39Å; F230-M331 HydrophobicContact CZ-SD 3.49Å; F230-M331 WeakPolarHBondContact CZ-SD 2.98Å
231	A	92.9	Very high	89.3	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.3	-43.3	-178.6	0	0	0	0	0	112.6	I210 T227 K228 S233 V234 V235 M255 F295	I210-A231 HydrophobicContact CG2-CB 4.26Å; T227-A231 WeakPolarHBondContact O-CB 3.41Å; T227-A231 PolarHBondContact O-N 3.42Å; K228-A231 PolarHBondContact O-N 3.18Å; A231-S233 PolarHBondContact O-N 3.46Å; A231-V234 PolarHBondContact O-N 3.15Å; A231-V235 WeakPolarHBondContact O-CG2 3.5Å; A231-V235 PolarHBondContact O-N 3.01Å; A231-V235 VanDerWaalsContact O-N 3.08Å; A231-M255 HydrophobicContact CB-CE 3.62Å; A231-M255 HydrophobicContact CB-SD 4.02Å; A231-F295 HydrophobicContact CB-CD2 4.03Å; A231-F295 HydrophobicContact CB-CE2 4Å
232	K	91.3	Very high	89.6	Confident	6 Å²	6	20.8 Å²	20.8	3%	0.026	10%	0.102	C	C	.	.	H	α-helix	trans	-65.2	-36.3	175.5	-70.6	179.6	-175.4	178.1	0	112.2	L69 Y73 E75 G91 Y96 K228 F230 V235 N236 L252 M255	L69-K232 HydrophobicContact CD2-CD 4.4Å; Y73-K232 WeakPolarHBondContact OH-CE 3.47Å; E75-K232 WeakPolarHBondContact OE1-CE 3.38Å; E75-K232 IonicContact OE1-NZ 2.85Å; E75-K232 PolarHBondContact OE1-NZ 2.63Å; G91-K232 PolarHBondContact O-NZ 3.42Å; Y96-K232 HydrophobicContact CD1-CB 4.27Å; Y96-K232 HydrophobicContact CD2-CB 4.41Å; Y96-K232 HydrophobicContact CE1-CB 3.51Å; Y96-K232 HydrophobicContact CE2-CB 3.7Å; Y96-K232 HydrophobicContact CE2-CD 3.57Å; Y96-K232 HydrophobicContact CE2-CG 4.24Å; Y96-K232 VanDerWaalsContact OH-CB 3.23Å; Y96-K232 WeakPolarHBondContact OH-CB 3.5Å; Y96-K232 WeakPolarHBondContact OH-CD 3.44Å; K228-K232 WeakPolarHBondContact O-CB 3.14Å; K228-K232 WeakPolarHBondContact O-CG 3.31Å; K228-K232 PolarHBondContact O-N 3.29Å; F230-K232 PolarHBondContact O-N 3.48Å; K232-V235 PolarHBondContact O-N 3.18Å; K232-N236 VanDerWaalsContact O-CB 3.3Å; K232-N236 WeakPolarHBondContact O-CB 3.39Å; K232-N236 PolarHBondContact O-N 3.41Å; K232-L252 HydrophobicContact CG-CD1 3.94Å; K232-M255 HydrophobicContact CG-CE 3.8Å
233	S	91	Very high	89.5	Confident	6 Å²	6	16.8 Å²	16.8	4%	0.042	9%	0.09	C	C	.	.	H	α-helix	trans	-63.1	-42.3	174.5	-66.9	0	0	0	0	112.1	Y96 S112 I229 F230 A231 N236 M237	Y96-S233 WeakPolarHBondContact CE1-OG 3.21Å; S112-S233 WeakPolarHBondContact CB-OG 3.16Å; I229-S233 WeakPolarHBondContact O-CB 3.22Å; I229-S233 PolarHBondContact O-N 3.48Å; I229-S233 PolarHBondContact O-OG 3.28Å; F230-S233 WeakPolarHBondContact O-CB 3.45Å; F230-S233 PolarHBondContact O-N 2.82Å; F230-S233 VanDerWaalsContact O-N 3.15Å; A231-S233 PolarHBondContact O-N 3.46Å; S233-N236 PolarHBondContact O-N 3.36Å; S233-M237 PolarHBondContact O-N 3.49Å; S233-M237 VanDerWaalsContact O-N 3.13Å
234	V	93	Very high	89.5	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-59.6	-48.6	175.1	170.3	0	0	0	0	110.6	F230 A231 M237 A238 F295 V328 M331 A332 L335	F230-V234 HydrophobicContact CE1-CG2 4.18Å; F230-V234 HydrophobicContact CE2-CG2 4.31Å; F230-V234 HydrophobicContact CZ-CG2 4.03Å; F230-V234 WeakPolarHBondContact O-CG2 3.36Å; F230-V234 PolarHBondContact O-N 3.32Å; A231-V234 PolarHBondContact O-N 3.15Å; V234-M237 PolarHBondContact O-N 2.82Å; V234-A238 PolarHBondContact O-N 3.36Å; V234-F295 HydrophobicContact CB-CE2 4.22Å; V234-F295 HydrophobicContact CB-CZ 4.41Å; V234-F295 HydrophobicContact CG1-CE2 4.02Å; V234-F295 HydrophobicContact CG1-CZ 3.74Å; V234-V328 HydrophobicContact CG2-CB 4.49Å; V234-V328 HydrophobicContact CG2-CG1 4.25Å; V234-M331 HydrophobicContact CG1-CB 4.21Å; V234-M331 HydrophobicContact CG1-CG 4.08Å; V234-M331 HydrophobicContact CG2-CB 4.05Å; V234-M331 HydrophobicContact CG2-CG 4.29Å; V234-M331 HydrophobicContact CG2-SD 4.12Å; V234-A332 HydrophobicContact CG1-CB 4.29Å; V234-L335 HydrophobicContact CG1-CB 4.46Å; V234-L335 HydrophobicContact CG1-CD2 4.16Å
235	V	95.3	Very high	89.7	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-67.8	-37.7	180	-179.8	0	0	0	0	111.8	L68 L208 I210 A231 K232 M237 A238 D239 I250 L252 L335	L68-V235 HydrophobicContact CD1-CB 4.48Å; L68-V235 HydrophobicContact CD1-CG1 3.96Å; L208-V235 HydrophobicContact CD2-CG1 4.22Å; L208-V235 HydrophobicContact CD2-CG2 4.15Å; I210-V235 HydrophobicContact CD1-CG2 4.26Å; I210-V235 HydrophobicContact CG1-CG2 4.03Å; A231-V235 WeakPolarHBondContact O-CG2 3.5Å; A231-V235 PolarHBondContact O-N 3.01Å; A231-V235 VanDerWaalsContact O-N 3.08Å; K232-V235 PolarHBondContact O-N 3.18Å; V235-M237 VanDerWaalsContact C-N 3.27Å; V235-M237 PolarHBondContact O-N 2.96Å; V235-A238 PolarHBondContact O-N 2.9Å; V235-D239 WeakPolarHBondContact O-CB 3.41Å; V235-D239 PolarHBondContact O-N 2.92Å; V235-I250 HydrophobicContact CG1-CB 4.48Å; V235-I250 HydrophobicContact CG1-CG2 3.71Å; V235-L252 HydrophobicContact CB-CD1 4.13Å; V235-L252 HydrophobicContact CB-CG 4.38Å; V235-L252 HydrophobicContact CG1-CD1 4.15Å; V235-L252 HydrophobicContact CG1-CD2 4.31Å; V235-L252 HydrophobicContact CG1-CG 3.92Å; V235-L252 HydrophobicContact CG2-CD1 4.35Å; V235-L252 HydrophobicContact CG2-CD2 4.16Å; V235-L252 HydrophobicContact CG2-CG 4.46Å; V235-L335 HydrophobicContact CG2-CD2 3.86Å
236	N	93.3	Very high	90.1	Very high	2 Å²	2	19.5 Å²	19.5	1%	0.011	9%	0.091	C	C	.	.	H	α-helix	trans	-59	-39.8	175.8	-174.8	52.8	0	0	0	111.9	N65 L68 Y96 Y97 H98 K232 S233 L240	N65-N236 PolarHBondContact ND2-OD1 3.38Å; L68-N236 HydrophobicContact CD1-CB 4.26Å; L68-N236 HydrophobicContact CD2-CB 3.87Å; Y96-N236 HydrophobicContact CD1-CB 4.26Å; Y97-N236 PolarHBondContact O-ND2 3.01Å; H98-N236 PolarHBondContact CD2-OD1 3.16Å; H98-N236 PolarHBondContact NE2-O 2.81Å; H98-N236 PolarHBondContact NE2-OD1 3.49Å; K232-N236 VanDerWaalsContact O-CB 3.3Å; K232-N236 WeakPolarHBondContact O-CB 3.39Å; K232-N236 PolarHBondContact O-N 3.41Å; S233-N236 PolarHBondContact O-N 3.36Å; N236-L240 PolarHBondContact O-N 3.43Å
237	M	90.4	Very high	90.2	Very high	8 Å²	8	20 Å²	20	4%	0.039	10%	0.095	C	C	.	.	H	α-helix	trans	-70.4	-42.5	175.9	-178.9	173.8	169.6	0	0	112	W108 A110 M120 S233 V234 V235 D239 L240 I241 A332	W108-M237 HydrophobicContact CH2-CE 4.14Å; A110-M237 HydrophobicContact CB-CB 4.22Å; A110-M237 HydrophobicContact CB-CG 4.45Å; M120-M237 HydrophobicContact CB-CE 4.43Å; M120-M237 HydrophobicContact CB-SD 4.18Å; M120-M237 HydrophobicContact CE-CE 4.22Å; M120-M237 HydrophobicContact CG-CE 4.45Å; M120-M237 HydrophobicContact CG-SD 4.09Å; M120-M237 HydrophobicContact SD-CE 3.39Å; M120-M237 WeakPolarHBondContact SD-CE 3.48Å; M120-M237 HydrophobicContact SD-SD 3.53Å; S233-M237 PolarHBondContact O-N 3.49Å; S233-M237 VanDerWaalsContact O-N 3.13Å; V234-M237 PolarHBondContact O-N 2.82Å; V235-M237 VanDerWaalsContact C-N 3.27Å; V235-M237 PolarHBondContact O-N 2.96Å; M237-D239 VanDerWaalsContact C-N 3.34Å; M237-D239 PolarHBondContact O-N 2.71Å; M237-L240 WeakPolarHBondContact O-CB 3.15Å; M237-L240 PolarHBondContact O-N 2.95Å; M237-I241 PolarHBondContact O-N 3.13Å; M237-A332 HydrophobicContact CB-CB 3.74Å; M237-A332 HydrophobicContact CE-CB 4.32Å; M237-A332 HydrophobicContact CG-CB 3.67Å; M237-A332 HydrophobicContact SD-CB 3.65Å
238	A	94.1	Very high	90.3	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-62.2	-40.4	176.1	0	0	0	0	0	112.3	V234 V235 L240 I241 Y242 I250 L335	V234-A238 PolarHBondContact O-N 3.36Å; V235-A238 PolarHBondContact O-N 2.9Å; A238-L240 VanDerWaalsContact C-N 3.31Å; A238-L240 PolarHBondContact O-N 3.31Å; A238-I241 WeakPolarHBondContact O-CB 3.41Å; A238-I241 PolarHBondContact O-N 2.8Å; A238-Y242 WeakPolarHBondContact O-CD2 3.36Å; A238-Y242 PolarHBondContact O-N 3.06Å; A238-I250 HydrophobicContact CB-CD1 3.85Å; A238-L335 HydrophobicContact CB-CD2 3.78Å; A238-L335 HydrophobicContact CB-CG 4.26Å
239	D	93.4	Very high	90.4	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-59.4	-41.4	176.5	178.2	45.2	0	0	0	111.3	N65 H98 V235 M237 I241 Y242 K243 R249 I250	N65-D239 PolarHBondContact ND2-OD2 2.84Å; H98-D239 IonicContact CE1-OD2 2.63Å; H98-D239 PolarHBondContact CE1-OD2 3.26Å; H98-D239 VanDerWaalsContact CE1-OD2 3.31Å; V235-D239 WeakPolarHBondContact O-CB 3.41Å; V235-D239 PolarHBondContact O-N 2.92Å; M237-D239 VanDerWaalsContact C-N 3.34Å; M237-D239 PolarHBondContact O-N 2.71Å; D239-I241 VanDerWaalsContact C-N 3.33Å; D239-I241 PolarHBondContact O-N 3.28Å; D239-Y242 PolarHBondContact O-N 2.76Å; D239-K243 WeakPolarHBondContact O-CB 3.3Å; D239-K243 PolarHBondContact O-N 3.4Å; D239-R249 WeakPolarHBondContact OD1-CA 3.35Å; D239-R249 IonicContact OD1-CZ 3.76Å; D239-R249 IonicContact OD1-NE 3.18Å; D239-R249 PolarHBondContact OD1-NE 3.38Å; D239-R249 IonicContact OD1-NH2 3.48Å; D239-R249 IonicContact OD2-CZ 3.66Å; D239-R249 IonicContact OD2-NE 3.62Å; D239-R249 PolarHBondContact OD2-NE 2.85Å; D239-R249 IonicContact OD2-NH2 3.29Å; D239-R249 PolarHBondContact OD2-NH2 3.11Å; D239-I250 HydrophobicContact CB-CB 4.11Å; D239-I250 PolarHBondContact OD1-N 2.8Å
240	L	89.8	Confident	90.7	Very high	11 Å²	11	18.6 Å²	18.6	6%	0.058	9%	0.088	C	C	.	.	H	α-helix	trans	-59.4	-44	176.4	-177.1	61.2	0	0	0	111.9	H98 W108 A110 N236 M237 A238 K243 E244	H98-L240 HydrophobicContact CB-CD1 4.28Å; W108-L240 HydrophobicContact CB-CD2 4.23Å; W108-L240 HydrophobicContact CD2-CD2 4.24Å; W108-L240 HydrophobicContact CE3-CD2 3.67Å; W108-L240 HydrophobicContact CG-CD2 4.5Å; W108-L240 HydrophobicContact CZ3-CD2 4.45Å; A110-L240 HydrophobicContact CB-CD2 3.88Å; N236-L240 PolarHBondContact O-N 3.43Å; M237-L240 WeakPolarHBondContact O-CB 3.15Å; M237-L240 PolarHBondContact O-N 2.95Å; A238-L240 VanDerWaalsContact C-N 3.31Å; A238-L240 PolarHBondContact O-N 3.31Å; L240-K243 PolarHBondContact O-N 3.19Å; L240-E244 HydrophobicContact CD1-CG 4.13Å; L240-E244 WeakPolarHBondContact O-CG 3.47Å; L240-E244 PolarHBondContact O-N 3.4Å; L240-E244 VanDerWaalsContact O-N 3.09Å
241	I	90.4	Very high	90.8	Very high	16 Å²	16	18.3 Å²	18.3	8%	0.082	9%	0.088	C	C	.	.	H	α-helix	trans	-63.1	-46.5	179.3	-66.8	172.6	0	0	0	110.4	M237 A238 D239 Q245 I333 I367 F379	M237-I241 PolarHBondContact O-N 3.13Å; A238-I241 WeakPolarHBondContact O-CB 3.41Å; A238-I241 PolarHBondContact O-N 2.8Å; D239-I241 VanDerWaalsContact C-N 3.33Å; D239-I241 PolarHBondContact O-N 3.28Å; I241-Q245 WeakPolarHBondContact O-CB 3.01Å; I241-Q245 PolarHBondContact O-N 3.29Å; I241-Q245 VanDerWaalsContact O-N 3.16Å; I241-I333 HydrophobicContact CD1-CD1 3.68Å; I241-I367 HydrophobicContact CG2-CD1 3.51Å; I241-F379 HydrophobicContact CG2-CE2 3.93Å
242	Y	92.6	Very high	90.7	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-67.7	-40.3	-179.8	-88.4	-121.1	0	0	0	112.2	I206 A238 D239 L246 N247 T248 I250 C336 L339 G340 I343 F379	I206-Y242 HydrophobicContact CD1-CD1 3.98Å; I206-Y242 HydrophobicContact CD1-CE1 3.79Å; A238-Y242 WeakPolarHBondContact O-CD2 3.36Å; A238-Y242 PolarHBondContact O-N 3.06Å; D239-Y242 PolarHBondContact O-N 2.76Å; Y242-L246 HydrophobicContact CD1-CD1 3.93Å; Y242-L246 HydrophobicContact CE1-CD1 3.95Å; Y242-L246 HydrophobicContact CG-CD1 4.28Å; Y242-L246 WeakPolarHBondContact O-CA 3.39Å; Y242-L246 PolarHBondContact O-N 2.77Å; Y242-N247 PolarHBondContact O-N 3.07Å; Y242-T248 CarbonylContact C-O 3.53Å; Y242-T248 WeakPolarHBondContact CB-O 3.43Å; Y242-T248 HydrophobicContact CD1-CG2 4.02Å; Y242-T248 PolarHBondContact O-N 3.04Å; Y242-I250 HydrophobicContact CD1-CD1 4.1Å; Y242-I250 HydrophobicContact CD1-CG1 4.14Å; Y242-I250 HydrophobicContact CD2-CD1 3.87Å; Y242-I250 HydrophobicContact CE1-CD1 4.48Å; Y242-I250 HydrophobicContact CE2-CD1 4.29Å; Y242-I250 HydrophobicContact CG-CD1 3.78Å; Y242-I250 HydrophobicContact CG-CG1 4.11Å; Y242-C336 HydrophobicContact CE2-CB 3.86Å; Y242-C336 PolarHBondContact OH-O 3.16Å; Y242-L339 HydrophobicContact CE1-CB 4.34Å; Y242-L339 VanDerWaalsContact OH-C 3.25Å; Y242-L339 WeakPolarHBondContact OH-CB 3.39Å; Y242-G340 WeakPolarHBondContact OH-CA 3.48Å; Y242-G340 PolarHBondContact OH-N 3.09Å; Y242-I343 HydrophobicContact CE1-CD1 3.85Å; Y242-F379 HydrophobicContact CD2-CE2 4.28Å; Y242-F379 HydrophobicContact CD2-CZ 4.44Å; Y242-F379 HydrophobicContact CE2-CE2 4.01Å; Y242-F379 AromaticContact CE2-CZ 3.72Å; Y242-F379 HydrophobicContact CE2-CZ 3.72Å
243	K	86.9	Confident	90.5	Very high	74 Å²	74	18.4 Å²	18.4	32%	0.322	9%	0.088	S	C	.	.	H	α-helix	trans	-58.6	-51.8	177.5	176.5	-168.8	175.8	-169	0	110.7	D239 L240 T248	D239-K243 WeakPolarHBondContact O-CB 3.3Å; D239-K243 PolarHBondContact O-N 3.4Å; L240-K243 PolarHBondContact O-N 3.19Å; K243-T248 VanDerWaalsContact CA-O 3.31Å; K243-T248 WeakPolarHBondContact CA-O 3.43Å; K243-T248 PolarHBondContact N-O 3.35Å
244	E	84.8	Confident	90.4	Very high	107 Å²	107	18.1 Å²	18.1	50%	0.5	9%	0.087	S	C	.	.	H	α-helix	trans	-73.6	-30.9	-174.2	-67.6	-69.5	148.7	0	0	112.7	R100 L240	R100-E244 IonicContact NH2-OE2 2.9Å; L240-E244 HydrophobicContact CD1-CG 4.13Å; L240-E244 WeakPolarHBondContact O-CG 3.47Å; L240-E244 PolarHBondContact O-N 3.4Å; L240-E244 VanDerWaalsContact O-N 3.09Å
245	Q	87.3	Confident	90.3	Very high	52 Å²	52	18.2 Å²	18.2	24%	0.243	9%	0.087	C	C	.	.	H	α-helix	trans	-106.9	-29.9	-170.2	-64.5	-173.2	68.3	0	0	115.5	I241 R377 F379	I241-Q245 WeakPolarHBondContact O-CB 3.01Å; I241-Q245 PolarHBondContact O-N 3.29Å; I241-Q245 VanDerWaalsContact O-N 3.16Å; Q245-R377 PolarHBondContact NE2-O 3.42Å; Q245-F379 HydrophobicContact CB-CD2 4.21Å
246	L	90.1	Very high	90.1	Very high	13 Å²	13	18.6 Å²	18.6	7%	0.068	9%	0.089	C	C	.	.	H	α-helix	trans	-117.7	-5.1	-171.9	-57	179.2	0	0	0	113.4	Y242 T248 I343 M345 F379 I384 Y387	Y242-L246 HydrophobicContact CD1-CD1 3.93Å; Y242-L246 HydrophobicContact CE1-CD1 3.95Å; Y242-L246 HydrophobicContact CG-CD1 4.28Å; Y242-L246 WeakPolarHBondContact O-CA 3.39Å; Y242-L246 PolarHBondContact O-N 2.77Å; L246-T248 PolarHBondContact O-N 3.32Å; L246-T248 PolarHBondContact O-OG1 3.5Å; L246-I343 HydrophobicContact CD1-CD1 4.01Å; L246-M345 HydrophobicContact CD1-CE 3.54Å; L246-M345 HydrophobicContact CD2-CE 3.6Å; L246-M345 HydrophobicContact CG-CE 4.24Å; L246-F379 HydrophobicContact CD1-CD2 4.14Å; L246-F379 HydrophobicContact CD1-CE2 3.79Å; L246-F379 HydrophobicContact CD1-CZ 4.24Å; L246-F379 HydrophobicContact CD2-CD2 4.24Å; L246-F379 HydrophobicContact CG-CD2 4.17Å; L246-F379 HydrophobicContact CG-CE2 4.23Å; L246-I384 HydrophobicContact CD2-CG1 3.89Å; L246-Y387 HydrophobicContact CB-CE1 4.22Å; L246-Y387 HydrophobicContact CD2-CD1 4.14Å
247	N	87.4	Confident	90	Very high	61 Å²	61	18.5 Å²	18.5	33%	0.326	9%	0.088	S	C	.	.	S	Bend	trans	52.4	43.1	-167.6	-170.2	29.6	0	0	0	111.1	T201 E202 T203 K204 Y242	T201-N247 PolarHBondContact O-ND2 2.84Å; E202-N247 PolarHBondContact O-ND2 3.42Å; T203-N247 VanDerWaalsContact CA-O 3.31Å; T203-N247 WeakPolarHBondContact CA-O 3.09Å; T203-N247 PolarHBondContact OG1-ND2 3.05Å; T203-N247 PolarHBondContact OG1-OD1 2.81Å; K204-N247 PolarHBondContact N-O 3.05Å; Y242-N247 PolarHBondContact O-N 3.07Å
248	T	89.9	Confident	90.1	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	138.3	-179.1	-59	0	0	0	0	108.5	K204 I206 Y242 K243 L246 Y387	K204-T248 HydrophobicContact CB-CG2 3.95Å; K204-T248 CarbonylContact O-C 3.51Å; K204-T248 VanDerWaalsContact O-CA 3.31Å; K204-T248 WeakPolarHBondContact O-CA 3.3Å; I206-T248 HydrophobicContact CD1-CG2 3.74Å; I206-T248 HydrophobicContact CG1-CG2 3.85Å; Y242-T248 CarbonylContact C-O 3.53Å; Y242-T248 WeakPolarHBondContact CB-O 3.43Å; Y242-T248 HydrophobicContact CD1-CG2 4.02Å; Y242-T248 PolarHBondContact O-N 3.04Å; K243-T248 VanDerWaalsContact CA-O 3.31Å; K243-T248 WeakPolarHBondContact CA-O 3.43Å; K243-T248 PolarHBondContact N-O 3.35Å; L246-T248 PolarHBondContact O-N 3.32Å; L246-T248 PolarHBondContact O-OG1 3.5Å; T248-Y387 PolarHBondContact OG1-OH 3Å; T248-Y387 VanDerWaalsContact OG1-OH 3.06Å
249	R	88.8	Confident	89.9	Confident	23 Å²	23	18.9 Å²	18.9	9%	0.087	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	142.9	176.3	-59.7	-56.7	-58.6	-106.3	-0.4	109.9	N65 N67 T203 K204 Y205 I206 D239 V251	N65-R249 PolarHBondContact OD1-NH2 3.15Å; N67-R249 PolarHBondContact ND2-NH1 3.38Å; N67-R249 VanDerWaalsContact ND2-NH1 3.15Å; T203-R249 HydrophobicContact CG2-CG 4.17Å; K204-R249 PolarHBondContact O-N 3.41Å; Y205-R249 CarbonylContact C-O 3.54Å; Y205-R249 WeakPolarHBondContact CA-O 3.16Å; Y205-R249 HydrophobicContact CD1-CB 3.81Å; Y205-R249 HydrophobicContact CD1-CG 4.22Å; Y205-R249 HydrophobicContact CE1-CB 4.05Å; Y205-R249 HydrophobicContact CE1-CG 3.94Å; I206-R249 PolarHBondContact N-O 2.91Å; D239-R249 WeakPolarHBondContact OD1-CA 3.35Å; D239-R249 IonicContact OD1-CZ 3.76Å; D239-R249 IonicContact OD1-NE 3.18Å; D239-R249 PolarHBondContact OD1-NE 3.38Å; D239-R249 IonicContact OD1-NH2 3.48Å; D239-R249 IonicContact OD2-CZ 3.66Å; D239-R249 IonicContact OD2-NE 3.62Å; D239-R249 PolarHBondContact OD2-NE 2.85Å; D239-R249 IonicContact OD2-NH2 3.29Å; D239-R249 PolarHBondContact OD2-NH2 3.11Å; R249-V251 HydrophobicContact CB-CG2 4.45Å
250	I	93.3	Very high	89.6	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	118.4	172	-56.7	172.1	0	0	0	107.5	I206 L208 V235 A238 D239 Y242 L339	I206-I250 HydrophobicContact CD1-CG1 4.42Å; L208-I250 HydrophobicContact CB-CG2 4.01Å; L208-I250 HydrophobicContact CD2-CG2 3.6Å; L208-I250 HydrophobicContact CG-CG2 4.47Å; V235-I250 HydrophobicContact CG1-CB 4.48Å; V235-I250 HydrophobicContact CG1-CG2 3.71Å; A238-I250 HydrophobicContact CB-CD1 3.85Å; D239-I250 HydrophobicContact CB-CB 4.11Å; D239-I250 PolarHBondContact OD1-N 2.8Å; Y242-I250 HydrophobicContact CD1-CD1 4.1Å; Y242-I250 HydrophobicContact CD1-CG1 4.14Å; Y242-I250 HydrophobicContact CD2-CD1 3.87Å; Y242-I250 HydrophobicContact CE1-CD1 4.48Å; Y242-I250 HydrophobicContact CE2-CD1 4.29Å; Y242-I250 HydrophobicContact CG-CD1 3.78Å; Y242-I250 HydrophobicContact CG-CG1 4.11Å; I250-L339 HydrophobicContact CD1-CD1 3.59Å; I250-L339 HydrophobicContact CG1-CD1 4.3Å
251	V	90.8	Very high	89.6	Confident	6 Å²	6	23.8 Å²	23.8	4%	0.036	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	123.6	-175.9	-172.3	0	0	0	0	108.9	N67 Y205 I206 L208 R249 V253 P403	N67-V251 WeakPolarHBondContact O-CG2 3.4Å; Y205-V251 HydrophobicContact CD1-CG2 4.18Å; I206-V251 PolarHBondContact O-N 2.98Å; L208-V251 PolarHBondContact N-O 2.74Å; R249-V251 HydrophobicContact CB-CG2 4.45Å; V251-V253 PolarHBondContact O-N 3.46Å; V251-P403 HydrophobicContact CB-CG 4.14Å; V251-P403 HydrophobicContact CG1-CB 4.13Å; V251-P403 HydrophobicContact CG1-CG 4.1Å; V251-P403 HydrophobicContact CG2-CG 4.08Å
252	L	90.4	Very high	89.7	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	122.1	174	-76.9	168.6	0	0	0	110.4	L68 L69 S70 Y73 L208 I210 K232 V235 M255	L68-L252 WeakPolarHBondContact O-CB 3.18Å; L68-L252 PolarHBondContact O-N 2.95Å; L69-L252 HydrophobicContact CD2-CB 3.92Å; L69-L252 HydrophobicContact CD2-CD1 3.95Å; S70-L252 PolarHBondContact N-O 3.04Å; Y73-L252 HydrophobicContact CD2-CB 3.95Å; Y73-L252 WeakPolarHBondContact CD2-O 3.39Å; Y73-L252 HydrophobicContact CE2-CB 3.83Å; L208-L252 HydrophobicContact CG-CD2 4.46Å; L208-L252 WeakPolarHBondContact O-CA 3.35Å; I210-L252 HydrophobicContact CG1-CD2 3.73Å; K232-L252 HydrophobicContact CG-CD1 3.94Å; V235-L252 HydrophobicContact CB-CD1 4.13Å; V235-L252 HydrophobicContact CB-CG 4.38Å; V235-L252 HydrophobicContact CG1-CD1 4.15Å; V235-L252 HydrophobicContact CG1-CD2 4.31Å; V235-L252 HydrophobicContact CG1-CG 3.92Å; V235-L252 HydrophobicContact CG2-CD1 4.35Å; V235-L252 HydrophobicContact CG2-CD2 4.16Å; V235-L252 HydrophobicContact CG2-CG 4.46Å; L252-M255 HydrophobicContact CD1-CE 4.28Å
253	V	88.2	Confident	89.6	Confident	7 Å²	7	28.6 Å²	28.6	4%	0.042	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-23	175.1	-62	0	0	0	0	113.1	Y73 V74 E207 L208 V251 C289	Y73-V253 WeakPolarHBondContact CA-O 3.19Å; V74-V253 PolarHBondContact N-O 3.47Å; E207-V253 HydrophobicContact CB-CG1 3.67Å; E207-V253 HydrophobicContact CB-CG2 4.27Å; E207-V253 HydrophobicContact CG-CG1 3.88Å; L208-V253 WeakPolarHBondContact O-CG2 3.42Å; L208-V253 PolarHBondContact O-N 2.85Å; V251-V253 PolarHBondContact O-N 3.46Å; V253-C289 HydrophobicContact CG2-CB 3.71Å
254	A	88.6	Confident	89.9	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.008	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	157.7	171.8	0	0	0	0	0	112.3	V74 M209 I210 Q287	V74-A254 CarbonylContact O-C 3.56Å; V74-A254 WeakPolarHBondContact O-CA 3.31Å; M209-A254 VanDerWaalsContact CA-O 3.29Å; M209-A254 WeakPolarHBondContact CA-O 3.38Å; M209-A254 HydrophobicContact CB-CB 4.26Å; M209-A254 HydrophobicContact CG-CB 3.84Å; M209-A254 HydrophobicContact SD-CB 4.01Å; I210-A254 PolarHBondContact N-O 3.5Å; I210-A254 VanDerWaalsContact N-O 3.13Å; A254-Q287 HydrophobicContact CB-CG 4.01Å
255	M	90.3	Very high	90.2	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.01	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	137.9	170.7	-172.5	174.4	-67.1	0	0	111	Y73 V74 E75 R76 I210 K228 A231 K232 L252	Y73-M255 HydrophobicContact CE2-CB 4.12Å; Y73-M255 VanDerWaalsContact OH-CB 3.22Å; Y73-M255 WeakPolarHBondContact OH-CB 3.19Å; V74-M255 PolarHBondContact O-N 3.09Å; E75-M255 CarbonylContact C-O 3.48Å; E75-M255 WeakPolarHBondContact CA-O 3.41Å; R76-M255 PolarHBondContact N-O 2.96Å; I210-M255 HydrophobicContact CB-CE 4.35Å; I210-M255 HydrophobicContact CB-CG 4.45Å; I210-M255 CarbonylContact O-C 3.5Å; I210-M255 VanDerWaalsContact O-CA 3.31Å; I210-M255 WeakPolarHBondContact O-CA 3.41Å; K228-M255 HydrophobicContact CB-SD 4.2Å; K228-M255 HydrophobicContact CG-SD 3.96Å; A231-M255 HydrophobicContact CB-CE 3.62Å; A231-M255 HydrophobicContact CB-SD 4.02Å; K232-M255 HydrophobicContact CG-CE 3.8Å; L252-M255 HydrophobicContact CD1-CE 4.28Å
256	E	90.8	Very high	90.2	Very high	7 Å²	7	22.7 Å²	22.7	3%	0.033	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	138	176.5	-171.8	173.8	128.5	0	0	110.5	R76 F78 M209 I210 V211 N212 W258	R76-E256 HydrophobicContact CB-CB 4.48Å; R76-E256 HydrophobicContact CB-CG 4.22Å; R76-E256 WeakPolarHBondContact O-CA 3.43Å; F78-E256 HydrophobicContact CD2-CG 4.36Å; F78-E256 HydrophobicContact CE2-CG 4.07Å; F78-E256 VanDerWaalsContact CE2-OE1 3.31Å; F78-E256 WeakPolarHBondContact CE2-OE1 3.45Å; M209-E256 HydrophobicContact CE-CB 3.97Å; I210-E256 PolarHBondContact O-N 2.84Å; V211-E256 CarbonylContact C-O 3.01Å; V211-E256 WeakPolarHBondContact CA-O 3.39Å; V211-E256 HydrophobicContact CG2-CB 4.34Å; N212-E256 PolarHBondContact N-O 3.08Å; N212-E256 PolarHBondContact ND2-O 2.85Å; E256-W258 PolarHBondContact OE1-NE1 2.04Å
257	T	91.3	Very high	90	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	125.5	174.3	-58.3	0	0	0	0	110.7	R76 F78 N212 F217 T227 S259	R76-T257 PolarHBondContact O-N 3.26Å; F78-T257 PolarHBondContact N-O 3.3Å; N212-T257 HydrophobicContact CB-CG2 4.23Å; N212-T257 PolarHBondContact ND2-OG1 2.95Å; F217-T257 HydrophobicContact CB-CG2 4.32Å; F217-T257 HydrophobicContact CD2-CG2 4.11Å; T227-T257 HydrophobicContact CG2-CG2 4.06Å; T257-S259 PolarHBondContact O-N 2.9Å
258	W	93.1	Very high	89.8	Confident	1 Å²	1	24.9 Å²	24.9	0%	0.004	15%	0.146	C	C	.	.			trans	-85.3	81.1	175.7	-62.7	-13.3	0	0	0	110.9	V211 N212 D213 Y214 E256 N262 R263 I264 I266 F277 F280 L294	V211-W258 HydrophobicContact CG1-CD2 4.13Å; V211-W258 VanDerWaalsContact CG1-CE2 3.48Å; V211-W258 HydrophobicContact CG1-CH2 4.21Å; V211-W258 HydrophobicContact CG1-CZ2 3.55Å; N212-W258 PolarHBondContact O-N 2.86Å; D213-W258 HydrophobicContact CB-CE3 4.03Å; D213-W258 HydrophobicContact CB-CZ3 4.35Å; Y214-W258 VanDerWaalsContact CA-O 3.26Å; Y214-W258 WeakPolarHBondContact CA-O 3.48Å; Y214-W258 WeakPolarHBondContact CD2-O 3.43Å; E256-W258 PolarHBondContact OE1-NE1 2.04Å; W258-N262 HydrophobicContact CE3-CB 4.03Å; W258-N262 HydrophobicContact CZ3-CB 4.22Å; W258-R263 HydrophobicContact CD2-CB 4.35Å; W258-R263 HydrophobicContact CD2-CG 4.07Å; W258-R263 HydrophobicContact CG-CG 4.29Å; W258-R263 HydrophobicContact CH2-CB 4.13Å; W258-R263 HydrophobicContact CZ2-CB 3.74Å; W258-R263 HydrophobicContact CZ2-CG 4.09Å; W258-I264 HydrophobicContact CH2-CD1 4.1Å; W258-I264 HydrophobicContact CH2-CG1 3.78Å; W258-I264 HydrophobicContact CH2-CG2 4.3Å; W258-I264 HydrophobicContact CZ3-CD1 4.44Å; W258-I264 HydrophobicContact CZ3-CG1 3.88Å; W258-I266 HydrophobicContact CZ3-CD1 4.33Å; W258-F277 HydrophobicContact CH2-CD2 4.45Å; W258-F280 HydrophobicContact CZ2-CD1 4.16Å; W258-F280 AromaticContact CZ2-CE1 3.75Å; W258-F280 HydrophobicContact CZ2-CE1 3.75Å; W258-F280 HydrophobicContact CZ2-CZ 4.01Å; W258-L294 HydrophobicContact CH2-CD1 4.15Å; W258-L294 HydrophobicContact CZ3-CD1 4.13Å
259	S	89.4	Confident	89.7	Confident	15 Å²	15	28.6 Å²	28.6	11%	0.105	17%	0.166	C	C	.	.	S	Bend	trans	-78	-18.4	-175.9	33.2	0	0	0	0	115.4	F78 Y214 F217 T257	F78-S259 PolarHBondContact O-OG 2.94Å; Y214-S259 VanDerWaalsContact CE2-O 3.26Å; Y214-S259 WeakPolarHBondContact CE2-O 3.3Å; F217-S259 WeakPolarHBondContact CE1-O 3.29Å; T257-S259 PolarHBondContact O-N 2.9Å
260	S	87.8	Confident	89.7	Confident	42 Å²	42	27.8 Å²	27.8	29%	0.294	16%	0.164	S	C	.	.	S	Bend	trans	-102.9	-54.9	-179.8	-53.3	0	0	0	0	113.8	F78 N80 Y214	F78-S260 PolarHBondContact O-OG 3.27Å; F78-S260 VanDerWaalsContact O-OG 3.11Å; N80-S260 PolarHBondContact N-OG 2.99Å; Y214-S260 VanDerWaalsContact CE2-O 3.29Å; Y214-S260 WeakPolarHBondContact CE2-O 3.49Å
261	E	89.6	Confident	89.5	Confident	73 Å²	73	30.4 Å²	30.4	34%	0.341	18%	0.178	S	C	.	.			trans	-154.2	153.8	-178	66.4	-172.3	163.2	0	0	110.2	R81 R263	R81-E261 IonicContact CZ-OE1 3.5Å; R81-E261 IonicContact NE-OE1 3.53Å; R81-E261 PolarHBondContact NE-OE1 3.04Å; R81-E261 IonicContact NH2-OE1 2.99Å; R81-E261 PolarHBondContact NH2-OE1 2.82Å; R81-E261 IonicContact NH2-OE2 3.63Å; E261-R263 IonicContact OE1-NH1 3.77Å
262	N	92.5	Very high	89.4	Confident	40 Å²	40	34 Å²	34	21%	0.214	20%	0.196	C	C	.	.			trans	-67.3	138.7	173.8	-69.6	-29.9	0	0	0	111	Y214 E215 W258 I264 I266	Y214-N262 WeakPolarHBondContact CB-OD1 2.96Å; Y214-N262 PolarHBondContact N-OD1 3.06Å; E215-N262 PolarHBondContact OE2-ND2 2.99Å; W258-N262 HydrophobicContact CE3-CB 4.03Å; W258-N262 HydrophobicContact CZ3-CB 4.22Å; N262-I264 VanDerWaalsContact C-N 3.33Å; N262-I264 WeakPolarHBondContact CB-O 3.42Å; N262-I266 HydrophobicContact CB-CD1 4.4Å
263	R	90.7	Very high	89.5	Confident	77 Å²	77	34.1 Å²	34.1	29%	0.291	20%	0.197	S	C	.	.	S	Bend	trans	-84.7	-11	177	-57.9	-55.4	-164.7	176.9	5.7	113.4	W258 E261 F280	W258-R263 HydrophobicContact CD2-CB 4.35Å; W258-R263 HydrophobicContact CD2-CG 4.07Å; W258-R263 HydrophobicContact CG-CG 4.29Å; W258-R263 HydrophobicContact CH2-CB 4.13Å; W258-R263 HydrophobicContact CZ2-CB 3.74Å; W258-R263 HydrophobicContact CZ2-CG 4.09Å; E261-R263 IonicContact OE1-NH1 3.77Å; R263-F280 HydrophobicContact CB-CD2 4.03Å; R263-F280 HydrophobicContact CB-CE2 3.59Å; R263-F280 HydrophobicContact CB-CZ 4.08Å; R263-F280 HydrophobicContact CG-CE2 4.11Å; R263-F280 HydrophobicContact CG-CZ 4.3Å
264	I	93.4	Very high	89.8	Confident	21 Å²	21	33.8 Å²	33.8	11%	0.108	20%	0.195	C	C	.	.	S	Bend	trans	-130	160.1	174.4	68.1	177	0	0	0	109.5	W258 N262 I266 T273 F277 F280 L294	W258-I264 HydrophobicContact CH2-CD1 4.1Å; W258-I264 HydrophobicContact CH2-CG1 3.78Å; W258-I264 HydrophobicContact CH2-CG2 4.3Å; W258-I264 HydrophobicContact CZ3-CD1 4.44Å; W258-I264 HydrophobicContact CZ3-CG1 3.88Å; N262-I264 VanDerWaalsContact C-N 3.33Å; N262-I264 WeakPolarHBondContact CB-O 3.42Å; I264-I266 HydrophobicContact CD1-CG1 4.41Å; I264-I266 HydrophobicContact CG1-CG1 3.96Å; I264-I266 PolarHBondContact O-N 3.22Å; I264-T273 HydrophobicContact CD1-CG2 4.41Å; I264-F277 HydrophobicContact CD1-CB 3.65Å; I264-F277 HydrophobicContact CD1-CD2 3.97Å; I264-F277 HydrophobicContact CD1-CG 4.27Å; I264-F280 HydrophobicContact CG2-CB 3.53Å; I264-F280 HydrophobicContact CG2-CD2 4.31Å; I264-F280 HydrophobicContact CG2-CG 3.95Å; I264-L294 HydrophobicContact CD1-CD2 4.07Å
265	A	90.7	Very high	89.9	Confident	76 Å²	76	40.2 Å²	40.2	63%	0.628	22%	0.219	S	C	*	.			trans	-74.4	118.8	167.8	0	0	0	0	0	109.2
266	I	87.9	Confident	90.1	Very high	11 Å²	11	42.6 Å²	42.6	6%	0.056	23%	0.232	C	C	.	.			trans	-99.5	108.3	175.6	-54.1	-176.4	0	0	0	107.7	D213 W258 N262 I264 T273 L294 R298	D213-I266 HydrophobicContact CB-CD1 3.48Å; D213-I266 VanDerWaalsContact CB-CD1 3.48Å; D213-I266 WeakPolarHBondContact OD2-CD1 3.05Å; W258-I266 HydrophobicContact CZ3-CD1 4.33Å; N262-I266 HydrophobicContact CB-CD1 4.4Å; I264-I266 HydrophobicContact CD1-CG1 4.41Å; I264-I266 HydrophobicContact CG1-CG1 3.96Å; I264-I266 PolarHBondContact O-N 3.22Å; I266-T273 HydrophobicContact CG2-CG2 4.07Å; I266-L294 HydrophobicContact CD1-CD2 4.43Å; I266-R298 HydrophobicContact CG2-CB 4.39Å; I266-R298 HydrophobicContact CG2-CG 4.28Å; I266-R298 PolarHBondContact O-NH1 3.2Å
267	G	85	Confident	90.3	Very high	33 Å²	33	42.3 Å²	42.3	34%	0.34	23%	0.23	S	C	.	.			trans	-104	-179.1	-179.5	0	0	0	0	0	112.8	D269 T273	G267-D269 VanDerWaalsContact C-N 3.28Å; G267-D269 PolarHBondContact O-N 2.83Å; G267-T273 PolarHBondContact N-OG1 3.02Å; G267-T273 PolarHBondContact O-OG1 3.25Å
268	D	84.5	Confident	90.5	Very high	87 Å²	87	42.6 Å²	42.6	47%	0.465	23%	0.232	S	C	.	.	S	Bend	trans	-74.7	-20.2	178.9	-57.6	-36.4	0	0	0	113	M301	D268-M301 HydrophobicContact CB-CB 3.96Å; D268-M301 HydrophobicContact CB-CG 3.78Å; D268-M301 HydrophobicContact CB-SD 4.07Å; D268-M301 PolarHBondContact O-N 2.81Å
269	D	87.3	Confident	90.5	Very high	78 Å²	78	48.5 Å²	48.5	42%	0.417	26%	0.258	S	S	.	.			trans	-87.1	113.4	176.1	-174.5	-28.7	0	0	0	110.2	G267 L271 L272 T273	G267-D269 VanDerWaalsContact C-N 3.28Å; G267-D269 PolarHBondContact O-N 2.83Å; D269-L271 VanDerWaalsContact C-N 3.35Å; D269-L271 PolarHBondContact O-N 2.97Å; D269-L271 WeakPolarHBondContact OD1-CA 3.45Å; D269-L271 WeakPolarHBondContact OD1-CB 3.29Å; D269-L271 PolarHBondContact OD1-N 3.36Å; D269-L272 HydrophobicContact CB-CB 4.04Å; D269-L272 HydrophobicContact CB-CD1 3.9Å; D269-L272 HydrophobicContact CB-CG 4.05Å; D269-L272 PolarHBondContact O-N 2.83Å; D269-L272 PolarHBondContact OD1-N 2.89Å; D269-L272 VanDerWaalsContact OD1-N 3.17Å; D269-T273 WeakPolarHBondContact O-CB 3.44Å; D269-T273 PolarHBondContact O-N 2.96Å; D269-T273 PolarHBondContact O-OG1 2.83Å
270	A	88.3	Confident	90.7	Very high	6 Å²	6	48.9 Å²	48.9	5%	0.05	26%	0.257	C	S	.	.	H	α-helix	trans	-63.8	-36.5	180	0	0	0	0	0	112.7	T273 L274 F300 A307 I322	A270-T273 PolarHBondContact O-N 3.23Å; A270-L274 WeakPolarHBondContact O-CB 3.43Å; A270-L274 PolarHBondContact O-N 2.85Å; A270-F300 HydrophobicContact CB-CB 4.23Å; A270-F300 HydrophobicContact CB-CD1 4.06Å; A270-F300 HydrophobicContact CB-CD2 4.1Å; A270-F300 HydrophobicContact CB-CG 3.85Å; A270-A307 HydrophobicContact CB-CB 3.9Å; A270-I322 HydrophobicContact CB-CD1 3.99Å; A270-I322 WeakPolarHBondContact O-CD1 3.25Å
271	L	88.5	Confident	91	Very high	55 Å²	55	47.2 Å²	47.2	29%	0.288	25%	0.245	S	C	.	.	H	α-helix	trans	-72.6	-38.8	-179	-67.4	177.5	0	0	0	111.8	D269 L274 R275 A307	D269-L271 VanDerWaalsContact C-N 3.35Å; D269-L271 PolarHBondContact O-N 2.97Å; D269-L271 WeakPolarHBondContact OD1-CA 3.45Å; D269-L271 WeakPolarHBondContact OD1-CB 3.29Å; D269-L271 PolarHBondContact OD1-N 3.36Å; L271-L274 PolarHBondContact O-N 2.03Å; L271-R275 PolarHBondContact O-N 2.83Å; L271-A307 HydrophobicContact CD2-CB 4.09Å
272	L	89.7	Confident	91.1	Very high	82 Å²	82	49.9 Å²	49.9	43%	0.429	26%	0.255	S	S	.	.	H	α-helix	trans	-63.6	-45	173.4	-70.4	178.9	0	0	0	111.2	D269 L274 R275 D276	D269-L272 HydrophobicContact CB-CB 4.04Å; D269-L272 HydrophobicContact CB-CD1 3.9Å; D269-L272 HydrophobicContact CB-CG 4.05Å; D269-L272 PolarHBondContact O-N 2.83Å; D269-L272 PolarHBondContact OD1-N 2.89Å; D269-L272 VanDerWaalsContact OD1-N 3.17Å; L272-L274 PolarHBondContact O-N 3.48Å; L272-R275 PolarHBondContact O-N 3.06Å; L272-D276 PolarHBondContact O-N 3.12Å
273	T	92.6	Very high	91.1	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.012	27%	0.274	C	S	.	.	H	α-helix	trans	-61.9	-43.1	177.2	-58.1	0	0	0	0	111.5	I264 I266 G267 D269 A270 R275 D276 F277 L294 F300 I322	I264-T273 HydrophobicContact CD1-CG2 4.41Å; I266-T273 HydrophobicContact CG2-CG2 4.07Å; G267-T273 PolarHBondContact N-OG1 3.02Å; G267-T273 PolarHBondContact O-OG1 3.25Å; D269-T273 WeakPolarHBondContact O-CB 3.44Å; D269-T273 PolarHBondContact O-N 2.96Å; D269-T273 PolarHBondContact O-OG1 2.83Å; A270-T273 PolarHBondContact O-N 3.23Å; T273-R275 PolarHBondContact O-N 2.77Å; T273-D276 PolarHBondContact O-N 3.44Å; T273-F277 VanDerWaalsContact O-CB 3.28Å; T273-F277 WeakPolarHBondContact O-CB 3.46Å; T273-F277 PolarHBondContact O-N 3.29Å; T273-L294 HydrophobicContact CG2-CD2 4.25Å; T273-F300 HydrophobicContact CG2-CE1 4.42Å; T273-I322 HydrophobicContact CG2-CD1 3.83Å
274	L	93.5	Very high	91	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-58.8	-46.5	175.5	173.5	64.2	0	0	0	111.6	A270 L271 L272 D276 F277 M278 A307 Y309 I322	A270-L274 WeakPolarHBondContact O-CB 3.43Å; A270-L274 PolarHBondContact O-N 2.85Å; L271-L274 PolarHBondContact O-N 2.03Å; L272-L274 PolarHBondContact O-N 3.48Å; L274-D276 PolarHBondContact O-N 3.06Å; L274-F277 PolarHBondContact O-N 2.68Å; L274-M278 HydrophobicContact CD1-CG 4.02Å; L274-M278 WeakPolarHBondContact O-CG 3.31Å; L274-M278 PolarHBondContact O-N 3.36Å; L274-A307 HydrophobicContact CD2-CB 4.21Å; L274-Y309 HydrophobicContact CD1-CD2 4.44Å; L274-Y309 HydrophobicContact CD1-CE2 4.39Å; L274-Y309 HydrophobicContact CD2-CD1 4.32Å; L274-Y309 HydrophobicContact CD2-CD2 4.07Å; L274-Y309 HydrophobicContact CD2-CE1 4.22Å; L274-Y309 HydrophobicContact CD2-CE2 4.02Å; L274-Y309 HydrophobicContact CD2-CG 4.24Å; L274-Y309 HydrophobicContact CG-CD2 4.24Å; L274-Y309 HydrophobicContact CG-CE2 3.89Å; L274-I322 HydrophobicContact CB-CD1 4.32Å; L274-I322 HydrophobicContact CB-CG1 4.48Å; L274-I322 HydrophobicContact CB-CG2 4.23Å; L274-I322 HydrophobicContact CD1-CG2 4.1Å
275	R	92.3	Very high	90.7	Very high	136 Å²	136	53 Å²	53	51%	0.513	28%	0.279	S	S	.	.	H	α-helix	trans	-60.3	-46.9	179.6	-174.1	-168.6	68.4	-171.9	-3.3	111.4	L271 L272 T273 F277 M278 K279	L271-R275 PolarHBondContact O-N 2.83Å; L272-R275 PolarHBondContact O-N 3.06Å; T273-R275 PolarHBondContact O-N 2.77Å; R275-F277 VanDerWaalsContact C-N 3.35Å; R275-M278 PolarHBondContact O-N 3.41Å; R275-K279 PolarHBondContact O-N 2.89Å; R275-K279 VanDerWaalsContact O-N 3.09Å
276	D	93.9	Very high	90.5	Very high	53 Å²	53	58.7 Å²	58.7	28%	0.283	29%	0.289	S	S	.	.	H	α-helix	trans	-69.7	-35.2	-178.6	-67.2	-2.9	0	0	0	111	L272 T273 L274 K279 F280	L272-D276 PolarHBondContact O-N 3.12Å; T273-D276 PolarHBondContact O-N 3.44Å; L274-D276 PolarHBondContact O-N 3.06Å; D276-K279 WeakPolarHBondContact O-CB 3.08Å; D276-K279 PolarHBondContact O-N 3.24Å; D276-F280 PolarHBondContact O-N 2.95Å
277	F	95.6	Very high	90.3	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.8	-43.6	172.9	-178.6	-119.8	0	0	0	112.8	V211 W258 I264 T273 L274 R275 K279 F280 R281 V292 L294 I322	V211-F277 HydrophobicContact CB-CE2 3.99Å; V211-F277 HydrophobicContact CB-CZ 4Å; V211-F277 HydrophobicContact CG1-CE2 4.25Å; V211-F277 HydrophobicContact CG2-CE2 3.99Å; V211-F277 HydrophobicContact CG2-CZ 3.86Å; W258-F277 HydrophobicContact CH2-CD2 4.45Å; I264-F277 HydrophobicContact CD1-CB 3.65Å; I264-F277 HydrophobicContact CD1-CD2 3.97Å; I264-F277 HydrophobicContact CD1-CG 4.27Å; T273-F277 VanDerWaalsContact O-CB 3.28Å; T273-F277 WeakPolarHBondContact O-CB 3.46Å; T273-F277 PolarHBondContact O-N 3.29Å; L274-F277 PolarHBondContact O-N 2.68Å; R275-F277 VanDerWaalsContact C-N 3.35Å; F277-K279 VanDerWaalsContact C-N 3.29Å; F277-K279 PolarHBondContact O-N 3.44Å; F277-F280 HydrophobicContact CD2-CD1 4.38Å; F277-F280 HydrophobicContact CE2-CD1 4.37Å; F277-F280 WeakPolarHBondContact O-CB 3.23Å; F277-F280 PolarHBondContact O-N 2.88Å; F277-F280 VanDerWaalsContact O-N 3.15Å; F277-R281 PolarHBondContact O-N 3.06Å; F277-V292 HydrophobicContact CE1-CG1 4.08Å; F277-V292 HydrophobicContact CZ-CG1 3.72Å; F277-L294 HydrophobicContact CD1-CB 4Å; F277-L294 HydrophobicContact CD2-CB 4.14Å; F277-L294 HydrophobicContact CD2-CD1 4.28Å; F277-L294 HydrophobicContact CD2-CD2 4.25Å; F277-L294 HydrophobicContact CD2-CG 4.47Å; F277-L294 HydrophobicContact CE1-CB 3.79Å; F277-L294 HydrophobicContact CE2-CB 3.94Å; F277-L294 HydrophobicContact CE2-CD1 3.96Å; F277-L294 HydrophobicContact CE2-CG 4.41Å; F277-L294 HydrophobicContact CG-CB 4.16Å; F277-L294 HydrophobicContact CG-CD2 4.39Å; F277-L294 HydrophobicContact CZ-CB 3.74Å; F277-L294 HydrophobicContact CZ-CD1 4.45Å; F277-I322 HydrophobicContact CB-CG2 4.4Å; F277-I322 HydrophobicContact CD1-CG2 4.16Å; F277-I322 HydrophobicContact CG-CG2 4.49Å
278	M	94.7	Very high	90.2	Very high	6 Å²	6	69.4 Å²	69.4	3%	0.03	32%	0.321	C	S	.	.	H	α-helix	trans	-69.8	-28.6	178.2	-67.8	-53.4	-64.7	0	0	112.7	L274 R275 R281 K282 Y309 T317	L274-M278 HydrophobicContact CD1-CG 4.02Å; L274-M278 WeakPolarHBondContact O-CG 3.31Å; L274-M278 PolarHBondContact O-N 3.36Å; R275-M278 PolarHBondContact O-N 3.41Å; M278-R281 PolarHBondContact O-N 2.87Å; M278-K282 PolarHBondContact O-N 3.15Å; M278-K282 VanDerWaalsContact O-N 3.15Å; M278-Y309 HydrophobicContact CB-CE2 4.29Å; M278-Y309 HydrophobicContact CG-CD2 4.14Å; M278-Y309 HydrophobicContact CG-CE2 3.78Å; M278-T317 WeakPolarHBondContact CB-O 2.98Å; M278-T317 WeakPolarHBondContact CE-O 3.42Å
279	K	93.4	Very high	90.5	Very high	126 Å²	126	66 Å²	66	55%	0.548	30%	0.304	S	S	.	.	H	α-helix	trans	-63.8	-46.9	167.5	-174.9	-178.4	175.7	-174.8	0	111.1	R275 D276 F277 R281 K282 E283	R275-K279 PolarHBondContact O-N 2.89Å; R275-K279 VanDerWaalsContact O-N 3.09Å; D276-K279 WeakPolarHBondContact O-CB 3.08Å; D276-K279 PolarHBondContact O-N 3.24Å; F277-K279 VanDerWaalsContact C-N 3.29Å; F277-K279 PolarHBondContact O-N 3.44Å; K279-R281 VanDerWaalsContact C-N 3.34Å; K279-R281 PolarHBondContact O-N 3.34Å; K279-K282 PolarHBondContact O-N 2.71Å; K279-E283 WeakPolarHBondContact CE-OE1 2.89Å; K279-E283 WeakPolarHBondContact CG-OE1 3.36Å; K279-E283 WeakPolarHBondContact O-CG 2.96Å; K279-E283 PolarHBondContact O-N 2.84Å; K279-E283 VanDerWaalsContact O-N 3.14Å
280	F	93.9	Very high	90.8	Very high	22 Å²	22	62.7 Å²	62.7	10%	0.096	29%	0.286	C	S	.	.	H	α-helix	trans	-58.4	-43.6	174.5	169.6	-95.9	0	0	0	112.2	W258 R263 I264 D276 F277 K282 E283 S284 I285	W258-F280 HydrophobicContact CZ2-CD1 4.16Å; W258-F280 AromaticContact CZ2-CE1 3.75Å; W258-F280 HydrophobicContact CZ2-CE1 3.75Å; W258-F280 HydrophobicContact CZ2-CZ 4.01Å; R263-F280 HydrophobicContact CB-CD2 4.03Å; R263-F280 HydrophobicContact CB-CE2 3.59Å; R263-F280 HydrophobicContact CB-CZ 4.08Å; R263-F280 HydrophobicContact CG-CE2 4.11Å; R263-F280 HydrophobicContact CG-CZ 4.3Å; I264-F280 HydrophobicContact CG2-CB 3.53Å; I264-F280 HydrophobicContact CG2-CD2 4.31Å; I264-F280 HydrophobicContact CG2-CG 3.95Å; D276-F280 PolarHBondContact O-N 2.95Å; F277-F280 HydrophobicContact CD2-CD1 4.38Å; F277-F280 HydrophobicContact CE2-CD1 4.37Å; F277-F280 WeakPolarHBondContact O-CB 3.23Å; F277-F280 PolarHBondContact O-N 2.88Å; F277-F280 VanDerWaalsContact O-N 3.15Å; F280-K282 VanDerWaalsContact C-N 3.34Å; F280-K282 PolarHBondContact O-N 2.67Å; F280-E283 PolarHBondContact O-N 3.37Å; F280-S284 VanDerWaalsContact CE2-CB 3.43Å; F280-S284 WeakPolarHBondContact CE2-OG 3.24Å; F280-S284 WeakPolarHBondContact O-CB 3.17Å; F280-S284 PolarHBondContact O-N 3.32Å; F280-I285 HydrophobicContact CD1-CD1 4.2Å; F280-I285 HydrophobicContact CD1-CG1 4.45Å; F280-I285 HydrophobicContact CE1-CD1 3.91Å; F280-I285 HydrophobicContact CE1-CG1 3.95Å
281	R	94	Very high	91.2	Very high	7 Å²	7	62.4 Å²	62.4	3%	0.026	28%	0.284	C	S	.	.	H	α-helix	trans	-53.4	-51.5	174.6	178.6	-173.5	179.3	-161.4	-0.2	111.1	F277 M278 K279 E283 I285 C289 V292 S315 L316 G319	F277-R281 PolarHBondContact O-N 3.06Å; M278-R281 PolarHBondContact O-N 2.87Å; K279-R281 VanDerWaalsContact C-N 3.34Å; K279-R281 PolarHBondContact O-N 3.34Å; R281-E283 VanDerWaalsContact C-N 3.28Å; R281-E283 PolarHBondContact O-N 3.38Å; R281-I285 HydrophobicContact CB-CD1 4.13Å; R281-I285 HydrophobicContact CG-CB 4.3Å; R281-I285 HydrophobicContact CG-CD1 4.17Å; R281-I285 WeakPolarHBondContact O-CB 2.97Å; R281-I285 PolarHBondContact O-N 2.87Å; R281-I285 VanDerWaalsContact O-N 3.09Å; R281-C289 PolarHBondContact NH2-O 2.99Å; R281-C289 VanDerWaalsContact NH2-O 3.09Å; R281-V292 HydrophobicContact CG-CG2 4.05Å; R281-S315 PolarHBondContact NH1-O 2.88Å; R281-L316 WeakPolarHBondContact CD-O 3.05Å; R281-L316 PolarHBondContact NH1-O 3.11Å; R281-G319 VanDerWaalsContact NH1-C 3.28Å; R281-G319 VanDerWaalsContact NH1-CA 3.34Å; R281-G319 PolarHBondContact NH1-O 3.5Å
282	K	91.8	Very high	91.6	Very high	129 Å²	129	59.8 Å²	59.8	56%	0.561	27%	0.27	S	S	*	.	H	α-helix	trans	-59.8	-38	-178.3	-172.7	-171.8	-177.1	177.8	0	112.6	M278 K279 F280 L316 T317	M278-K282 PolarHBondContact O-N 3.15Å; M278-K282 VanDerWaalsContact O-N 3.15Å; K279-K282 PolarHBondContact O-N 2.71Å; F280-K282 VanDerWaalsContact C-N 3.34Å; F280-K282 PolarHBondContact O-N 2.67Å; K282-L316 HydrophobicContact CG-CD2 4.12Å; K282-L316 HydrophobicContact CG-CG 4.48Å; K282-T317 HydrophobicContact CD-CG2 3.92Å; K282-T317 HydrophobicContact CG-CG2 4.44Å
283	E	91.7	Very high	92	Very high	129 Å²	129	55.9 Å²	55.9	60%	0.603	25%	0.25	S	C	*	.	H	α-helix	trans	-89.1	-36.1	-172.6	-68.1	172.9	-175.4	0	0	113.1	K279 F280 R281	K279-E283 WeakPolarHBondContact CE-OE1 2.89Å; K279-E283 WeakPolarHBondContact CG-OE1 3.36Å; K279-E283 WeakPolarHBondContact O-CG 2.96Å; K279-E283 PolarHBondContact O-N 2.84Å; K279-E283 VanDerWaalsContact O-N 3.14Å; F280-E283 PolarHBondContact O-N 3.37Å; R281-E283 VanDerWaalsContact C-N 3.28Å; R281-E283 PolarHBondContact O-N 3.38Å
284	S	88.3	Confident	92.2	Very high	64 Å²	64	55.8 Å²	55.8	45%	0.448	25%	0.249	S	C	.	.	H	α-helix	trans	-114.4	-30.4	-167.2	-58.1	0	0	0	0	114.5	F280 K286	F280-S284 VanDerWaalsContact CE2-CB 3.43Å; F280-S284 WeakPolarHBondContact CE2-OG 3.24Å; F280-S284 WeakPolarHBondContact O-CB 3.17Å; F280-S284 PolarHBondContact O-N 3.32Å; S284-K286 PolarHBondContact O-N 3.25Å
285	I	88.1	Confident	92.3	Very high	12 Å²	12	55.8 Å²	55.8	6%	0.062	25%	0.249	C	C	.	.			trans	-91.3	110.9	-175.1	-60.5	173.9	0	0	0	109.9	M209 V211 F280 R281 Q287 V292	M209-I285 HydrophobicContact CE-CD1 4Å; M209-I285 HydrophobicContact CE-CG1 4.25Å; M209-I285 HydrophobicContact CE-CG2 4.05Å; M209-I285 HydrophobicContact SD-CD1 4.29Å; M209-I285 HydrophobicContact SD-CG2 3.54Å; M209-I285 VanDerWaalsContact SD-CG2 3.54Å; V211-I285 HydrophobicContact CG2-CD1 4.33Å; F280-I285 HydrophobicContact CD1-CD1 4.2Å; F280-I285 HydrophobicContact CD1-CG1 4.45Å; F280-I285 HydrophobicContact CE1-CD1 3.91Å; F280-I285 HydrophobicContact CE1-CG1 3.95Å; R281-I285 HydrophobicContact CB-CD1 4.13Å; R281-I285 HydrophobicContact CG-CB 4.3Å; R281-I285 HydrophobicContact CG-CD1 4.17Å; R281-I285 WeakPolarHBondContact O-CB 2.97Å; R281-I285 PolarHBondContact O-N 2.87Å; R281-I285 VanDerWaalsContact O-N 3.09Å; I285-Q287 HydrophobicContact CG2-CB 4.38Å; I285-V292 HydrophobicContact CD1-CG1 3.98Å
286	K	85.7	Confident	92.4	Very high	194 Å²	194	49.3 Å²	49.3	84%	0.843	23%	0.225	S	C	*	.			trans	-95.1	-10.1	178.9	-60.8	-176.7	-178.4	178.4	0	114.5	S284	S284-K286 PolarHBondContact O-N 3.25Å
287	Q	83.5	Confident	92.1	Very high	55 Å²	55	47 Å²	47	26%	0.257	21%	0.214	S	C	.	.	S	Bend	trans	-68.2	136.1	-178.5	-169.8	64.6	34.6	0	0	110	M209 A254 I285 C289	M209-Q287 HydrophobicContact SD-CB 4.44Å; A254-Q287 HydrophobicContact CB-CG 4.01Å; I285-Q287 HydrophobicContact CG2-CB 4.38Å; Q287-C289 PolarHBondContact O-N 3.34Å; Q287-C289 PolarHBondContact O-SG 3.12Å
288	R	83.9	Confident	91.6	Very high	215 Å²	215	51.7 Å²	51.7	81%	0.811	23%	0.231	S	C	*	.			trans	-73.5	125.1	171.1	-66.8	-172.6	179	-170.8	-0.3	109.2
289	C	89.9	Confident	91	Very high	15 Å²	15	56 Å²	56	10%	0.101	26%	0.258	C	S	.	.			trans	-160.7	147.9	-178.7	50.4	0	0	0	0	108.7	M209 V253 R281 Q287 V292	M209-C289 HydrophobicContact CB-CB 4.24Å; V253-C289 HydrophobicContact CG2-CB 3.71Å; R281-C289 PolarHBondContact NH2-O 2.99Å; R281-C289 VanDerWaalsContact NH2-O 3.09Å; Q287-C289 PolarHBondContact O-N 3.34Å; Q287-C289 PolarHBondContact O-SG 3.12Å; C289-V292 WeakPolarHBondContact SG-CG2 3.42Å
290	D	94.1	Very high	90.5	Very high	9 Å²	9	50.7 Å²	50.7	5%	0.048	24%	0.235	C	C	.	.	S	Bend	trans	-76.4	-42.2	-179.4	-59.4	-30.8	0	0	0	111	E207 I313 C314 C398 L399	E207-D290 HydrophobicContact CB-CB 4.34Å; E207-D290 WeakPolarHBondContact CB-OD2 3.31Å; E207-D290 PolarHBondContact N-OD2 3.32Å; E207-D290 PolarHBondContact O-N 2.83Å; D290-I313 HydrophobicContact CB-CD1 3.8Å; D290-I313 HydrophobicContact CB-CG1 4.43Å; D290-C314 PolarHBondContact O-N 3.49Å; D290-C398 VanDerWaalsContact OD1-CB 3.29Å; D290-C398 WeakPolarHBondContact OD1-CB 3.42Å; D290-C398 PolarHBondContact OD1-SG 2.85Å; D290-L399 HydrophobicContact CB-CD2 4.35Å
291	A	96.4	Very high	89.4	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	149	178.7	0	0	0	0	0	112.4	I206 E207 L208 M209 I313 G319 L339	I206-A291 HydrophobicContact CG2-CB 4.48Å; E207-A291 PolarHBondContact O-N 3.05Å; L208-A291 HydrophobicContact CD1-CB 4.12Å; M209-A291 PolarHBondContact N-O 2.78Å; A291-I313 HydrophobicContact CB-CD1 3.73Å; A291-G319 CarbonylContact C-O 3.07Å; A291-G319 VanDerWaalsContact CA-O 3.27Å; A291-G319 WeakPolarHBondContact CA-O 3.22Å; A291-L339 HydrophobicContact CB-CD2 4.11Å
292	V	97	Very high	88.1	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	125.2	173.3	-171.1	0	0	0	0	109.5	M209 V211 F277 R281 I285 C289 G319 G320 G321	M209-V292 HydrophobicContact CB-CG1 4.25Å; M209-V292 HydrophobicContact CB-CG2 4.17Å; M209-V292 HydrophobicContact CG-CG1 4.16Å; M209-V292 CarbonylContact O-C 3.48Å; M209-V292 VanDerWaalsContact O-CA 3.32Å; M209-V292 WeakPolarHBondContact O-CA 3.28Å; M209-V292 HydrophobicContact SD-CG1 4.44Å; V211-V292 HydrophobicContact CG2-CG1 4.03Å; F277-V292 HydrophobicContact CE1-CG1 4.08Å; F277-V292 HydrophobicContact CZ-CG1 3.72Å; R281-V292 HydrophobicContact CG-CG2 4.05Å; I285-V292 HydrophobicContact CD1-CG1 3.98Å; C289-V292 WeakPolarHBondContact SG-CG2 3.42Å; V292-G319 PolarHBondContact N-O 3.07Å; V292-G320 WeakPolarHBondContact O-CA 2.87Å; V292-G321 PolarHBondContact O-N 2.84Å
293	H	97.7	Very high	86.9	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	134.5	-179.2	-73.2	-123.4	0	0	0	111.5	L208 M209 I210 V211 G321 L335 S338 L339 N342	L208-H293 HydrophobicContact CD1-CB 4.35Å; L208-H293 VanDerWaalsContact CD1-CD2 3.49Å; L208-H293 WeakPolarHBondContact CD1-CD2 3.31Å; M209-H293 PolarHBondContact O-N 3.47Å; I210-H293 WeakPolarHBondContact CA-O 3.47Å; I210-H293 HydrophobicContact CD1-CB 3.88Å; V211-H293 PolarHBondContact N-O 3.05Å; H293-G321 CarbonylContact C-O 3.51Å; H293-G321 VanDerWaalsContact CA-O 3.24Å; H293-G321 WeakPolarHBondContact CA-O 3.25Å; H293-L335 HydrophobicContact CB-CD1 4.31Å; H293-S338 PolarHBondContact CE1-OG 2.95Å; H293-S338 VanDerWaalsContact CE1-OG 3.24Å; H293-S338 PolarHBondContact ND1-OG 3.33Å; H293-S338 VanDerWaalsContact ND1-OG 3.15Å; H293-L339 VanDerWaalsContact NE2-CD2 3.26Å; H293-L339 WeakPolarHBondContact NE2-CD2 3.49Å; H293-N342 PolarHBondContact CE1-OD1 3.39Å; H293-N342 PolarHBondContact NE2-OD1 2.81Å
294	L	97.1	Very high	86	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	130	170	-175.3	66.5	0	0	0	109.3	V211 D213 W258 I264 I266 T273 F277 G321 I322 N323	V211-L294 HydrophobicContact CB-CD1 4.07Å; V211-L294 HydrophobicContact CG1-CD1 3.9Å; V211-L294 CarbonylContact O-C 3.44Å; V211-L294 WeakPolarHBondContact O-CA 3.48Å; D213-L294 HydrophobicContact CB-CD1 4.25Å; W258-L294 HydrophobicContact CH2-CD1 4.15Å; W258-L294 HydrophobicContact CZ3-CD1 4.13Å; I264-L294 HydrophobicContact CD1-CD2 4.07Å; I266-L294 HydrophobicContact CD1-CD2 4.43Å; T273-L294 HydrophobicContact CG2-CD2 4.25Å; F277-L294 HydrophobicContact CD1-CB 4Å; F277-L294 HydrophobicContact CD2-CB 4.14Å; F277-L294 HydrophobicContact CD2-CD1 4.28Å; F277-L294 HydrophobicContact CD2-CD2 4.25Å; F277-L294 HydrophobicContact CD2-CG 4.47Å; F277-L294 HydrophobicContact CE1-CB 3.79Å; F277-L294 HydrophobicContact CE2-CB 3.94Å; F277-L294 HydrophobicContact CE2-CD1 3.96Å; F277-L294 HydrophobicContact CE2-CG 4.41Å; F277-L294 HydrophobicContact CG-CB 4.16Å; F277-L294 HydrophobicContact CG-CD2 4.39Å; F277-L294 HydrophobicContact CZ-CB 3.74Å; F277-L294 HydrophobicContact CZ-CD1 4.45Å; L294-G321 PolarHBondContact N-O 3.29Å; L294-I322 HydrophobicContact CB-CB 4.14Å; L294-I322 HydrophobicContact CB-CG2 3.79Å; L294-I322 HydrophobicContact CD2-CG2 4.07Å; L294-I322 CarbonylContact O-C 3.56Å; L294-I322 WeakPolarHBondContact O-CA 3.36Å; L294-N323 PolarHBondContact O-N 3.2Å; L294-N323 PolarHBondContact O-ND2 3.18Å
295	F	96.4	Very high	85.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	111.9	168.3	-76.1	1.6	0	0	0	107.8	I210 V211 D213 L216 A231 V234 N323 M331 L335	I210-F295 HydrophobicContact CD1-CD1 4.44Å; I210-F295 HydrophobicContact CD1-CE1 3.86Å; I210-F295 HydrophobicContact CD1-CE2 4.2Å; I210-F295 HydrophobicContact CD1-CZ 3.72Å; I210-F295 HydrophobicContact CG1-CE2 4.44Å; I210-F295 HydrophobicContact CG1-CZ 4.4Å; I210-F295 HydrophobicContact CG2-CD1 4.46Å; I210-F295 HydrophobicContact CG2-CD2 3.62Å; I210-F295 HydrophobicContact CG2-CE2 3.87Å; I210-F295 HydrophobicContact CG2-CG 3.95Å; I210-F295 HydrophobicContact CG2-CZ 4.4Å; V211-F295 PolarHBondContact O-N 3.34Å; D213-F295 PolarHBondContact N-O 3.02Å; L216-F295 HydrophobicContact CD2-CB 3.58Å; A231-F295 HydrophobicContact CB-CD2 4.03Å; A231-F295 HydrophobicContact CB-CE2 4Å; V234-F295 HydrophobicContact CB-CE2 4.22Å; V234-F295 HydrophobicContact CB-CZ 4.41Å; V234-F295 HydrophobicContact CG1-CE2 4.02Å; V234-F295 HydrophobicContact CG1-CZ 3.74Å; F295-N323 HydrophobicContact CD1-CB 4.14Å; F295-N323 HydrophobicContact CE1-CB 4.34Å; F295-M331 HydrophobicContact CB-CE 3.53Å; F295-M331 HydrophobicContact CD1-CE 3.55Å; F295-M331 HydrophobicContact CD2-CE 3.72Å; F295-M331 HydrophobicContact CD2-SD 4.33Å; F295-M331 HydrophobicContact CE1-CE 4.1Å; F295-M331 HydrophobicContact CE2-CE 4.26Å; F295-M331 HydrophobicContact CG-CE 3.33Å; F295-M331 HydrophobicContact CG-SD 4.49Å; F295-M331 HydrophobicContact CZ-CE 4.43Å; F295-L335 HydrophobicContact CE1-CD1 4.2Å; F295-L335 HydrophobicContact CZ-CD2 4.14Å
296	S	93.3	Very high	85.6	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	133.1	-174.7	-174	0	0	0	0	112.1	D213 R298 N323 E324 F325	D213-S296 VanDerWaalsContact CG-CA 3.45Å; D213-S296 WeakPolarHBondContact OD2-CA 3.19Å; D213-S296 VanDerWaalsContact OD2-CB 3.27Å; D213-S296 WeakPolarHBondContact OD2-CB 3.27Å; D213-S296 PolarHBondContact OD2-OG 2.84Å; S296-R298 PolarHBondContact O-N 3.32Å; S296-R298 PolarHBondContact OG-N 3.4Å; S296-N323 PolarHBondContact N-O 3.2Å; S296-E324 CarbonylContact O-C 3.58Å; S296-F325 VanDerWaalsContact O-CB 3.3Å; S296-F325 WeakPolarHBondContact O-CB 3.34Å; S296-F325 PolarHBondContact O-N 3.13Å
297	G	87.8	Confident	85.9	Confident	5 Å²	5	43.5 Å²	43.5	5%	0.052	22%	0.221	C	C	.	.	S	Bend	trans	-71.7	-8	170.4	0	0	0	0	0	113.8	D213 Q219	D213-G297 PolarHBondContact OD1-N 3.39Å; D213-G297 PolarHBondContact OD2-N 1.99Å; Q219-G297 PolarHBondContact NE2-O 3.3Å
298	R	85.1	Confident	86.3	Confident	98 Å²	98	40.9 Å²	40.9	37%	0.37	21%	0.209	S	C	.	.	S	Bend	trans	-85.3	151.6	178.2	-66.1	-162	171.7	-163.8	-8.5	111.9	E215 I266 S296	E215-R298 HydrophobicContact CB-CG 4.27Å; E215-R298 HydrophobicContact CG-CG 3.85Å; E215-R298 IonicContact OE1-CZ 2.98Å; E215-R298 VanDerWaalsContact OE1-CZ 3.27Å; E215-R298 IonicContact OE1-NE 2.7Å; E215-R298 PolarHBondContact OE1-NE 3.48Å; E215-R298 IonicContact OE1-NH2 3.7Å; E215-R298 PolarHBondContact OE1-NH2 3.26Å; I266-R298 HydrophobicContact CG2-CB 4.39Å; I266-R298 HydrophobicContact CG2-CG 4.28Å; I266-R298 PolarHBondContact O-NH1 3.2Å; S296-R298 PolarHBondContact O-N 3.32Å; S296-R298 PolarHBondContact OG-N 3.4Å
299	T	82.3	Confident	86.7	Confident	97 Å²	97	32.5 Å²	32.5	60%	0.595	18%	0.178	S	C	*	.	P	Polyproline II helix	trans	-98.5	127.6	170.2	51.4	0	0	0	0	108.9
300	F	81.8	Confident	86.8	Confident	13 Å²	13	32.8 Å²	32.8	6%	0.057	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-81.4	145.7	-177.8	-61.7	-65.9	0	0	0	111	A270 T273 S302 I322 E324	A270-F300 HydrophobicContact CB-CB 4.23Å; A270-F300 HydrophobicContact CB-CD1 4.06Å; A270-F300 HydrophobicContact CB-CD2 4.1Å; A270-F300 HydrophobicContact CB-CG 3.85Å; T273-F300 HydrophobicContact CG2-CE1 4.42Å; F300-S302 PolarHBondContact O-N 3.02Å; F300-I322 HydrophobicContact CE1-CD1 4.02Å; F300-I322 HydrophobicContact CE2-CD1 3.97Å; F300-I322 HydrophobicContact CE2-CG1 4.27Å; F300-I322 HydrophobicContact CZ-CD1 3.52Å; F300-I322 HydrophobicContact CZ-CG1 4.22Å; F300-E324 HydrophobicContact CD2-CB 3.92Å; F300-E324 HydrophobicContact CE2-CB 4.02Å
301	M	71.1	Confident	86.6	Confident	157 Å²	157	33 Å²	33	77%	0.773	18%	0.182	S	C	*	.	S	Bend	trans	-81.1	45.5	175.1	-70.2	-171.8	74.3	0	0	111.5	D268	D268-M301 HydrophobicContact CB-CB 3.96Å; D268-M301 HydrophobicContact CB-CG 3.78Å; D268-M301 HydrophobicContact CB-SD 4.07Å; D268-M301 PolarHBondContact O-N 2.81Å
302	S	67.9	Low	86.3	Confident	51 Å²	51	33 Å²	33	36%	0.357	18%	0.183	S	C	.	.	S	Bend	trans	-126.8	162.5	177	95.1	0	0	0	0	109.2	F300 R304	F300-S302 PolarHBondContact O-N 3.02Å; S302-R304 PolarHBondContact O-N 2.93Å; S302-R304 WeakPolarHBondContact OG-CA 3.35Å; S302-R304 WeakPolarHBondContact OG-CB 3.46Å; S302-R304 PolarHBondContact OG-N 1.97Å; S302-R304 PolarHBondContact OG-O 2.84Å
303	S	66.3	Low	86.2	Confident	107 Å²	107	33.5 Å²	33.5	75%	0.748	19%	0.185	S	C	*	.	S	Bend	trans	-67.8	0.9	170.4	50.6	0	0	0	0	113
304	R	72.9	Confident	85.8	Confident	53 Å²	53	35.7 Å²	35.7	20%	0.2	20%	0.2	C	C	.	.			trans	-120.6	135.7	-170.7	-44.6	-174.5	177.3	151.9	-1.5	110	S302 E306 D608	S302-R304 PolarHBondContact O-N 2.93Å; S302-R304 WeakPolarHBondContact OG-CA 3.35Å; S302-R304 WeakPolarHBondContact OG-CB 3.46Å; S302-R304 PolarHBondContact OG-N 1.97Å; S302-R304 PolarHBondContact OG-O 2.84Å; R304-E306 VanDerWaalsContact C-N 3.33Å; R304-D608 IonicContact CZ-OD1 2.73Å; R304-D608 PolarHBondContact NH1-O 3.41Å; R304-D608 IonicContact NH1-OD1 3.58Å; R304-D608 IonicContact NH2-OD1 3.77Å; R304-D608 PolarHBondContact NH2-OD1 3.46Å
305	S	81.1	Confident	85.4	Confident	27 Å²	27	37.5 Å²	37.5	19%	0.189	21%	0.213	C	C	.	.	S	Bend	trans	-92.8	2.4	177.3	-63.4	0	0	0	0	113	E324	S305-E324 WeakPolarHBondContact CA-OE2 3.41Å; S305-E324 WeakPolarHBondContact CB-OE2 3.13Å; S305-E324 WeakPolarHBondContact O-CB 3.3Å; S305-E324 PolarHBondContact O-N 3.03Å; S305-E324 VanDerWaalsContact OG-CD 3.23Å; S305-E324 PolarHBondContact OG-OE2 3.11Å
306	E	87.2	Confident	85	Confident	3 Å²	3	41.8 Å²	41.8	1%	0.014	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	157	179.9	84.1	-67.5	-171.7	0	0	112.3	R304 I322 Q337 R347	R304-E306 VanDerWaalsContact C-N 3.33Å; E306-I322 VanDerWaalsContact CA-O 3.24Å; E306-I322 WeakPolarHBondContact CA-O 3.44Å; E306-I322 WeakPolarHBondContact CB-O 3.45Å; E306-Q337 HydrophobicContact CG-CB 4.16Å; E306-Q337 VanDerWaalsContact OE1-CB 3.24Å; E306-Q337 WeakPolarHBondContact OE1-CB 3.46Å; E306-Q337 PolarHBondContact OE1-OE1 2.86Å; E306-R347 IonicContact OE1-CZ 3.49Å; E306-R347 IonicContact OE1-NH2 3.06Å; E306-R347 PolarHBondContact OE1-NH2 3.22Å; E306-R347 IonicContact OE2-NH2 2.71Å; E306-R347 PolarHBondContact OE2-NH2 2.81Å; E306-R347 VanDerWaalsContact OE2-NH2 3.17Å
307	A	90.6	Very high	84.8	Confident	8 Å²	8	44.9 Å²	44.9	7%	0.066	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	132.4	168.8	0	0	0	0	0	110.2	A270 L271 L274 G321 I322	A270-A307 HydrophobicContact CB-CB 3.9Å; L271-A307 HydrophobicContact CD2-CB 4.09Å; L274-A307 HydrophobicContact CD2-CB 4.21Å; A307-G321 CarbonylContact O-C 3.47Å; A307-G321 WeakPolarHBondContact O-CA 3.44Å; A307-I322 HydrophobicContact CB-CD1 4.48Å; A307-I322 HydrophobicContact CB-CG1 4.07Å; A307-I322 PolarHBondContact N-O 3.01Å; A307-I322 PolarHBondContact O-N 3.11Å
308	A	93.4	Very high	85	Confident	1 Å²	1	48 Å²	48	1%	0.008	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	153.4	176.3	0	0	0	0	0	111.3	G320 S338 Q341 D609	A308-G320 WeakPolarHBondContact CB-O 3.48Å; A308-S338 VanDerWaalsContact CB-O 3.29Å; A308-S338 WeakPolarHBondContact CB-O 3Å; A308-Q341 HydrophobicContact CB-CB 4.17Å; A308-Q341 PolarHBondContact O-OE1 3Å; A308-Q341 VanDerWaalsContact O-OE1 3.13Å; A308-D609 WeakPolarHBondContact O-CB 3.48Å
309	Y	92.3	Very high	85.4	Confident	39 Å²	39	43.4 Å²	43.4	15%	0.153	25%	0.247	C	C	.	.			trans	-77.1	129.3	177	-71.8	-60.8	0	0	0	111.4	L274 M278 G311 G312 R318 G320 N342 D609	L274-Y309 HydrophobicContact CD1-CD2 4.44Å; L274-Y309 HydrophobicContact CD1-CE2 4.39Å; L274-Y309 HydrophobicContact CD2-CD1 4.32Å; L274-Y309 HydrophobicContact CD2-CD2 4.07Å; L274-Y309 HydrophobicContact CD2-CE1 4.22Å; L274-Y309 HydrophobicContact CD2-CE2 4.02Å; L274-Y309 HydrophobicContact CD2-CG 4.24Å; L274-Y309 HydrophobicContact CG-CD2 4.24Å; L274-Y309 HydrophobicContact CG-CE2 3.89Å; M278-Y309 HydrophobicContact CB-CE2 4.29Å; M278-Y309 HydrophobicContact CG-CD2 4.14Å; M278-Y309 HydrophobicContact CG-CE2 3.78Å; Y309-G311 PolarHBondContact O-N 3.05Å; Y309-G312 PolarHBondContact O-N 3.02Å; Y309-R318 WeakPolarHBondContact CB-O 2.91Å; Y309-R318 HydrophobicContact CD2-CB 4.11Å; Y309-R318 HydrophobicContact CD2-CG 4.27Å; Y309-R318 HydrophobicContact CG-CB 4.2Å; Y309-R318 HydrophobicContact CG-CG 4.35Å; Y309-G320 PolarHBondContact N-O 2.92Å; Y309-N342 WeakPolarHBondContact O-CA 3.47Å; Y309-N342 PolarHBondContact O-ND2 3.35Å; Y309-D609 HydrophobicContact CD1-CB 3.95Å
310	I	90.9	Very high	86	Confident	21 Å²	21	38.8 Å²	38.8	11%	0.108	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	129.4	-176.1	-58.7	-179.1	0	0	0	110.3	G312 Q341 L346 L607 D609	I310-G312 PolarHBondContact O-N 3.03Å; I310-Q341 CarbonylContact C-O 3.55Å; I310-Q341 VanDerWaalsContact CA-O 3.28Å; I310-Q341 WeakPolarHBondContact CA-O 3.4Å; I310-Q341 HydrophobicContact CG1-CB 4.17Å; I310-Q341 HydrophobicContact CG1-CG 4.4Å; I310-L346 HydrophobicContact CD1-CD2 3.77Å; I310-L346 HydrophobicContact CG2-CD2 3.53Å; I310-L607 HydrophobicContact CD1-CB 4.09Å; I310-L607 HydrophobicContact CD1-CD1 4.1Å; I310-L607 HydrophobicContact CD1-CD2 4.13Å; I310-L607 HydrophobicContact CD1-CG 4.34Å; I310-D609 HydrophobicContact CG1-CB 4.49Å; I310-D609 PolarHBondContact N-OD2 3.34Å
311	G	89.9	Confident	86.7	Confident	12 Å²	12	38.1 Å²	38.1	12%	0.124	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	25.7	-177.4	0	0	0	0	0	113.2	Y309 Q341 N342	Y309-G311 PolarHBondContact O-N 3.05Å; G311-Q341 PolarHBondContact N-O 3.46Å; G311-N342 CarbonylContact C-O 3.3Å; G311-N342 VanDerWaalsContact C-O 3.24Å; G311-N342 WeakPolarHBondContact CA-O 3.41Å; G311-N342 PolarHBondContact N-O 3.33Å
312	G	90.6	Very high	87.8	Confident	2 Å²	2	30.7 Å²	30.7	2%	0.021	18%	0.179	C	C	.	.			trans	-83.1	-11.5	-176.4	0	0	0	0	0	115.2	Y309 I310 S315 R318 G319 N342	Y309-G312 PolarHBondContact O-N 3.02Å; I310-G312 PolarHBondContact O-N 3.03Å; G312-S315 WeakPolarHBondContact O-CB 3.44Å; G312-S315 PolarHBondContact O-N 3.43Å; G312-R318 WeakPolarHBondContact CA-O 3.22Å; G312-R318 CarbonylContact O-C 3.6Å; G312-G319 WeakPolarHBondContact O-CA 3.43Å; G312-G319 PolarHBondContact O-N 3.15Å; G312-N342 PolarHBondContact N-O 3.17Å; G312-N342 VanDerWaalsContact N-O 3.1Å
313	I	94.3	Very high	89	Confident	9 Å²	9	28.2 Å²	28.2	5%	0.046	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	146	-179	-164.5	64.6	0	0	0	111.7	I206 D290 A291 S315 N342 I343 F390 L399	I206-I313 HydrophobicContact CG2-CD1 4.33Å; D290-I313 HydrophobicContact CB-CD1 3.8Å; D290-I313 HydrophobicContact CB-CG1 4.43Å; A291-I313 HydrophobicContact CB-CD1 3.73Å; I313-S315 PolarHBondContact O-N 3.04Å; I313-S315 VanDerWaalsContact O-N 3.15Å; I313-N342 HydrophobicContact CB-CB 4.34Å; I313-N342 WeakPolarHBondContact CB-O 3.5Å; I313-N342 WeakPolarHBondContact CG2-O 3.3Å; I313-N342 PolarHBondContact N-O 2.98Å; I313-I343 HydrophobicContact CB-CG2 4.37Å; I313-I343 HydrophobicContact CG1-CG2 4.34Å; I313-I343 HydrophobicContact CG2-CG2 4.39Å; I313-F390 HydrophobicContact CG2-CE1 3.72Å; I313-F390 HydrophobicContact CG2-CZ 3.58Å; I313-L399 HydrophobicContact CD1-CD2 4.21Å; I313-L399 HydrophobicContact CG1-CD1 4.26Å; I313-L399 HydrophobicContact CG1-CD2 3.78Å; I313-L399 HydrophobicContact CG1-CG 4.26Å
314	C	90.1	Very high	90.1	Very high	46 Å²	46	25 Å²	25	31%	0.311	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	-7.9	-173	-41.7	0	0	0	0	115.8	D290 C398	D290-C314 PolarHBondContact O-N 3.49Å; C314-C398 WeakPolarHBondContact CA-SG 3.49Å; C314-C398 HydrophobicContact CB-CB 3.74Å; C314-C398 WeakPolarHBondContact CB-SG 3.47Å; C314-C398 WeakPolarHBondContact SG-CB 3.45Å; C314-C398 PolarHBondContact SG-N 3.26Å; C314-C398 CovalentContact SG-SG 2.02Å; C314-C398 PolarHBondContact SG-SG 2.92Å
315	S	89.1	Confident	90.8	Very high	39 Å²	39	25.6 Å²	25.6	27%	0.273	14%	0.139	S	C	.	.			trans	-89.4	135.4	176.4	179.2	0	0	0	0	111.3	R281 G312 I313 T317 R318 G319	R281-S315 PolarHBondContact NH1-O 2.88Å; G312-S315 WeakPolarHBondContact O-CB 3.44Å; G312-S315 PolarHBondContact O-N 3.43Å; I313-S315 PolarHBondContact O-N 3.04Å; I313-S315 VanDerWaalsContact O-N 3.15Å; S315-T317 VanDerWaalsContact C-N 3.32Å; S315-T317 PolarHBondContact O-N 2.93Å; S315-T317 PolarHBondContact OG-N 3.18Å; S315-T317 PolarHBondContact OG-OG1 2.74Å; S315-R318 PolarHBondContact OG-N 3.18Å; S315-G319 VanDerWaalsContact O-CA 3.28Å; S315-G319 WeakPolarHBondContact O-CA 3.47Å; S315-G319 PolarHBondContact O-N 3.46Å
316	L	87.7	Confident	90.8	Very high	90 Å²	90	25.1 Å²	25.1	47%	0.471	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-33.4	173.9	-175.4	64.1	0	0	0	112.8	R281 K282	R281-L316 WeakPolarHBondContact CD-O 3.05Å; R281-L316 PolarHBondContact NH1-O 3.11Å; K282-L316 HydrophobicContact CG-CD2 4.12Å; K282-L316 HydrophobicContact CG-CG 4.48Å
317	T	88.9	Confident	90.5	Very high	64 Å²	64	27.2 Å²	27.2	39%	0.393	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-16	-176.2	52.7	0	0	0	0	113.5	M278 K282 S315	M278-T317 WeakPolarHBondContact CB-O 2.98Å; M278-T317 WeakPolarHBondContact CE-O 3.42Å; K282-T317 HydrophobicContact CD-CG2 3.92Å; K282-T317 HydrophobicContact CG-CG2 4.44Å; S315-T317 VanDerWaalsContact C-N 3.32Å; S315-T317 PolarHBondContact O-N 2.93Å; S315-T317 PolarHBondContact OG-N 3.18Å; S315-T317 PolarHBondContact OG-OG1 2.74Å
318	R	90.9	Very high	90.1	Very high	72 Å²	72	27.4 Å²	27.4	27%	0.272	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.6	-12.6	-177.5	-60.4	-172.5	68.5	-178.7	-2.4	115.1	Y309 G312 S315 G320 D609	Y309-R318 WeakPolarHBondContact CB-O 2.91Å; Y309-R318 HydrophobicContact CD2-CB 4.11Å; Y309-R318 HydrophobicContact CD2-CG 4.27Å; Y309-R318 HydrophobicContact CG-CB 4.2Å; Y309-R318 HydrophobicContact CG-CG 4.35Å; G312-R318 WeakPolarHBondContact CA-O 3.22Å; G312-R318 CarbonylContact O-C 3.6Å; S315-R318 PolarHBondContact OG-N 3.18Å; R318-G320 VanDerWaalsContact C-N 3.28Å; R318-G320 PolarHBondContact O-N 3.13Å; R318-D609 IonicContact NH2-OD2 2.93Å; R318-D609 PolarHBondContact NH2-OD2 3.12Å
319	G	94.1	Very high	89.5	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.154	C	C	.	.	S	Bend	trans	-76.7	73.6	-178.1	0	0	0	0	0	112.4	R281 A291 V292 G312 S315	R281-G319 VanDerWaalsContact NH1-C 3.28Å; R281-G319 VanDerWaalsContact NH1-CA 3.34Å; R281-G319 PolarHBondContact NH1-O 3.5Å; A291-G319 CarbonylContact C-O 3.07Å; A291-G319 VanDerWaalsContact CA-O 3.27Å; A291-G319 WeakPolarHBondContact CA-O 3.22Å; V292-G319 PolarHBondContact N-O 3.07Å; G312-G319 WeakPolarHBondContact O-CA 3.43Å; G312-G319 PolarHBondContact O-N 3.15Å; S315-G319 VanDerWaalsContact O-CA 3.28Å; S315-G319 WeakPolarHBondContact O-CA 3.47Å; S315-G319 PolarHBondContact O-N 3.46Å
320	G	95.3	Very high	89	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.7	176	179.6	0	0	0	0	0	114.2	V292 A308 Y309 R318 N342	V292-G320 WeakPolarHBondContact O-CA 2.87Å; A308-G320 WeakPolarHBondContact CB-O 3.48Å; Y309-G320 PolarHBondContact N-O 2.92Å; R318-G320 VanDerWaalsContact C-N 3.28Å; R318-G320 PolarHBondContact O-N 3.13Å; G320-N342 PolarHBondContact O-ND2 2.88Å
321	G	95.4	Very high	88.9	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	170.8	-177.7	0	0	0	0	0	112.2	V292 H293 L294 A307	V292-G321 PolarHBondContact O-N 2.84Å; H293-G321 CarbonylContact C-O 3.51Å; H293-G321 VanDerWaalsContact CA-O 3.24Å; H293-G321 WeakPolarHBondContact CA-O 3.25Å; L294-G321 PolarHBondContact N-O 3.29Å; A307-G321 CarbonylContact O-C 3.47Å; A307-G321 WeakPolarHBondContact O-CA 3.44Å
322	I	95.1	Very high	88.9	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	147	171.1	71.5	174.5	0	0	0	108.9	A270 T273 L274 F277 L294 F300 E306 A307	A270-I322 HydrophobicContact CB-CD1 3.99Å; A270-I322 WeakPolarHBondContact O-CD1 3.25Å; T273-I322 HydrophobicContact CG2-CD1 3.83Å; L274-I322 HydrophobicContact CB-CD1 4.32Å; L274-I322 HydrophobicContact CB-CG1 4.48Å; L274-I322 HydrophobicContact CB-CG2 4.23Å; L274-I322 HydrophobicContact CD1-CG2 4.1Å; F277-I322 HydrophobicContact CB-CG2 4.4Å; F277-I322 HydrophobicContact CD1-CG2 4.16Å; F277-I322 HydrophobicContact CG-CG2 4.49Å; L294-I322 HydrophobicContact CB-CB 4.14Å; L294-I322 HydrophobicContact CB-CG2 3.79Å; L294-I322 HydrophobicContact CD2-CG2 4.07Å; L294-I322 CarbonylContact O-C 3.56Å; L294-I322 WeakPolarHBondContact O-CA 3.36Å; F300-I322 HydrophobicContact CE1-CD1 4.02Å; F300-I322 HydrophobicContact CE2-CD1 3.97Å; F300-I322 HydrophobicContact CE2-CG1 4.27Å; F300-I322 HydrophobicContact CZ-CD1 3.52Å; F300-I322 HydrophobicContact CZ-CG1 4.22Å; E306-I322 VanDerWaalsContact CA-O 3.24Å; E306-I322 WeakPolarHBondContact CA-O 3.44Å; E306-I322 WeakPolarHBondContact CB-O 3.45Å; A307-I322 HydrophobicContact CB-CD1 4.48Å; A307-I322 HydrophobicContact CB-CG1 4.07Å; A307-I322 PolarHBondContact N-O 3.01Å; A307-I322 PolarHBondContact O-N 3.11Å
323	N	93.4	Very high	88.8	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	128.9	-174.8	-46.1	-99.5	0	0	0	108	L294 F295 S296 M331 T334 L335 S338	L294-N323 PolarHBondContact O-N 3.2Å; L294-N323 PolarHBondContact O-ND2 3.18Å; F295-N323 HydrophobicContact CD1-CB 4.14Å; F295-N323 HydrophobicContact CE1-CB 4.34Å; S296-N323 PolarHBondContact N-O 3.2Å; N323-M331 HydrophobicContact CB-CE 4.29Å; N323-T334 PolarHBondContact OD1-O 3Å; N323-L335 WeakPolarHBondContact OD1-CA 3.23Å; N323-L335 PolarHBondContact OD1-N 3.47Å; N323-S338 PolarHBondContact OD1-OG 3.37Å
324	E	89.9	Confident	88.6	Confident	39 Å²	39	25.9 Å²	25.9	18%	0.182	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	155.8	173	113.8	-179.8	-149	0	0	110.6	S296 F300 S305	S296-E324 CarbonylContact O-C 3.58Å; F300-E324 HydrophobicContact CD2-CB 3.92Å; F300-E324 HydrophobicContact CE2-CB 4.02Å; S305-E324 WeakPolarHBondContact CA-OE2 3.41Å; S305-E324 WeakPolarHBondContact CB-OE2 3.13Å; S305-E324 WeakPolarHBondContact O-CB 3.3Å; S305-E324 PolarHBondContact O-N 3.03Å; S305-E324 VanDerWaalsContact OG-CD 3.23Å; S305-E324 PolarHBondContact OG-OE2 3.11Å
325	F	85.6	Confident	88.8	Confident	65 Å²	65	23.7 Å²	23.7	29%	0.285	13%	0.133	S	C	.	.			trans	-69.5	132.3	176.9	173.1	-104.2	0	0	0	112.5	L216 F230 S296	L216-F325 HydrophobicContact CD1-CD2 3.36Å; L216-F325 HydrophobicContact CD1-CE2 3.85Å; L216-F325 HydrophobicContact CD1-CG 4.23Å; F230-F325 HydrophobicContact CE1-CD2 4.23Å; F230-F325 HydrophobicContact CE1-CE2 4.23Å; F230-F325 HydrophobicContact CE2-CE2 4.21Å; F230-F325 AromaticContact CZ-CD2 3.99Å; F230-F325 HydrophobicContact CZ-CD2 3.99Å; F230-F325 AromaticContact CZ-CE2 3.77Å; F230-F325 HydrophobicContact CZ-CE2 3.77Å; S296-F325 VanDerWaalsContact O-CB 3.3Å; S296-F325 WeakPolarHBondContact O-CB 3.34Å; S296-F325 PolarHBondContact O-N 3.13Å
326	G	81.9	Confident	89.1	Confident	18 Å²	18	21.9 Å²	21.9	19%	0.186	12%	0.12	C	C	.	.			trans	-144.2	-173.5	165	0	0	0	0	0	110	F230	F230-G326 VanDerWaalsContact CZ-O 3.29Å; F230-G326 WeakPolarHBondContact CZ-O 3.41Å
327	S	80.4	Confident	89.3	Confident	47 Å²	47	17.6 Å²	17.6	33%	0.329	10%	0.098	S	C	.	.			trans	-65.8	170.4	166.5	65.5	0	0	0	0	110.5	G329 P330 M331	S327-G329 PolarHBondContact O-N 3.31Å; S327-G329 VanDerWaalsContact O-N 3.11Å; S327-P330 WeakPolarHBondContact O-CD 3.41Å; S327-P330 WeakPolarHBondContact OG-CD 3.48Å; S327-P330 WeakPolarHBondContact OG-CG 3.43Å; S327-M331 WeakPolarHBondContact O-CB 3.45Å; S327-M331 PolarHBondContact O-N 3.18Å; S327-M331 VanDerWaalsContact O-N 3.07Å
328	V	83.1	Confident	89.5	Confident	12 Å²	12	14.6 Å²	14.6	7%	0.073	8%	0.079	C	C	.	.	H	α-helix	trans	-53.1	-39.8	-173.8	175.6	0	0	0	0	112.2	F230 V234 A332	F230-V328 HydrophobicContact CD2-CG2 3.87Å; F230-V328 HydrophobicContact CE2-CG2 3.88Å; V234-V328 HydrophobicContact CG2-CB 4.49Å; V234-V328 HydrophobicContact CG2-CG1 4.25Å; V328-A332 VanDerWaalsContact O-CB 3.25Å; V328-A332 WeakPolarHBondContact O-CB 3.38Å; V328-A332 PolarHBondContact O-N 3.25Å
329	G	80.9	Confident	89.8	Confident	1 Å²	1	11.1 Å²	11.1	1%	0.01	7%	0.066	C	C	.	.	H	α-helix	trans	-64.5	-65.2	179.9	0	0	0	0	0	114.9	M120 S327 M331 A332 I333	M120-G329 WeakPolarHBondContact SD-CA 2.95Å; S327-G329 PolarHBondContact O-N 3.31Å; S327-G329 VanDerWaalsContact O-N 3.11Å; G329-M331 PolarHBondContact O-N 2.76Å; G329-A332 WeakPolarHBondContact O-CB 3.49Å; G329-A332 PolarHBondContact O-N 3.1Å; G329-A332 VanDerWaalsContact O-N 3.07Å; G329-I333 PolarHBondContact O-N 2.79Å; G329-I333 VanDerWaalsContact O-N 3.13Å
330	P	82.6	Confident	89.8	Confident	39 Å²	39	11.1 Å²	11.1	25%	0.253	7%	0.066	S	C	.	.	H	α-helix	trans	-51.7	-43.7	176.4	-24.6	31.5	0	0	0	112.8	S327 A332 I333 T334 L375	S327-P330 WeakPolarHBondContact O-CD 3.41Å; S327-P330 WeakPolarHBondContact OG-CD 3.48Å; S327-P330 WeakPolarHBondContact OG-CG 3.43Å; P330-A332 VanDerWaalsContact C-N 3.32Å; P330-A332 PolarHBondContact O-N 3.28Å; P330-I333 WeakPolarHBondContact O-CB 3.12Å; P330-I333 PolarHBondContact O-N 3.25Å; P330-I333 VanDerWaalsContact O-N 3.12Å; P330-T334 PolarHBondContact O-N 3.37Å; P330-L375 HydrophobicContact CB-CD2 4Å; P330-L375 HydrophobicContact CG-CD1 4.17Å; P330-L375 HydrophobicContact CG-CD2 4Å
331	M	87.4	Confident	89.7	Confident	1 Å²	1	11.3 Å²	11.3	1%	0.005	7%	0.067	C	C	.	.	H	α-helix	trans	-68.8	-30.8	-179.6	-161.1	176.6	-164.6	0	0	112.9	F230 V234 F295 N323 S327 G329 I333 T334 L335	F230-M331 HydrophobicContact CE1-CE 4.49Å; F230-M331 HydrophobicContact CE1-SD 3.39Å; F230-M331 WeakPolarHBondContact CE1-SD 3.39Å; F230-M331 HydrophobicContact CZ-SD 3.49Å; F230-M331 WeakPolarHBondContact CZ-SD 2.98Å; V234-M331 HydrophobicContact CG1-CB 4.21Å; V234-M331 HydrophobicContact CG1-CG 4.08Å; V234-M331 HydrophobicContact CG2-CB 4.05Å; V234-M331 HydrophobicContact CG2-CG 4.29Å; V234-M331 HydrophobicContact CG2-SD 4.12Å; F295-M331 HydrophobicContact CB-CE 3.53Å; F295-M331 HydrophobicContact CD1-CE 3.55Å; F295-M331 HydrophobicContact CD2-CE 3.72Å; F295-M331 HydrophobicContact CD2-SD 4.33Å; F295-M331 HydrophobicContact CE1-CE 4.1Å; F295-M331 HydrophobicContact CE2-CE 4.26Å; F295-M331 HydrophobicContact CG-CE 3.33Å; F295-M331 HydrophobicContact CG-SD 4.49Å; F295-M331 HydrophobicContact CZ-CE 4.43Å; N323-M331 HydrophobicContact CB-CE 4.29Å; S327-M331 WeakPolarHBondContact O-CB 3.45Å; S327-M331 PolarHBondContact O-N 3.18Å; S327-M331 VanDerWaalsContact O-N 3.07Å; G329-M331 PolarHBondContact O-N 2.76Å; M331-I333 VanDerWaalsContact C-N 3.32Å; M331-T334 WeakPolarHBondContact CA-OG1 3.22Å; M331-T334 PolarHBondContact O-OG1 2.53Å; M331-L335 WeakPolarHBondContact O-CB 3.07Å; M331-L335 PolarHBondContact O-N 3.34Å
332	A	90.6	Very high	89.7	Confident	0 Å²	0	11.3 Å²	11.3	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-67.6	-34.7	172.4	0	0	0	0	0	111.8	V234 M237 V328 G329 P330 C336	V234-A332 HydrophobicContact CG1-CB 4.29Å; M237-A332 HydrophobicContact CB-CB 3.74Å; M237-A332 HydrophobicContact CE-CB 4.32Å; M237-A332 HydrophobicContact CG-CB 3.67Å; M237-A332 HydrophobicContact SD-CB 3.65Å; V328-A332 VanDerWaalsContact O-CB 3.25Å; V328-A332 WeakPolarHBondContact O-CB 3.38Å; V328-A332 PolarHBondContact O-N 3.25Å; G329-A332 WeakPolarHBondContact O-CB 3.49Å; G329-A332 PolarHBondContact O-N 3.1Å; G329-A332 VanDerWaalsContact O-N 3.07Å; P330-A332 VanDerWaalsContact C-N 3.32Å; P330-A332 PolarHBondContact O-N 3.28Å; A332-C336 WeakPolarHBondContact O-CB 3.29Å; A332-C336 PolarHBondContact O-N 2.97Å; A332-C336 PolarHBondContact O-SG 2.57Å
333	I	88.1	Confident	89.7	Confident	3 Å²	3	11.3 Å²	11.3	2%	0.015	7%	0.067	C	C	.	.	H	α-helix	trans	-69.2	-44.8	174.6	-60	-47.4	0	0	0	111.2	I241 G329 P330 M331 L335 C336 Q337 T371 L375 P376	I241-I333 HydrophobicContact CD1-CD1 3.68Å; G329-I333 PolarHBondContact O-N 2.79Å; G329-I333 VanDerWaalsContact O-N 3.13Å; P330-I333 WeakPolarHBondContact O-CB 3.12Å; P330-I333 PolarHBondContact O-N 3.25Å; P330-I333 VanDerWaalsContact O-N 3.12Å; M331-I333 VanDerWaalsContact C-N 3.32Å; I333-L335 VanDerWaalsContact C-N 3.3Å; I333-L335 PolarHBondContact O-N 3.29Å; I333-C336 CarbonylContact O-C 3.44Å; I333-C336 WeakPolarHBondContact O-CA 3.4Å; I333-C336 WeakPolarHBondContact O-CB 3.09Å; I333-C336 PolarHBondContact O-N 3.14Å; I333-Q337 WeakPolarHBondContact O-CG 3.42Å; I333-Q337 PolarHBondContact O-N 2.84Å; I333-T371 HydrophobicContact CG2-CG2 3.92Å; I333-L375 HydrophobicContact CG1-CB 4.39Å; I333-L375 HydrophobicContact CG1-CD2 4.04Å; I333-P376 WeakPolarHBondContact CD1-O 3.38Å; I333-P376 HydrophobicContact CG2-CG 3.77Å
334	T	90.2	Very high	89.6	Confident	8 Å²	8	11.8 Å²	11.8	5%	0.049	7%	0.072	C	C	.	.	H	α-helix	trans	-64.4	-36.2	176.6	59.8	0	0	0	0	111.8	N323 P330 M331 Q337 S338	N323-T334 PolarHBondContact OD1-O 3Å; P330-T334 PolarHBondContact O-N 3.37Å; M331-T334 WeakPolarHBondContact CA-OG1 3.22Å; M331-T334 PolarHBondContact O-OG1 2.53Å; T334-Q337 WeakPolarHBondContact O-CB 3.45Å; T334-Q337 PolarHBondContact O-N 3.42Å; T334-S338 WeakPolarHBondContact O-CB 3.48Å; T334-S338 PolarHBondContact O-N 3.45Å; T334-S338 PolarHBondContact O-OG 3.3Å; T334-S338 VanDerWaalsContact O-OG 3.09Å
335	L	94.7	Very high	89.6	Confident	0 Å²	0	9.9 Å²	9.9	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-62.3	-44	169.1	178.5	62.2	0	0	0	111.8	L208 V234 V235 A238 H293 F295 N323 M331 I333 Q337 S338 L339	L208-L335 HydrophobicContact CD2-CD1 4.47Å; L208-L335 HydrophobicContact CD2-CD2 4.41Å; V234-L335 HydrophobicContact CG1-CB 4.46Å; V234-L335 HydrophobicContact CG1-CD2 4.16Å; V235-L335 HydrophobicContact CG2-CD2 3.86Å; A238-L335 HydrophobicContact CB-CD2 3.78Å; A238-L335 HydrophobicContact CB-CG 4.26Å; H293-L335 HydrophobicContact CB-CD1 4.31Å; F295-L335 HydrophobicContact CE1-CD1 4.2Å; F295-L335 HydrophobicContact CZ-CD2 4.14Å; N323-L335 WeakPolarHBondContact OD1-CA 3.23Å; N323-L335 PolarHBondContact OD1-N 3.47Å; M331-L335 WeakPolarHBondContact O-CB 3.07Å; M331-L335 PolarHBondContact O-N 3.34Å; I333-L335 VanDerWaalsContact C-N 3.3Å; I333-L335 PolarHBondContact O-N 3.29Å; L335-Q337 VanDerWaalsContact C-N 3.29Å; L335-Q337 PolarHBondContact O-N 2.82Å; L335-S338 WeakPolarHBondContact CA-OG 3.49Å; L335-S338 PolarHBondContact O-N 3.27Å; L335-S338 PolarHBondContact O-OG 2.03Å; L335-S338 VanDerWaalsContact O-OG 3.06Å; L335-L339 HydrophobicContact CD1-CD1 3.81Å; L335-L339 HydrophobicContact CD1-CG 3.98Å; L335-L339 HydrophobicContact CG-CD1 3.91Å; L335-L339 HydrophobicContact CG-CG 4.47Å; L335-L339 WeakPolarHBondContact O-CB 3.28Å; L335-L339 WeakPolarHBondContact O-CG 3.28Å; L335-L339 PolarHBondContact O-N 3.49Å
336	C	94.4	Very high	89.5	Confident	0 Å²	0	7.6 Å²	7.6	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-61.9	-38.2	177.2	-73.9	0	0	0	0	112.2	Y242 A332 I333 G340 I367 F379	Y242-C336 HydrophobicContact CE2-CB 3.86Å; Y242-C336 PolarHBondContact OH-O 3.16Å; A332-C336 WeakPolarHBondContact O-CB 3.29Å; A332-C336 PolarHBondContact O-N 2.97Å; A332-C336 PolarHBondContact O-SG 2.57Å; I333-C336 CarbonylContact O-C 3.44Å; I333-C336 WeakPolarHBondContact O-CA 3.4Å; I333-C336 WeakPolarHBondContact O-CB 3.09Å; I333-C336 PolarHBondContact O-N 3.14Å; C336-G340 WeakPolarHBondContact O-CA 3.43Å; C336-G340 PolarHBondContact O-N 3.02Å; C336-I367 HydrophobicContact CB-CG2 3.9Å; C336-F379 HydrophobicContact CB-CZ 4.41Å
337	Q	92	Very high	89.2	Confident	1 Å²	1	8 Å²	8	1%	0.005	5%	0.049	C	C	.	.	H	α-helix	trans	-65.5	-51	175.4	-76.3	169.9	-40.7	0	0	111.9	E306 I333 T334 L335 G340 Q341 I367 E369 T371	E306-Q337 HydrophobicContact CG-CB 4.16Å; E306-Q337 VanDerWaalsContact OE1-CB 3.24Å; E306-Q337 WeakPolarHBondContact OE1-CB 3.46Å; E306-Q337 PolarHBondContact OE1-OE1 2.86Å; I333-Q337 WeakPolarHBondContact O-CG 3.42Å; I333-Q337 PolarHBondContact O-N 2.84Å; T334-Q337 WeakPolarHBondContact O-CB 3.45Å; T334-Q337 PolarHBondContact O-N 3.42Å; L335-Q337 VanDerWaalsContact C-N 3.29Å; L335-Q337 PolarHBondContact O-N 2.82Å; Q337-G340 WeakPolarHBondContact O-CA 3.05Å; Q337-G340 PolarHBondContact O-N 3.07Å; Q337-G340 VanDerWaalsContact O-N 3.09Å; Q337-Q341 WeakPolarHBondContact O-CG 3.29Å; Q337-Q341 PolarHBondContact O-N 2.7Å; Q337-I367 VanDerWaalsContact CD-O 3.26Å; Q337-I367 HydrophobicContact CG-CG2 3.71Å; Q337-I367 WeakPolarHBondContact CG-O 3.48Å; Q337-I367 PolarHBondContact NE2-O 3.46Å; Q337-E369 PolarHBondContact NE2-O 2.68Å; Q337-T371 VanDerWaalsContact NE2-CG2 3.27Å
338	S	94.1	Very high	88.5	Confident	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-64	-43.5	-178.7	61.1	0	0	0	0	111.8	H293 A308 N323 T334 L335 G340 Q341 N342	H293-S338 PolarHBondContact CE1-OG 2.95Å; H293-S338 VanDerWaalsContact CE1-OG 3.24Å; H293-S338 PolarHBondContact ND1-OG 3.33Å; H293-S338 VanDerWaalsContact ND1-OG 3.15Å; A308-S338 VanDerWaalsContact CB-O 3.29Å; A308-S338 WeakPolarHBondContact CB-O 3Å; N323-S338 PolarHBondContact OD1-OG 3.37Å; T334-S338 WeakPolarHBondContact O-CB 3.48Å; T334-S338 PolarHBondContact O-N 3.45Å; T334-S338 PolarHBondContact O-OG 3.3Å; T334-S338 VanDerWaalsContact O-OG 3.09Å; L335-S338 WeakPolarHBondContact CA-OG 3.49Å; L335-S338 PolarHBondContact O-N 3.27Å; L335-S338 PolarHBondContact O-OG 2.03Å; L335-S338 VanDerWaalsContact O-OG 3.06Å; S338-G340 VanDerWaalsContact C-N 3.3Å; S338-G340 PolarHBondContact O-N 3Å; S338-Q341 WeakPolarHBondContact O-CB 3.37Å; S338-Q341 PolarHBondContact O-N 2.83Å; S338-N342 PolarHBondContact O-N 2.84Å; S338-N342 PolarHBondContact O-OD1 2.8Å
339	L	96.8	Very high	87.2	Confident	0 Å²	0	13 Å²	13	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-64.3	-36.6	171.2	-76.9	172.4	0	0	0	111.9	I206 L208 Y242 I250 A291 H293 L335 Q341 N342 I343	I206-L339 HydrophobicContact CG2-CD2 4.18Å; L208-L339 HydrophobicContact CD1-CD2 4.33Å; L208-L339 HydrophobicContact CD2-CD1 4.38Å; Y242-L339 HydrophobicContact CE1-CB 4.34Å; Y242-L339 VanDerWaalsContact OH-C 3.25Å; Y242-L339 WeakPolarHBondContact OH-CB 3.39Å; I250-L339 HydrophobicContact CD1-CD1 3.59Å; I250-L339 HydrophobicContact CG1-CD1 4.3Å; A291-L339 HydrophobicContact CB-CD2 4.11Å; H293-L339 VanDerWaalsContact NE2-CD2 3.26Å; H293-L339 WeakPolarHBondContact NE2-CD2 3.49Å; L335-L339 HydrophobicContact CD1-CD1 3.81Å; L335-L339 HydrophobicContact CD1-CG 3.98Å; L335-L339 HydrophobicContact CG-CD1 3.91Å; L335-L339 HydrophobicContact CG-CG 4.47Å; L335-L339 WeakPolarHBondContact O-CB 3.28Å; L335-L339 WeakPolarHBondContact O-CG 3.28Å; L335-L339 PolarHBondContact O-N 3.49Å; L339-Q341 VanDerWaalsContact C-N 3.3Å; L339-Q341 PolarHBondContact O-N 2.95Å; L339-N342 WeakPolarHBondContact O-CB 3.09Å; L339-N342 PolarHBondContact O-N 2.95Å; L339-N342 VanDerWaalsContact O-N 3.07Å; L339-I343 WeakPolarHBondContact O-CG1 3.5Å; L339-I343 PolarHBondContact O-N 2.82Å
340	G	95	Very high	85.7	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59.2	-44.5	177.2	0	0	0	0	0	110.9	Y242 C336 Q337 S338 I343 G344 M345	Y242-G340 WeakPolarHBondContact OH-CA 3.48Å; Y242-G340 PolarHBondContact OH-N 3.09Å; C336-G340 WeakPolarHBondContact O-CA 3.43Å; C336-G340 PolarHBondContact O-N 3.02Å; Q337-G340 WeakPolarHBondContact O-CA 3.05Å; Q337-G340 PolarHBondContact O-N 3.07Å; Q337-G340 VanDerWaalsContact O-N 3.09Å; S338-G340 VanDerWaalsContact C-N 3.3Å; S338-G340 PolarHBondContact O-N 3Å; G340-I343 CarbonylContact O-C 2.93Å; G340-I343 VanDerWaalsContact O-CG1 3.25Å; G340-I343 WeakPolarHBondContact O-CG1 3.5Å; G340-I343 PolarHBondContact O-N 3.18Å; G340-G344 PolarHBondContact O-N 2.94Å; G340-M345 VanDerWaalsContact O-CB 3.25Å; G340-M345 WeakPolarHBondContact O-CB 3.5Å; G340-M345 WeakPolarHBondContact O-CG 3.41Å; G340-M345 PolarHBondContact O-N 2.88Å
341	Q	93	Very high	84.2	Confident	4 Å²	4	24 Å²	24	2%	0.019	11%	0.108	C	C	.	.	H	α-helix	trans	-60.3	-48.2	171.4	-69.4	178.3	-4.7	0	0	111.1	A308 I310 G311 Q337 S338 L339 I343 G344 M345 M368	A308-Q341 HydrophobicContact CB-CB 4.17Å; A308-Q341 PolarHBondContact O-OE1 3Å; A308-Q341 VanDerWaalsContact O-OE1 3.13Å; I310-Q341 CarbonylContact C-O 3.55Å; I310-Q341 VanDerWaalsContact CA-O 3.28Å; I310-Q341 WeakPolarHBondContact CA-O 3.4Å; I310-Q341 HydrophobicContact CG1-CB 4.17Å; I310-Q341 HydrophobicContact CG1-CG 4.4Å; G311-Q341 PolarHBondContact N-O 3.46Å; Q337-Q341 WeakPolarHBondContact O-CG 3.29Å; Q337-Q341 PolarHBondContact O-N 2.7Å; S338-Q341 WeakPolarHBondContact O-CB 3.37Å; S338-Q341 PolarHBondContact O-N 2.83Å; L339-Q341 VanDerWaalsContact C-N 3.3Å; L339-Q341 PolarHBondContact O-N 2.95Å; Q341-I343 PolarHBondContact O-N 3.43Å; Q341-G344 PolarHBondContact O-N 3.45Å; Q341-M345 WeakPolarHBondContact CA-O 3.47Å; Q341-M368 HydrophobicContact CG-CE 3.88Å
342	N	95.6	Very high	82	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-58.1	-33.9	178.8	-66.9	149.7	0	0	0	113.4	H293 Y309 G311 G312 I313 G320 S338 L339 G344	H293-N342 PolarHBondContact CE1-OD1 3.39Å; H293-N342 PolarHBondContact NE2-OD1 2.81Å; Y309-N342 WeakPolarHBondContact O-CA 3.47Å; Y309-N342 PolarHBondContact O-ND2 3.35Å; G311-N342 CarbonylContact C-O 3.3Å; G311-N342 VanDerWaalsContact C-O 3.24Å; G311-N342 WeakPolarHBondContact CA-O 3.41Å; G311-N342 PolarHBondContact N-O 3.33Å; G312-N342 PolarHBondContact N-O 3.17Å; G312-N342 VanDerWaalsContact N-O 3.1Å; I313-N342 HydrophobicContact CB-CB 4.34Å; I313-N342 WeakPolarHBondContact CB-O 3.5Å; I313-N342 WeakPolarHBondContact CG2-O 3.3Å; I313-N342 PolarHBondContact N-O 2.98Å; G320-N342 PolarHBondContact O-ND2 2.88Å; S338-N342 PolarHBondContact O-N 2.84Å; S338-N342 PolarHBondContact O-OD1 2.8Å; L339-N342 WeakPolarHBondContact O-CB 3.09Å; L339-N342 PolarHBondContact O-N 2.95Å; L339-N342 VanDerWaalsContact O-N 3.07Å; N342-G344 VanDerWaalsContact C-N 3.29Å
343	I	95.1	Very high	79.7	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	13.8	175.6	68.3	178.7	0	0	0	113.8	I206 Y242 L246 I313 L339 G340 Q341 M345 Y387 F390 L399	I206-I343 HydrophobicContact CD1-CG2 4.25Å; Y242-I343 HydrophobicContact CE1-CD1 3.85Å; L246-I343 HydrophobicContact CD1-CD1 4.01Å; I313-I343 HydrophobicContact CB-CG2 4.37Å; I313-I343 HydrophobicContact CG1-CG2 4.34Å; I313-I343 HydrophobicContact CG2-CG2 4.39Å; L339-I343 WeakPolarHBondContact O-CG1 3.5Å; L339-I343 PolarHBondContact O-N 2.82Å; G340-I343 CarbonylContact O-C 2.93Å; G340-I343 VanDerWaalsContact O-CG1 3.25Å; G340-I343 WeakPolarHBondContact O-CG1 3.5Å; G340-I343 PolarHBondContact O-N 3.18Å; Q341-I343 PolarHBondContact O-N 3.43Å; I343-M345 HydrophobicContact CD1-CE 3.99Å; I343-M345 HydrophobicContact CG1-CG 4.34Å; I343-Y387 HydrophobicContact CB-CD2 3.93Å; I343-Y387 HydrophobicContact CB-CE2 4.06Å; I343-Y387 HydrophobicContact CD1-CD2 3.73Å; I343-Y387 HydrophobicContact CD1-CE2 3.89Å; I343-Y387 HydrophobicContact CD1-CG 4.26Å; I343-Y387 HydrophobicContact CG1-CD2 3.9Å; I343-Y387 HydrophobicContact CG1-CE2 4.3Å; I343-F390 WeakPolarHBondContact O-CD1 3.48Å; I343-F390 VanDerWaalsContact O-CG 3.28Å; I343-F390 WeakPolarHBondContact O-CG 3.39Å; I343-L399 HydrophobicContact CG2-CD1 4.32Å
344	G	89.8	Confident	77.2	Confident	9 Å²	9	39 Å²	39	9%	0.093	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.1	9.4	167.5	0	0	0	0	0	115.9	G340 Q341 N342	G340-G344 PolarHBondContact O-N 2.94Å; Q341-G344 PolarHBondContact O-N 3.45Å; N342-G344 VanDerWaalsContact C-N 3.29Å
345	M	90.5	Very high	75.4	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	26%	0.259	C	S	.	.			trans	-75.2	144.3	170.1	-54.8	-175	175.3	0	0	110.4	L246 G340 Q341 I343 M368 F379 S383 Y387	L246-M345 HydrophobicContact CD1-CE 3.54Å; L246-M345 HydrophobicContact CD2-CE 3.6Å; L246-M345 HydrophobicContact CG-CE 4.24Å; G340-M345 VanDerWaalsContact O-CB 3.25Å; G340-M345 WeakPolarHBondContact O-CB 3.5Å; G340-M345 WeakPolarHBondContact O-CG 3.41Å; G340-M345 PolarHBondContact O-N 2.88Å; Q341-M345 WeakPolarHBondContact CA-O 3.47Å; I343-M345 HydrophobicContact CD1-CE 3.99Å; I343-M345 HydrophobicContact CG1-CG 4.34Å; M345-M368 HydrophobicContact CB-CE 3.78Å; M345-M368 HydrophobicContact CB-CG 4.17Å; M345-M368 HydrophobicContact CB-SD 4.12Å; M345-M368 HydrophobicContact SD-CG 4.14Å; M345-M368 HydrophobicContact SD-SD 4.24Å; M345-F379 HydrophobicContact CE-CD1 4.12Å; M345-F379 HydrophobicContact CE-CE1 4.25Å; M345-F379 HydrophobicContact CE-CG 4.41Å; M345-F379 HydrophobicContact SD-CD1 3.53Å; M345-F379 VanDerWaalsContact SD-CD1 3.53Å; M345-F379 HydrophobicContact SD-CE1 3.54Å; M345-F379 VanDerWaalsContact SD-CE1 3.54Å; M345-F379 HydrophobicContact SD-CG 4.36Å; M345-F379 HydrophobicContact SD-CZ 4.36Å; M345-S383 WeakPolarHBondContact CG-O 3.45Å; M345-Y387 HydrophobicContact CE-CD1 4.4Å; M345-Y387 HydrophobicContact CE-CG 4.01Å
346	L	83.1	Confident	73.6	Confident	17 Å²	17	43.9 Å²	43.9	9%	0.089	27%	0.272	C	S	.	.			trans	-109.9	151	-178.8	-59	171.6	0	0	0	110.6	I310 N348 E386 F579 L607	I310-L346 HydrophobicContact CD1-CD2 3.77Å; I310-L346 HydrophobicContact CG2-CD2 3.53Å; L346-N348 PolarHBondContact O-N 2.76Å; L346-E386 WeakPolarHBondContact CB-OE2 3.25Å; L346-E386 PolarHBondContact N-OE2 2.97Å; L346-F579 HydrophobicContact CD1-CB 3.94Å; L346-F579 HydrophobicContact CD1-CD1 2.95Å; L346-F579 HydrophobicContact CD1-CD2 4.4Å; L346-F579 HydrophobicContact CD1-CE1 3.38Å; L346-F579 HydrophobicContact CD1-CG 3.52Å; L346-F579 HydrophobicContact CD1-CZ 4.27Å; L346-F579 HydrophobicContact CG-CD1 4.41Å; L346-L607 HydrophobicContact CD2-CD2 4.31Å
347	R	76.4	Confident	72.3	Confident	25 Å²	25	45.6 Å²	45.6	9%	0.094	28%	0.284	C	S	.	.			trans	-74.9	109.4	170.6	-154.6	179.8	-85.1	-156.2	3.8	107.5	E306 M368 D370 D608	E306-R347 IonicContact OE1-CZ 3.49Å; E306-R347 IonicContact OE1-NH2 3.06Å; E306-R347 PolarHBondContact OE1-NH2 3.22Å; E306-R347 IonicContact OE2-NH2 2.71Å; E306-R347 PolarHBondContact OE2-NH2 2.81Å; E306-R347 VanDerWaalsContact OE2-NH2 3.17Å; R347-M368 WeakPolarHBondContact CA-O 3.45Å; R347-M368 WeakPolarHBondContact CG-O 3.05Å; R347-D370 WeakPolarHBondContact CD-OD1 3.46Å; R347-D370 IonicContact CZ-OD1 3.34Å; R347-D370 IonicContact NE-OD1 2.67Å; R347-D370 IonicContact NH1-OD1 3.77Å; R347-D370 PolarHBondContact NH1-OD1 3.47Å; R347-D608 WeakPolarHBondContact CB-OD2 3.42Å; R347-D608 IonicContact NE-OD2 3.66Å
348	N	64.6	Low	71.1	Confident	32 Å²	32	56 Å²	56	17%	0.171	32%	0.323	C	S	.	.			trans	-82.3	121.7	-179.1	-83.2	-54.2	0	0	0	109	L346	L346-N348 PolarHBondContact O-N 2.76Å
349	K	56.1	Low	70.2	Confident	133 Å²	133	56.7 Å²	56.7	58%	0.578	33%	0.328	S	S	*	.	S	Bend	trans	-98.4	-17.8	170.8	-83.6	-169	175.2	-178.8	0	115.5
350	E	50.5	Low	69	Low	155 Å²	155	59.7 Å²	59.7	72%	0.724	35%	0.347	S	S	*	.			trans	172.8	117.4	170.9	-104.1	155.4	-164.8	0	0	108.9
351	R	49.9	Very low	67.8	Low	115 Å²	115	61.8 Å²	61.8	43%	0.434	36%	0.359	S	S	.	.			trans	-93.5	93.8	156.2	-69.4	-157.1	-166.3	165.3	0.8	107.5	A353 C357 E386	R351-A353 PolarHBondContact O-N 3.35Å; R351-C357 WeakPolarHBondContact CD-SG 3.29Å; R351-C357 VanDerWaalsContact CZ-SG 3.56Å; R351-C357 PolarHBondContact NE-SG 2.76Å; R351-E386 IonicContact NH2-OE1 2.71Å; R351-E386 PolarHBondContact NH2-OE1 2.9Å
352	T	41.9	Very low	66.5	Low	128 Å²	128	66.5 Å²	66.5	79%	0.785	39%	0.389	S	S	*	.			trans	-72.8	3.8	-178.7	9.7	0	0	0	0	114.5
353	A	42.9	Very low	65	Low	75 Å²	75	76.4 Å²	76.4	62%	0.62	43%	0.427	S	S	*	.	S	Bend	trans	-78.5	145.9	176.9	0	0	0	0	0	112.1	R351 G355 G356	R351-A353 PolarHBondContact O-N 3.35Å; A353-G355 PolarHBondContact O-N 3.28Å; A353-G356 PolarHBondContact O-N 2.96Å
354	A	35.1	Very low	63.8	Low	118 Å²	118	77.8 Å²	77.8	98%	0.975	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	104.5	173.3	0	0	0	0	0	110
355	G	51.1	Low	63.2	Low	82 Å²	82	78 Å²	78	85%	0.845	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	116.3	8.1	-167.4	0	0	0	0	0	115	A353	A353-G355 PolarHBondContact O-N 3.28Å
356	G	57.9	Low	63	Low	28 Å²	28	78.1 Å²	78.1	29%	0.289	44%	0.437	S	S	.	.			trans	-55	152.6	-176.7	0	0	0	0	0	115.8	A353 R358	A353-G356 PolarHBondContact O-N 2.96Å; G356-R358 PolarHBondContact O-N 3.07Å; G356-R358 VanDerWaalsContact O-N 3.08Å
357	C	66.4	Low	63.2	Low	35 Å²	35	77.3 Å²	77.3	24%	0.236	43%	0.433	C	S	.	.			trans	-53.9	109.6	176.6	-57.8	0	0	0	0	110.6	R351 C382	R351-C357 WeakPolarHBondContact CD-SG 3.29Å; R351-C357 VanDerWaalsContact CZ-SG 3.56Å; R351-C357 PolarHBondContact NE-SG 2.76Å; C357-C382 VanDerWaalsContact CA-SG 3.53Å; C357-C382 HydrophobicContact CB-CB 3.65Å; C357-C382 WeakPolarHBondContact CB-SG 3.13Å; C357-C382 WeakPolarHBondContact SG-CB 3.41Å; C357-C382 CovalentContact SG-SG 1.97Å; C357-C382 PolarHBondContact SG-SG 3.43Å
358	R	68.3	Low	63.7	Low	220 Å²	220	76.2 Å²	76.2	83%	0.83	43%	0.429	S	S	*	.			trans	-105.4	133.8	171.2	-77.5	-176.8	174.6	161.3	-1.3	109.6	G356	G356-R358 PolarHBondContact O-N 3.07Å; G356-R358 VanDerWaalsContact O-N 3.08Å
359	C	74.7	Confident	64.4	Low	14 Å²	14	77.8 Å²	77.8	10%	0.095	44%	0.435	C	S	.	.			trans	-60.8	136.3	168.8	-167.8	0	0	0	0	109.3	D361 G365 C366	C359-D361 PolarHBondContact O-N 2.89Å; C359-G365 PolarHBondContact SG-O 3.43Å; C359-C366 WeakPolarHBondContact CA-SG 3.44Å; C359-C366 HydrophobicContact CB-CB 3.93Å; C359-C366 WeakPolarHBondContact CB-SG 3.36Å; C359-C366 WeakPolarHBondContact SG-CA 3.46Å; C359-C366 WeakPolarHBondContact SG-CB 3.29Å; C359-C366 PolarHBondContact SG-N 2.82Å; C359-C366 CovalentContact SG-SG 2.04Å; C359-C366 PolarHBondContact SG-SG 3.4Å
360	P	71	Confident	65.1	Low	64 Å²	64	75.2 Å²	75.2	42%	0.416	43%	0.428	S	S	.	.	S	Bend	trans	-56.1	-32.2	175.1	-24.7	34.6	0	0	0	112.6	P362 C366	P360-P362 WeakPolarHBondContact O-CD 3.31Å; P360-C366 VanDerWaalsContact CD-SG 3.52Å
361	D	70.8	Confident	65.7	Low	44 Å²	44	70 Å²	70	24%	0.235	41%	0.406	C	S	.	.	S	Bend	trans	-117.6	89.3	-177.4	-61	-49	0	0	0	109	C359 W363 L364 G365 K378	C359-D361 PolarHBondContact O-N 2.89Å; D361-W363 PolarHBondContact O-N 3.02Å; D361-W363 VanDerWaalsContact O-N 3.08Å; D361-L364 HydrophobicContact CB-CB 4.24Å; D361-L364 HydrophobicContact CB-CD1 4.46Å; D361-G365 PolarHBondContact O-N 3.08Å; D361-G365 VanDerWaalsContact O-N 3.11Å; D361-K378 IonicContact OD1-NZ 3.69Å; D361-K378 WeakPolarHBondContact OD2-CD 3.46Å; D361-K378 IonicContact OD2-NZ 3.98Å; D361-K378 PolarHBondContact OD2-NZ 2.93Å
362	P	64.9	Low	66.3	Low	103 Å²	103	67.1 Å²	67.1	67%	0.669	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-18	-172.1	-23	33.5	0	0	0	115.2	P360	P360-P362 WeakPolarHBondContact O-CD 3.31Å
363	W	63.8	Low	67.1	Low	208 Å²	208	69.4 Å²	69.4	79%	0.788	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-39.8	-174.3	-56.5	98.6	0	0	0	112.6	D361 G365	D361-W363 PolarHBondContact O-N 3.02Å; D361-W363 VanDerWaalsContact O-N 3.08Å; W363-G365 VanDerWaalsContact C-N 3.34Å
364	L	69.8	Low	68.2	Low	28 Å²	28	68.8 Å²	68.8	15%	0.147	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-20.2	176	-74.2	167.2	0	0	0	112.4	D157 D361	D157-L364 WeakPolarHBondContact OD2-CD2 3.39Å; D361-L364 HydrophobicContact CB-CB 4.24Å; D361-L364 HydrophobicContact CB-CD1 4.46Å
365	G	77.7	Confident	69.8	Low	14 Å²	14	64.2 Å²	64.2	14%	0.144	35%	0.35	C	S	.	.			trans	71.3	-180	-171	0	0	0	0	0	112.5	C359 D361 W363 E369 P376	C359-G365 PolarHBondContact SG-O 3.43Å; D361-G365 PolarHBondContact O-N 3.08Å; D361-G365 VanDerWaalsContact O-N 3.11Å; W363-G365 VanDerWaalsContact C-N 3.34Å; G365-E369 VanDerWaalsContact CA-OE2 3.31Å; G365-E369 WeakPolarHBondContact CA-OE2 3.29Å; G365-P376 WeakPolarHBondContact O-CB 3.4Å
366	C	85.6	Confident	71.1	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.014	31%	0.31	C	S	.	.			trans	-110.8	154.9	179.7	-88.4	0	0	0	0	111.2	C359 P360 M368 E369 K378	C359-C366 WeakPolarHBondContact CA-SG 3.44Å; C359-C366 HydrophobicContact CB-CB 3.93Å; C359-C366 WeakPolarHBondContact CB-SG 3.36Å; C359-C366 WeakPolarHBondContact SG-CA 3.46Å; C359-C366 WeakPolarHBondContact SG-CB 3.29Å; C359-C366 PolarHBondContact SG-N 2.82Å; C359-C366 CovalentContact SG-SG 2.04Å; C359-C366 PolarHBondContact SG-SG 3.4Å; P360-C366 VanDerWaalsContact CD-SG 3.52Å; C366-M368 PolarHBondContact O-N 3.42Å; C366-E369 HydrophobicContact CB-CG 4.13Å; C366-E369 PolarHBondContact N-OE2 3.41Å; C366-E369 WeakPolarHBondContact O-CB 3.22Å; C366-E369 PolarHBondContact O-N 2.85Å; C366-K378 CarbonylContact C-O 3.44Å; C366-K378 WeakPolarHBondContact CA-O 3.26Å
367	I	87.6	Confident	72	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-43.7	-175.1	-68.7	169.8	0	0	0	110.5	I241 C336 Q337 E369 P376 K378 F379	I241-I367 HydrophobicContact CG2-CD1 3.51Å; C336-I367 HydrophobicContact CB-CG2 3.9Å; Q337-I367 VanDerWaalsContact CD-O 3.26Å; Q337-I367 HydrophobicContact CG-CG2 3.71Å; Q337-I367 WeakPolarHBondContact CG-O 3.48Å; Q337-I367 PolarHBondContact NE2-O 3.46Å; I367-E369 PolarHBondContact O-N 2.93Å; I367-P376 HydrophobicContact CG1-CB 4.34Å; I367-P376 HydrophobicContact CG1-CG 4.44Å; I367-K378 PolarHBondContact N-O 3.06Å; I367-F379 HydrophobicContact CB-CD1 3.98Å; I367-F379 HydrophobicContact CB-CE1 3.88Å; I367-F379 HydrophobicContact CB-CZ 4.38Å; I367-F379 HydrophobicContact CD1-CD1 4.4Å; I367-F379 HydrophobicContact CD1-CD2 3.96Å; I367-F379 HydrophobicContact CD1-CE1 4.25Å; I367-F379 HydrophobicContact CD1-CE2 3.8Å; I367-F379 HydrophobicContact CD1-CG 4.26Å; I367-F379 HydrophobicContact CD1-CZ 3.95Å; I367-F379 HydrophobicContact CG2-CD1 4.21Å; I367-F379 HydrophobicContact CG2-CE1 3.59Å; I367-F379 HydrophobicContact CG2-CZ 3.94Å
368	M	86.4	Confident	72.7	Confident	3 Å²	3	63.2 Å²	63.2	2%	0.015	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	16.8	-179.7	-56.3	-57.7	-60.4	0	0	114.7	Q341 M345 R347 C366 F379 S383	Q341-M368 HydrophobicContact CG-CE 3.88Å; M345-M368 HydrophobicContact CB-CE 3.78Å; M345-M368 HydrophobicContact CB-CG 4.17Å; M345-M368 HydrophobicContact CB-SD 4.12Å; M345-M368 HydrophobicContact SD-CG 4.14Å; M345-M368 HydrophobicContact SD-SD 4.24Å; R347-M368 WeakPolarHBondContact CA-O 3.45Å; R347-M368 WeakPolarHBondContact CG-O 3.05Å; C366-M368 PolarHBondContact O-N 3.42Å; M368-F379 HydrophobicContact CG-CD1 3.88Å; M368-F379 HydrophobicContact CG-CE1 4.02Å; M368-F379 HydrophobicContact SD-CD1 4.39Å; M368-F379 HydrophobicContact SD-CE1 3.91Å; M368-S383 WeakPolarHBondContact CG-OG 3.35Å
369	E	80.1	Confident	73.6	Confident	64 Å²	64	53 Å²	53	30%	0.299	27%	0.271	S	S	.	.	S	Bend	trans	-101	167.4	169.8	-65.3	170.9	178.6	0	0	109.4	Q337 G365 C366 I367 T371	Q337-E369 PolarHBondContact NE2-O 2.68Å; G365-E369 VanDerWaalsContact CA-OE2 3.31Å; G365-E369 WeakPolarHBondContact CA-OE2 3.29Å; C366-E369 HydrophobicContact CB-CG 4.13Å; C366-E369 PolarHBondContact N-OE2 3.41Å; C366-E369 WeakPolarHBondContact O-CB 3.22Å; C366-E369 PolarHBondContact O-N 2.85Å; I367-E369 PolarHBondContact O-N 2.93Å; E369-T371 PolarHBondContact O-N 2.89Å
370	D	70.4	Confident	74.2	Confident	79 Å²	79	52.6 Å²	52.6	42%	0.422	27%	0.268	S	S	.	.			trans	-61.1	126.1	176.6	-68.1	-33.8	0	0	0	109.3	R347 G372	R347-D370 WeakPolarHBondContact CD-OD1 3.46Å; R347-D370 IonicContact CZ-OD1 3.34Å; R347-D370 IonicContact NE-OD1 2.67Å; R347-D370 IonicContact NH1-OD1 3.77Å; R347-D370 PolarHBondContact NH1-OD1 3.47Å; D370-G372 PolarHBondContact O-N 3.09Å
371	T	64.2	Low	74.8	Confident	45 Å²	45	58.7 Å²	58.7	28%	0.276	28%	0.283	S	S	.	.			trans	-65.2	106.2	179.1	40.8	0	0	0	0	109.7	I333 Q337 E369	I333-T371 HydrophobicContact CG2-CG2 3.92Å; Q337-T371 VanDerWaalsContact NE2-CG2 3.27Å; E369-T371 PolarHBondContact O-N 2.89Å
372	G	61.8	Low	75.5	Confident	56 Å²	56	57.2 Å²	57.2	58%	0.577	28%	0.276	S	S	*	.			trans	-80	-159.1	172.1	0	0	0	0	0	112.2	D370 Y374	D370-G372 PolarHBondContact O-N 3.09Å; G372-Y374 PolarHBondContact O-N 2.9Å
373	Y	58	Low	76.6	Confident	175 Å²	175	52.3 Å²	52.3	69%	0.686	24%	0.244	S	C	*	.	S	Bend	trans	-63.7	-20.2	173.8	-170.8	-116.1	0	0	0	113.1	P156	P156-Y373 HydrophobicContact CB-CD1 3.79Å; P156-Y373 HydrophobicContact CB-CE1 3.09Å; P156-Y373 HydrophobicContact CG-CD1 3.99Å; P156-Y373 HydrophobicContact CG-CE1 3.31Å; P156-Y373 HydrophobicContact CG-CE2 4.18Å; P156-Y373 WeakPolarHBondContact CG-OH 3.27Å
374	Y	65.9	Low	77.8	Confident	63 Å²	63	44.6 Å²	44.6	25%	0.247	22%	0.218	C	C	.	.	S	Bend	trans	-101.7	142.9	-177.7	-56.3	-68.5	0	0	0	111.3	P156 D157 I158 G372 P376	P156-Y374 HydrophobicContact CB-CE1 4.39Å; P156-Y374 WeakPolarHBondContact O-CD1 3.45Å; P156-Y374 WeakPolarHBondContact O-CE1 3.49Å; D157-Y374 WeakPolarHBondContact OD1-CE1 3.5Å; I158-Y374 WeakPolarHBondContact CG1-OH 3.2Å; G372-Y374 PolarHBondContact O-N 2.9Å; Y374-P376 VanDerWaalsContact O-CD 3.23Å; Y374-P376 WeakPolarHBondContact O-CD 3.46Å
375	L	70.2	Confident	78.6	Confident	22 Å²	22	47.8 Å²	47.8	12%	0.115	24%	0.235	C	C	.	.			trans	-87.3	110.7	177.3	-69.6	-177.7	0	0	0	111.2	M120 M155 P330 I333	M120-L375 HydrophobicContact CE-CD1 4.07Å; M120-L375 HydrophobicContact SD-CD1 4.48Å; M155-L375 HydrophobicContact CE-CD1 3.27Å; M155-L375 HydrophobicContact CE-CG 3.7Å; M155-L375 HydrophobicContact SD-CD1 4.17Å; P330-L375 HydrophobicContact CB-CD2 4Å; P330-L375 HydrophobicContact CG-CD1 4.17Å; P330-L375 HydrophobicContact CG-CD2 4Å; I333-L375 HydrophobicContact CG1-CB 4.39Å; I333-L375 HydrophobicContact CG1-CD2 4.04Å
376	P	78.3	Confident	79.1	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.019	23%	0.23	C	C	.	.			trans	-67.6	140.8	176	28.7	-35.5	0	0	0	110.3	I333 G365 I367 Y374	I333-P376 WeakPolarHBondContact CD1-O 3.38Å; I333-P376 HydrophobicContact CG2-CG 3.77Å; G365-P376 WeakPolarHBondContact O-CB 3.4Å; I367-P376 HydrophobicContact CG1-CB 4.34Å; I367-P376 HydrophobicContact CG1-CG 4.44Å; Y374-P376 VanDerWaalsContact O-CD 3.23Å; Y374-P376 WeakPolarHBondContact O-CD 3.46Å
377	R	75.2	Confident	79.4	Confident	35 Å²	35	47.4 Å²	47.4	13%	0.132	23%	0.229	C	C	.	.			trans	-109.6	-18.4	-174.6	-53.5	-179.7	-158.9	164.7	12.3	112.8	S122 N125 S127 Q245	S122-R377 PolarHBondContact OG-NH1 3.41Å; N125-R377 PolarHBondContact O-NH1 3.36Å; N125-R377 PolarHBondContact O-NH2 3.31Å; S127-R377 PolarHBondContact OG-NE 2.91Å; S127-R377 PolarHBondContact OG-NH1 2.86Å; S127-R377 PolarHBondContact OG-NH2 3.26Å; Q245-R377 PolarHBondContact NE2-O 3.42Å
378	K	82.9	Confident	79.5	Confident	86 Å²	86	49.1 Å²	49.1	37%	0.374	24%	0.238	S	C	.	.	S	Bend	trans	-126.4	145.7	-171	-63.6	-176.1	-165.3	134	0	113.1	D361 C366 I367	D361-K378 IonicContact OD1-NZ 3.69Å; D361-K378 WeakPolarHBondContact OD2-CD 3.46Å; D361-K378 IonicContact OD2-NZ 3.98Å; D361-K378 PolarHBondContact OD2-NZ 2.93Å; C366-K378 CarbonylContact C-O 3.44Å; C366-K378 WeakPolarHBondContact CA-O 3.26Å; I367-K378 PolarHBondContact N-O 3.06Å
379	F	87	Confident	79.5	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.018	25%	0.251	C	S	.	.			trans	-72.7	142.6	163.7	-71	-74.9	0	0	0	109.6	I241 Y242 Q245 L246 C336 M345 I367 M368 I384	I241-F379 HydrophobicContact CG2-CE2 3.93Å; Y242-F379 HydrophobicContact CD2-CE2 4.28Å; Y242-F379 HydrophobicContact CD2-CZ 4.44Å; Y242-F379 HydrophobicContact CE2-CE2 4.01Å; Y242-F379 AromaticContact CE2-CZ 3.72Å; Y242-F379 HydrophobicContact CE2-CZ 3.72Å; Q245-F379 HydrophobicContact CB-CD2 4.21Å; L246-F379 HydrophobicContact CD1-CD2 4.14Å; L246-F379 HydrophobicContact CD1-CE2 3.79Å; L246-F379 HydrophobicContact CD1-CZ 4.24Å; L246-F379 HydrophobicContact CD2-CD2 4.24Å; L246-F379 HydrophobicContact CG-CD2 4.17Å; L246-F379 HydrophobicContact CG-CE2 4.23Å; C336-F379 HydrophobicContact CB-CZ 4.41Å; M345-F379 HydrophobicContact CE-CD1 4.12Å; M345-F379 HydrophobicContact CE-CE1 4.25Å; M345-F379 HydrophobicContact CE-CG 4.41Å; M345-F379 HydrophobicContact SD-CD1 3.53Å; M345-F379 VanDerWaalsContact SD-CD1 3.53Å; M345-F379 HydrophobicContact SD-CE1 3.54Å; M345-F379 VanDerWaalsContact SD-CE1 3.54Å; M345-F379 HydrophobicContact SD-CG 4.36Å; M345-F379 HydrophobicContact SD-CZ 4.36Å; I367-F379 HydrophobicContact CB-CD1 3.98Å; I367-F379 HydrophobicContact CB-CE1 3.88Å; I367-F379 HydrophobicContact CB-CZ 4.38Å; I367-F379 HydrophobicContact CD1-CD1 4.4Å; I367-F379 HydrophobicContact CD1-CD2 3.96Å; I367-F379 HydrophobicContact CD1-CE1 4.25Å; I367-F379 HydrophobicContact CD1-CE2 3.8Å; I367-F379 HydrophobicContact CD1-CG 4.26Å; I367-F379 HydrophobicContact CD1-CZ 3.95Å; I367-F379 HydrophobicContact CG2-CD1 4.21Å; I367-F379 HydrophobicContact CG2-CE1 3.59Å; I367-F379 HydrophobicContact CG2-CZ 3.94Å; M368-F379 HydrophobicContact CG-CD1 3.88Å; M368-F379 HydrophobicContact CG-CE1 4.02Å; M368-F379 HydrophobicContact SD-CD1 4.39Å; M368-F379 HydrophobicContact SD-CE1 3.91Å; F379-I384 HydrophobicContact CB-CD1 4.34Å; F379-I384 HydrophobicContact CB-CG1 3.97Å
380	S	86.6	Confident	80	Confident	6 Å²	6	50 Å²	50	4%	0.042	24%	0.239	C	C	.	.			trans	-67.3	155.1	170	81.9	0	0	0	0	109.5	C382 S383 I384	S380-C382 PolarHBondContact O-N 3.44Å; S380-C382 VanDerWaalsContact O-N 3.15Å; S380-C382 PolarHBondContact OG-N 2.92Å; S380-S383 WeakPolarHBondContact O-CB 3.47Å; S380-S383 PolarHBondContact O-N 3.06Å; S380-S383 VanDerWaalsContact O-N 3.11Å; S380-S383 PolarHBondContact OG-N 3.01Å; S380-S383 PolarHBondContact OG-OG 2.92Å; S380-I384 WeakPolarHBondContact O-CG1 3.44Å; S380-I384 PolarHBondContact O-N 3.3Å; S380-I384 VanDerWaalsContact O-N 3.12Å
381	R	84.1	Confident	80.9	Confident	193 Å²	193	46.4 Å²	46.4	73%	0.728	22%	0.22	S	C	*	.	H	α-helix	trans	-55.6	-34.2	173.8	-69.6	-175.7	179.2	173.8	0.9	112.2	I384 D385	R381-I384 PolarHBondContact O-N 3Å; R381-D385 VanDerWaalsContact O-CG 3.26Å; R381-D385 PolarHBondContact O-N 3.48Å
382	C	84.6	Confident	82	Confident	12 Å²	12	48.9 Å²	48.9	8%	0.081	23%	0.228	C	C	.	.	H	α-helix	trans	-73.7	-34.3	180	-66.1	0	0	0	0	113.5	C357 S380 I384 D385 E386	C357-C382 VanDerWaalsContact CA-SG 3.53Å; C357-C382 HydrophobicContact CB-CB 3.65Å; C357-C382 WeakPolarHBondContact CB-SG 3.13Å; C357-C382 WeakPolarHBondContact SG-CB 3.41Å; C357-C382 CovalentContact SG-SG 1.97Å; C357-C382 PolarHBondContact SG-SG 3.43Å; S380-C382 PolarHBondContact O-N 3.44Å; S380-C382 VanDerWaalsContact O-N 3.15Å; S380-C382 PolarHBondContact OG-N 2.92Å; C382-I384 VanDerWaalsContact C-N 3.28Å; C382-D385 PolarHBondContact O-N 3.22Å; C382-E386 WeakPolarHBondContact O-CB 3.43Å; C382-E386 VanDerWaalsContact O-CG 3.22Å; C382-E386 WeakPolarHBondContact O-CG 3.16Å; C382-E386 PolarHBondContact O-N 3.25Å
383	S	88.1	Confident	83.1	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.007	22%	0.216	C	C	.	.	H	α-helix	trans	-62.6	-41.4	171.6	-52.8	0	0	0	0	110.1	M345 M368 S380 E386 Y387	M345-S383 WeakPolarHBondContact CG-O 3.45Å; M368-S383 WeakPolarHBondContact CG-OG 3.35Å; S380-S383 WeakPolarHBondContact O-CB 3.47Å; S380-S383 PolarHBondContact O-N 3.06Å; S380-S383 VanDerWaalsContact O-N 3.11Å; S380-S383 PolarHBondContact OG-N 3.01Å; S380-S383 PolarHBondContact OG-OG 2.92Å; S383-E386 PolarHBondContact O-N 3.01Å; S383-Y387 PolarHBondContact O-N 3.49Å
384	I	89.2	Confident	84.2	Confident	46 Å²	46	41.7 Å²	41.7	24%	0.236	19%	0.189	C	C	.	.	H	α-helix	trans	-64.1	-46.4	174.4	-59.4	171.9	0	0	0	110.6	L246 F379 S380 R381 C382 E386 Y387 L388	L246-I384 HydrophobicContact CD2-CG1 3.89Å; F379-I384 HydrophobicContact CB-CD1 4.34Å; F379-I384 HydrophobicContact CB-CG1 3.97Å; S380-I384 WeakPolarHBondContact O-CG1 3.44Å; S380-I384 PolarHBondContact O-N 3.3Å; S380-I384 VanDerWaalsContact O-N 3.12Å; R381-I384 PolarHBondContact O-N 3Å; C382-I384 VanDerWaalsContact C-N 3.28Å; I384-E386 VanDerWaalsContact C-N 3.29Å; I384-E386 PolarHBondContact O-N 3.22Å; I384-Y387 WeakPolarHBondContact O-CB 3.47Å; I384-Y387 PolarHBondContact O-N 3.47Å; I384-L388 HydrophobicContact CG2-CD1 4.04Å; I384-L388 HydrophobicContact CG2-CG 4.32Å; I384-L388 VanDerWaalsContact O-CG 3.27Å; I384-L388 WeakPolarHBondContact O-CG 3.49Å; I384-L388 PolarHBondContact O-N 3.41Å
385	D	86.8	Confident	85.2	Confident	95 Å²	95	39.1 Å²	39.1	51%	0.508	18%	0.182	S	C	.	.	H	α-helix	trans	-61.1	-37.6	177.1	-70.2	-24.4	0	0	0	112.4	R381 C382 L388 R389	R381-D385 VanDerWaalsContact O-CG 3.26Å; R381-D385 PolarHBondContact O-N 3.48Å; C382-D385 PolarHBondContact O-N 3.22Å; D385-L388 PolarHBondContact O-N 3.07Å; D385-R389 VanDerWaalsContact O-CB 3.3Å; D385-R389 WeakPolarHBondContact O-CB 3.25Å; D385-R389 PolarHBondContact O-N 3.27Å
386	E	88.1	Confident	86.1	Confident	5 Å²	5	38.2 Å²	38.2	2%	0.023	18%	0.178	C	C	.	.	H	α-helix	trans	-65.4	-44.4	175.7	-77.8	163	-167.7	0	0	111.8	L346 R351 C382 S383 I384 R389 F390	L346-E386 WeakPolarHBondContact CB-OE2 3.25Å; L346-E386 PolarHBondContact N-OE2 2.97Å; R351-E386 IonicContact NH2-OE1 2.71Å; R351-E386 PolarHBondContact NH2-OE1 2.9Å; C382-E386 WeakPolarHBondContact O-CB 3.43Å; C382-E386 VanDerWaalsContact O-CG 3.22Å; C382-E386 WeakPolarHBondContact O-CG 3.16Å; C382-E386 PolarHBondContact O-N 3.25Å; S383-E386 PolarHBondContact O-N 3.01Å; I384-E386 VanDerWaalsContact C-N 3.29Å; I384-E386 PolarHBondContact O-N 3.22Å; E386-R389 PolarHBondContact O-N 3.27Å; E386-F390 WeakPolarHBondContact O-CB 3.37Å; E386-F390 PolarHBondContact O-N 2.73Å
387	Y	91.8	Very high	86.5	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.008	18%	0.182	C	C	.	.	H	α-helix	trans	-60.4	-46.7	172.3	167.4	-121.9	0	0	0	112	K204 L246 T248 I343 M345 S383 I384 R389 F390 L391	K204-Y387 WeakPolarHBondContact CD-OH 3.26Å; L246-Y387 HydrophobicContact CB-CE1 4.22Å; L246-Y387 HydrophobicContact CD2-CD1 4.14Å; T248-Y387 PolarHBondContact OG1-OH 3Å; T248-Y387 VanDerWaalsContact OG1-OH 3.06Å; I343-Y387 HydrophobicContact CB-CD2 3.93Å; I343-Y387 HydrophobicContact CB-CE2 4.06Å; I343-Y387 HydrophobicContact CD1-CD2 3.73Å; I343-Y387 HydrophobicContact CD1-CE2 3.89Å; I343-Y387 HydrophobicContact CD1-CG 4.26Å; I343-Y387 HydrophobicContact CG1-CD2 3.9Å; I343-Y387 HydrophobicContact CG1-CE2 4.3Å; M345-Y387 HydrophobicContact CE-CD1 4.4Å; M345-Y387 HydrophobicContact CE-CG 4.01Å; S383-Y387 PolarHBondContact O-N 3.49Å; I384-Y387 WeakPolarHBondContact O-CB 3.47Å; I384-Y387 PolarHBondContact O-N 3.47Å; Y387-R389 VanDerWaalsContact C-N 3.31Å; Y387-R389 PolarHBondContact O-N 2.72Å; Y387-F390 WeakPolarHBondContact O-CB 3.39Å; Y387-F390 PolarHBondContact O-N 2.95Å; Y387-L391 HydrophobicContact CD2-CD1 4.38Å; Y387-L391 HydrophobicContact CD2-CG 4.16Å; Y387-L391 HydrophobicContact CE1-CD1 3.94Å; Y387-L391 HydrophobicContact CE2-CD1 3.73Å; Y387-L391 HydrophobicContact CE2-CD2 3.9Å; Y387-L391 HydrophobicContact CE2-CG 3.73Å; Y387-L391 VanDerWaalsContact CZ-CD1 3.48Å; Y387-L391 WeakPolarHBondContact O-CG 3.23Å; Y387-L391 PolarHBondContact O-N 3.01Å
388	L	89.8	Confident	87.1	Confident	37 Å²	37	38.1 Å²	38.1	19%	0.194	18%	0.183	C	C	.	.	H	α-helix	trans	-62.7	-40	178.1	-67	173.8	0	0	0	111.6	Q200 I384 D385 L391 Q392	Q200-L388 HydrophobicContact CB-CD2 4.19Å; Q200-L388 HydrophobicContact CG-CD2 3.95Å; I384-L388 HydrophobicContact CG2-CD1 4.04Å; I384-L388 HydrophobicContact CG2-CG 4.32Å; I384-L388 VanDerWaalsContact O-CG 3.27Å; I384-L388 WeakPolarHBondContact O-CG 3.49Å; I384-L388 PolarHBondContact O-N 3.41Å; D385-L388 PolarHBondContact O-N 3.07Å; L388-L391 PolarHBondContact O-N 2.72Å; L388-Q392 WeakPolarHBondContact O-CB 3.35Å; L388-Q392 VanDerWaalsContact O-CG 3.24Å; L388-Q392 WeakPolarHBondContact O-CG 3.25Å; L388-Q392 PolarHBondContact O-N 3.04Å
389	R	87.5	Confident	87.4	Confident	74 Å²	74	34 Å²	34	28%	0.279	17%	0.165	S	C	.	.	H	α-helix	trans	-65.3	-41	174.6	-172.8	-177.2	68.8	102.4	-3.8	111.5	D385 E386 Y387 L391 Q392 Q393	D385-R389 VanDerWaalsContact O-CB 3.3Å; D385-R389 WeakPolarHBondContact O-CB 3.25Å; D385-R389 PolarHBondContact O-N 3.27Å; E386-R389 PolarHBondContact O-N 3.27Å; Y387-R389 VanDerWaalsContact C-N 3.31Å; Y387-R389 PolarHBondContact O-N 2.72Å; R389-L391 VanDerWaalsContact C-N 3.32Å; R389-L391 PolarHBondContact O-N 3.07Å; R389-Q392 PolarHBondContact O-N 3.32Å; R389-Q393 WeakPolarHBondContact O-CB 3.18Å; R389-Q393 VanDerWaalsContact O-CG 3.26Å; R389-Q393 WeakPolarHBondContact O-CG 3.34Å; R389-Q393 PolarHBondContact O-N 2.77Å
390	F	89.9	Confident	87.3	Confident	10 Å²	10	35.4 Å²	35.4	4%	0.044	17%	0.171	C	C	.	.	H	α-helix	trans	-57.4	-46.6	175.7	169.2	-99.2	0	0	0	111.1	I313 I343 E386 Y387 Q393 G395	I313-F390 HydrophobicContact CG2-CE1 3.72Å; I313-F390 HydrophobicContact CG2-CZ 3.58Å; I343-F390 WeakPolarHBondContact O-CD1 3.48Å; I343-F390 VanDerWaalsContact O-CG 3.28Å; I343-F390 WeakPolarHBondContact O-CG 3.39Å; E386-F390 WeakPolarHBondContact O-CB 3.37Å; E386-F390 PolarHBondContact O-N 2.73Å; Y387-F390 WeakPolarHBondContact O-CB 3.39Å; Y387-F390 PolarHBondContact O-N 2.95Å; F390-Q393 PolarHBondContact O-N 2.74Å; F390-G395 VanDerWaalsContact CE1-C 3.46Å; F390-G395 WeakPolarHBondContact O-CA 3.42Å; F390-G395 PolarHBondContact O-N 3.09Å
391	L	90.1	Very high	86.9	Confident	5 Å²	5	37.5 Å²	37.5	3%	0.026	18%	0.181	C	C	.	.	H	α-helix	trans	-65.4	-43.5	176.1	-64.9	-179.8	0	0	0	112.8	V199 Y387 L388 R389 Q393 G394 G395	V199-L391 HydrophobicContact CG1-CB 3.48Å; V199-L391 VanDerWaalsContact CG1-CB 3.48Å; V199-L391 HydrophobicContact CG1-CD1 3.88Å; V199-L391 HydrophobicContact CG1-CG 4.25Å; Y387-L391 HydrophobicContact CD2-CD1 4.38Å; Y387-L391 HydrophobicContact CD2-CG 4.16Å; Y387-L391 HydrophobicContact CE1-CD1 3.94Å; Y387-L391 HydrophobicContact CE2-CD1 3.73Å; Y387-L391 HydrophobicContact CE2-CD2 3.9Å; Y387-L391 HydrophobicContact CE2-CG 3.73Å; Y387-L391 VanDerWaalsContact CZ-CD1 3.48Å; Y387-L391 WeakPolarHBondContact O-CG 3.23Å; Y387-L391 PolarHBondContact O-N 3.01Å; L388-L391 PolarHBondContact O-N 2.72Å; R389-L391 VanDerWaalsContact C-N 3.32Å; R389-L391 PolarHBondContact O-N 3.07Å; L391-Q393 PolarHBondContact O-N 3.05Å; L391-G394 PolarHBondContact O-N 3.33Å; L391-G395 WeakPolarHBondContact CD2-O 3.48Å
392	Q	87.1	Confident	86.4	Confident	96 Å²	96	32.6 Å²	32.6	45%	0.449	17%	0.165	S	C	.	.	H	α-helix	trans	-62.1	-28.7	176.9	-75.9	172.1	-9.6	0	0	112.9	L388 R389 G394 V472	L388-Q392 WeakPolarHBondContact O-CB 3.35Å; L388-Q392 VanDerWaalsContact O-CG 3.24Å; L388-Q392 WeakPolarHBondContact O-CG 3.25Å; L388-Q392 PolarHBondContact O-N 3.04Å; R389-Q392 PolarHBondContact O-N 3.32Å; Q392-G394 PolarHBondContact O-N 2.78Å; Q392-V472 VanDerWaalsContact O-CG2 3.29Å; Q392-V472 WeakPolarHBondContact O-CG2 3.21Å
393	Q	84.4	Confident	85.6	Confident	69 Å²	69	32.7 Å²	32.7	32%	0.322	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-3.1	175	-73.1	-179.6	-12	0	0	113	R389 F390 L391 N473 R511	R389-Q393 WeakPolarHBondContact O-CB 3.18Å; R389-Q393 VanDerWaalsContact O-CG 3.26Å; R389-Q393 WeakPolarHBondContact O-CG 3.34Å; R389-Q393 PolarHBondContact O-N 2.77Å; F390-Q393 PolarHBondContact O-N 2.74Å; L391-Q393 PolarHBondContact O-N 3.05Å; Q393-N473 PolarHBondContact O-ND2 3.27Å; Q393-R511 WeakPolarHBondContact O-CG 3.49Å
394	G	81.8	Confident	84.6	Confident	12 Å²	12	36.7 Å²	36.7	12%	0.124	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.6	10.3	-178.1	0	0	0	0	0	114.1	L391 Q392	L391-G394 PolarHBondContact O-N 3.33Å; Q392-G394 PolarHBondContact O-N 2.78Å
395	G	86.8	Confident	83.2	Confident	8 Å²	8	35.9 Å²	35.9	8%	0.082	19%	0.185	C	C	.	.			trans	-75.6	152.1	173.1	0	0	0	0	0	112.4	F390 L391	F390-G395 VanDerWaalsContact CE1-C 3.46Å; F390-G395 WeakPolarHBondContact O-CA 3.42Å; F390-G395 PolarHBondContact O-N 3.09Å; L391-G395 WeakPolarHBondContact CD2-O 3.48Å
396	G	88.2	Confident	81.6	Confident	4 Å²	4	32.9 Å²	32.9	4%	0.041	17%	0.169	C	C	.	.			trans	76	29	173.5	0	0	0	0	0	115	C398 L399 F400	G396-C398 PolarHBondContact O-N 3.46Å; G396-L399 VanDerWaalsContact O-CB 3.29Å; G396-L399 WeakPolarHBondContact O-CB 3.43Å; G396-L399 WeakPolarHBondContact O-CG 3.44Å; G396-L399 PolarHBondContact O-N 3.21Å; G396-F400 WeakPolarHBondContact O-CD2 3.44Å; G396-F400 VanDerWaalsContact O-CE2 3.31Å; G396-F400 WeakPolarHBondContact O-CE2 3.21Å
397	S	86	Confident	79.8	Confident	14 Å²	14	35.5 Å²	35.5	10%	0.098	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-56.1	-33.7	179.1	52	0	0	0	0	113.7	L399 F400	S397-L399 PolarHBondContact O-N 3.08Å; S397-F400 WeakPolarHBondContact O-CD2 3.3Å
398	C	88.1	Confident	77.7	Confident	22 Å²	22	36.8 Å²	36.8	15%	0.149	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-70.4	-3.8	175.5	68.5	0	0	0	0	114.6	D290 C314 G396 F400 N401	D290-C398 VanDerWaalsContact OD1-CB 3.29Å; D290-C398 WeakPolarHBondContact OD1-CB 3.42Å; D290-C398 PolarHBondContact OD1-SG 2.85Å; C314-C398 WeakPolarHBondContact CA-SG 3.49Å; C314-C398 HydrophobicContact CB-CB 3.74Å; C314-C398 WeakPolarHBondContact CB-SG 3.47Å; C314-C398 WeakPolarHBondContact SG-CB 3.45Å; C314-C398 PolarHBondContact SG-N 3.26Å; C314-C398 CovalentContact SG-SG 2.02Å; C314-C398 PolarHBondContact SG-SG 2.92Å; G396-C398 PolarHBondContact O-N 3.46Å; C398-F400 VanDerWaalsContact C-N 3.33Å; C398-N401 PolarHBondContact O-OD1 3.47Å
399	L	90.6	Very high	75.9	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-90.1	0.1	-175.3	-57.3	180	0	0	0	113.6	K204 Y205 I206 D290 I313 I343 G396 S397	K204-L399 CarbonylContact C-O 3.59Å; K204-L399 VanDerWaalsContact CA-O 3.25Å; K204-L399 WeakPolarHBondContact CA-O 3.44Å; K204-L399 HydrophobicContact CB-CB 4.03Å; K204-L399 HydrophobicContact CG-CB 4.19Å; Y205-L399 PolarHBondContact N-O 2.67Å; Y205-L399 VanDerWaalsContact O-CA 3.29Å; Y205-L399 WeakPolarHBondContact O-CA 3.33Å; Y205-L399 VanDerWaalsContact O-CD2 3.22Å; Y205-L399 WeakPolarHBondContact O-CD2 3.01Å; I206-L399 HydrophobicContact CB-CD2 4.36Å; I206-L399 HydrophobicContact CG1-CD2 3.73Å; D290-L399 HydrophobicContact CB-CD2 4.35Å; I313-L399 HydrophobicContact CD1-CD2 4.21Å; I313-L399 HydrophobicContact CG1-CD1 4.26Å; I313-L399 HydrophobicContact CG1-CD2 3.78Å; I313-L399 HydrophobicContact CG1-CG 4.26Å; I343-L399 HydrophobicContact CG2-CD1 4.32Å; G396-L399 VanDerWaalsContact O-CB 3.29Å; G396-L399 WeakPolarHBondContact O-CB 3.43Å; G396-L399 WeakPolarHBondContact O-CG 3.44Å; G396-L399 PolarHBondContact O-N 3.21Å; S397-L399 PolarHBondContact O-N 3.08Å
400	F	84.3	Confident	74.5	Confident	33 Å²	33	39.4 Å²	39.4	15%	0.145	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-101.3	-4.9	-174.1	-62.6	-91.4	0	0	0	113	V199 E202 K204 G396 S397 C398 N491	V199-F400 HydrophobicContact CG1-CE1 4.44Å; V199-F400 HydrophobicContact CG1-CZ 3.9Å; E202-F400 HydrophobicContact CB-CE1 4.48Å; K204-F400 HydrophobicContact CG-CE1 4.22Å; K204-F400 HydrophobicContact CG-CZ 4.3Å; G396-F400 WeakPolarHBondContact O-CD2 3.44Å; G396-F400 VanDerWaalsContact O-CE2 3.31Å; G396-F400 WeakPolarHBondContact O-CE2 3.21Å; S397-F400 WeakPolarHBondContact O-CD2 3.3Å; C398-F400 VanDerWaalsContact C-N 3.33Å; F400-N491 HydrophobicContact CB-CB 4.01Å; F400-N491 HydrophobicContact CD2-CB 3.94Å; F400-N491 HydrophobicContact CG-CB 4.13Å
401	N	77	Confident	73.3	Confident	49 Å²	49	44.3 Å²	44.3	26%	0.262	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-81.7	123.4	166	43.9	-69.1	0	0	0	110.1	Y205 E207 C398 P403	Y205-N401 WeakPolarHBondContact CB-O 3.4Å; E207-N401 VanDerWaalsContact CD-ND2 3.34Å; E207-N401 PolarHBondContact OE1-ND2 2.85Å; C398-N401 PolarHBondContact O-OD1 3.47Å; N401-P403 WeakPolarHBondContact O-CD 3.05Å
402	K	74.1	Confident	72.4	Confident	90 Å²	90	47.1 Å²	47.1	39%	0.391	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-84.1	119.2	174.3	-175.5	-178	-152.1	-157.2	0	109.2	Y205 Y416	Y205-K402 HydrophobicContact CD2-CB 3.99Å; Y205-K402 HydrophobicContact CD2-CG 4.3Å; Y205-K402 HydrophobicContact CE1-CG 3.97Å; Y205-K402 HydrophobicContact CE2-CB 3.72Å; Y205-K402 HydrophobicContact CE2-CD 4.38Å; Y205-K402 HydrophobicContact CE2-CG 3.75Å; Y205-K402 WeakPolarHBondContact OH-CE 3.46Å; K402-Y416 HydrophobicContact CD-CD1 4.24Å; K402-Y416 HydrophobicContact CD-CE1 3.63Å; K402-Y416 WeakPolarHBondContact CE-OH 3.44Å; K402-Y416 HydrophobicContact CG-CE1 4.13Å; K402-Y416 VanDerWaalsContact NZ-CD1 3.33Å; K402-Y416 PolarHBondContact NZ-OH 2.98Å
403	P	69.3	Low	71.6	Confident	15 Å²	15	43.8 Å²	43.8	10%	0.097	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-66.5	150.6	176	-20.9	33.9	0	0	0	111.9	E207 V251 N401	E207-P403 HydrophobicContact CG-CG 3.87Å; V251-P403 HydrophobicContact CB-CG 4.14Å; V251-P403 HydrophobicContact CG1-CB 4.13Å; V251-P403 HydrophobicContact CG1-CG 4.1Å; V251-P403 HydrophobicContact CG2-CG 4.08Å; N401-P403 WeakPolarHBondContact O-CD 3.05Å
404	T	65.4	Low	70.5	Confident	84 Å²	84	42.2 Å²	42.2	52%	0.515	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-73.9	143.1	169.9	38.3	0	0	0	0	110.2	S70 T71	S70-T404 CarbonylContact C-O 3.52Å; S70-T404 WeakPolarHBondContact CA-O 3.49Å; T71-T404 PolarHBondContact N-O 3.23Å; T71-T404 WeakPolarHBondContact OG1-CB 3.41Å; T71-T404 PolarHBondContact OG1-OG1 3.34Å
405	K	60.6	Low	69.8	Low	30 Å²	30	42.7 Å²	42.7	13%	0.13	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-92.6	142.9	-173.7	-55.7	-171	-149.5	153.7	0	114.1	H66 N67 T71 D408 Y416	H66-K405 HydrophobicContact CB-CD 4.23Å; N67-K405 WeakPolarHBondContact OD1-CD 3.35Å; N67-K405 WeakPolarHBondContact OD1-CE 3.49Å; T71-K405 WeakPolarHBondContact CG2-O 3.24Å; K405-D408 IonicContact NZ-OD2 2.79Å; K405-D408 PolarHBondContact NZ-OD2 3.47Å; K405-Y416 HydrophobicContact CG-CE1 4.33Å
406	L	53.3	Low	68.8	Low	32 Å²	32	44.2 Å²	44.2	17%	0.168	25%	0.254	C	S	.	.	S	Bend	trans	-74.4	-33.6	-172.2	-171.2	66.9	0	0	0	117.2	L69 S70 T71 G90	L69-L406 HydrophobicContact CB-CB 4.27Å; L69-L406 HydrophobicContact CB-CD2 3.69Å; L69-L406 HydrophobicContact CD1-CD2 3.85Å; L69-L406 HydrophobicContact CG-CD2 4.43Å; L69-L406 PolarHBondContact O-N 2.82Å; S70-L406 WeakPolarHBondContact O-CD1 3.39Å; T71-L406 WeakPolarHBondContact O-CD1 3.38Å; G90-L406 WeakPolarHBondContact O-CD2 3.37Å
407	L	49.7	Very low	67.8	Low	59 Å²	59	48.2 Å²	48.2	31%	0.309	28%	0.278	S	S	.	.	S	Bend	trans	-126	2.2	-152.4	-74.1	159	0	0	0	116.8	H94	H94-L407 HydrophobicContact CB-CD1 3.08Å; H94-L407 HydrophobicContact CB-CG 4.43Å; H94-L407 WeakPolarHBondContact CD2-CD1 3.33Å
408	D	47.9	Very low	66.9	Low	29 Å²	29	49.2 Å²	49.2	16%	0.155	28%	0.281	C	S	.	.			trans	-94.3	123.7	179.5	-63	-22.9	0	0	0	109	H66 K405	H66-D408 IonicContact CE1-OD1 3.73Å; H66-D408 PolarHBondContact CE1-OD1 2.99Å; H66-D408 IonicContact CG-OD1 3.73Å; H66-D408 IonicContact CG-OD2 3.64Å; H66-D408 IonicContact ND1-OD1 2.77Å; H66-D408 PolarHBondContact ND1-OD1 3.02Å; H66-D408 IonicContact ND1-OD2 2.78Å; H66-D408 PolarHBondContact ND1-OD2 2.02Å; K405-D408 IonicContact NZ-OD2 2.79Å; K405-D408 PolarHBondContact NZ-OD2 3.47Å
409	P	51.1	Low	65.6	Low	104 Å²	104	56.1 Å²	56.1	68%	0.675	32%	0.316	S	S	*	.			trans	-52.2	140.8	148.3	-12.5	26.5	0	0	0	106.7	E411	P409-E411 PolarHBondContact O-N 3.22Å
410	P	58.5	Low	64.6	Low	63 Å²	63	60 Å²	60	41%	0.409	36%	0.355	S	S	.	.			trans	-41.4	109.7	178.8	-25.8	27.2	0	0	0	111.5	E418 L419 E421	P410-E418 VanDerWaalsContact CA-OE2 3.31Å; P410-E418 WeakPolarHBondContact CA-OE2 3.33Å; P410-E418 HydrophobicContact CB-CB 3.65Å; P410-E418 HydrophobicContact CG-CB 4.07Å; P410-L419 HydrophobicContact CG-CB 4.42Å; P410-L419 WeakPolarHBondContact CG-O 3.2Å; P410-E421 VanDerWaalsContact C-OE1 3.27Å; P410-E421 HydrophobicContact CB-CG 4.21Å
411	E	65.3	Low	64.1	Low	113 Å²	113	59.7 Å²	59.7	53%	0.528	35%	0.354	S	S	.	.			trans	-111.5	102.8	-176.9	-169.3	-170.9	-179.6	0	0	110.7	P409 G413 N414 E418 E421	P409-E411 PolarHBondContact O-N 3.22Å; E411-G413 PolarHBondContact O-N 2.83Å; E411-G413 VanDerWaalsContact O-N 3.11Å; E411-N414 PolarHBondContact O-N 3.27Å; E411-N414 PolarHBondContact O-ND2 3.24Å; E411-N414 PolarHBondContact O-OD1 3.28Å; E411-E418 PolarHBondContact N-OE2 3.13Å; E411-E421 PolarHBondContact N-OE1 3.24Å
412	C	70.6	Confident	63.9	Low	64 Å²	64	63 Å²	63	43%	0.432	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	115.4	-179.6	175.8	0	0	0	0	113.4	E421 C442	C412-E421 VanDerWaalsContact CA-OE1 3.29Å; C412-E421 WeakPolarHBondContact CA-OE1 3.43Å; C412-E421 PolarHBondContact N-OE1 3.01Å; C412-C442 VanDerWaalsContact C-SG 3.55Å; C412-C442 WeakPolarHBondContact CA-SG 3.36Å; C412-C442 HydrophobicContact CB-CB 3.51Å; C412-C442 WeakPolarHBondContact CB-SG 3.41Å; C412-C442 WeakPolarHBondContact SG-CB 3.22Å; C412-C442 PolarHBondContact SG-N 3.18Å; C412-C442 CovalentContact SG-SG 2.01Å; C412-C442 PolarHBondContact SG-SG 3.17Å
413	G	70.1	Confident	64.1	Low	26 Å²	26	58.8 Å²	58.8	27%	0.268	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	110.1	12.2	176.1	0	0	0	0	0	113.7	E411 D424 G426 S427	E411-G413 PolarHBondContact O-N 2.83Å; E411-G413 VanDerWaalsContact O-N 3.11Å; G413-D424 WeakPolarHBondContact CA-OD1 3.33Å; G413-D424 WeakPolarHBondContact CA-OD2 3.29Å; G413-D424 VanDerWaalsContact N-CG 3.32Å; G413-D424 PolarHBondContact N-OD1 3.42Å; G413-D424 PolarHBondContact N-OD2 3.3Å; G413-G426 CarbonylContact C-O 3.51Å; G413-G426 WeakPolarHBondContact CA-O 3Å; G413-G426 CarbonylContact O-C 3.6Å; G413-S427 WeakPolarHBondContact O-CA 3.39Å; G413-S427 PolarHBondContact O-N 2.92Å
414	N	62.6	Low	64.5	Low	36 Å²	36	58 Å²	58	19%	0.193	35%	0.345	C	S	.	.	S	Bend	trans	-91	-7	174.4	72	14.9	0	0	0	112.4	E411 Y416 E418 D424	E411-N414 PolarHBondContact O-N 3.27Å; E411-N414 PolarHBondContact O-ND2 3.24Å; E411-N414 PolarHBondContact O-OD1 3.28Å; N414-Y416 HydrophobicContact CB-CD2 4.4Å; N414-Y416 WeakPolarHBondContact O-CD2 3.06Å; N414-Y416 VanDerWaalsContact O-CE2 3.31Å; N414-Y416 WeakPolarHBondContact O-CE2 3.4Å; N414-Y416 WeakPolarHBondContact OD1-CB 3.42Å; N414-Y416 VanDerWaalsContact OD1-CD2 3.32Å; N414-Y416 WeakPolarHBondContact OD1-CD2 3.3Å; N414-Y416 PolarHBondContact OD1-N 3.02Å; N414-E418 PolarHBondContact ND2-OE2 2.8Å; N414-D424 PolarHBondContact N-OD2 3.38Å; N414-D424 PolarHBondContact OD1-OD2 2.88Å
415	G	66.3	Low	65.1	Low	21 Å²	21	54.6 Å²	54.6	22%	0.216	33%	0.325	C	S	.	.	S	Bend	trans	87.2	17.7	177.7	0	0	0	0	0	114.7	D424	G415-D424 VanDerWaalsContact CA-CG 3.46Å; G415-D424 WeakPolarHBondContact CA-OD1 3.4Å; G415-D424 PolarHBondContact N-OD1 2.85Å; G415-D424 PolarHBondContact N-OD2 3.11Å
416	Y	66.3	Low	65.6	Low	40 Å²	40	53.4 Å²	53.4	16%	0.157	32%	0.32	C	S	.	.			trans	-125.6	133.3	179.6	-59.7	-108.3	0	0	0	109.8	N67 K402 K405 N414 E418 D424	N67-Y416 PolarHBondContact OD1-OH 3.27Å; K402-Y416 HydrophobicContact CD-CD1 4.24Å; K402-Y416 HydrophobicContact CD-CE1 3.63Å; K402-Y416 WeakPolarHBondContact CE-OH 3.44Å; K402-Y416 HydrophobicContact CG-CE1 4.13Å; K402-Y416 VanDerWaalsContact NZ-CD1 3.33Å; K402-Y416 PolarHBondContact NZ-OH 2.98Å; K405-Y416 HydrophobicContact CG-CE1 4.33Å; N414-Y416 HydrophobicContact CB-CD2 4.4Å; N414-Y416 WeakPolarHBondContact O-CD2 3.06Å; N414-Y416 VanDerWaalsContact O-CE2 3.31Å; N414-Y416 WeakPolarHBondContact O-CE2 3.4Å; N414-Y416 WeakPolarHBondContact OD1-CB 3.42Å; N414-Y416 VanDerWaalsContact OD1-CD2 3.32Å; N414-Y416 WeakPolarHBondContact OD1-CD2 3.3Å; N414-Y416 PolarHBondContact OD1-N 3.02Å; Y416-E418 PolarHBondContact O-N 2.93Å; Y416-D424 PolarHBondContact N-OD2 2.94Å; Y416-D424 WeakPolarHBondContact O-CB 3.22Å
417	V	67.8	Low	66.5	Low	89 Å²	89	54.2 Å²	54.2	54%	0.539	33%	0.329	S	S	.	.			trans	-83.4	104.1	174.4	-174.3	0	0	0	0	108.1	E421	V417-E421 HydrophobicContact CG1-CB 4.44Å; V417-E421 VanDerWaalsContact CG1-O 3.31Å; V417-E421 WeakPolarHBondContact CG1-O 3.24Å
418	E	65.1	Low	67.7	Low	34 Å²	34	59.2 Å²	59.2	16%	0.159	36%	0.355	C	S	.	.			trans	-100.4	173.3	-177.1	-67	177.2	129.9	0	0	111.7	P410 E411 N414 Y416 G420 E421	P410-E418 VanDerWaalsContact CA-OE2 3.31Å; P410-E418 WeakPolarHBondContact CA-OE2 3.33Å; P410-E418 HydrophobicContact CB-CB 3.65Å; P410-E418 HydrophobicContact CG-CB 4.07Å; E411-E418 PolarHBondContact N-OE2 3.13Å; N414-E418 PolarHBondContact ND2-OE2 2.8Å; Y416-E418 PolarHBondContact O-N 2.93Å; E418-G420 PolarHBondContact O-N 2.85Å; E418-E421 PolarHBondContact O-N 2.68Å
419	L	61.8	Low	69	Low	168 Å²	168	62.5 Å²	62.5	88%	0.88	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	108.4	-176.2	-81.5	164	0	0	0	111.8	P410	P410-L419 HydrophobicContact CG-CB 4.42Å; P410-L419 WeakPolarHBondContact CG-O 3.2Å
420	G	68.6	Low	69.9	Low	81 Å²	81	62.7 Å²	62.7	84%	0.835	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	107	-5.6	-177.9	0	0	0	0	0	114	E418	E418-G420 PolarHBondContact O-N 2.85Å
421	E	74.8	Confident	70.9	Confident	26 Å²	26	60.4 Å²	60.4	12%	0.121	35%	0.353	C	S	.	.			trans	-99.9	144	169.6	-58.8	-171.2	-172.6	0	0	110.6	P410 E411 C412 V417 E418 C442	P410-E421 VanDerWaalsContact C-OE1 3.27Å; P410-E421 HydrophobicContact CB-CG 4.21Å; E411-E421 PolarHBondContact N-OE1 3.24Å; C412-E421 VanDerWaalsContact CA-OE1 3.29Å; C412-E421 WeakPolarHBondContact CA-OE1 3.43Å; C412-E421 PolarHBondContact N-OE1 3.01Å; V417-E421 HydrophobicContact CG1-CB 4.44Å; V417-E421 VanDerWaalsContact CG1-O 3.31Å; V417-E421 WeakPolarHBondContact CG1-O 3.24Å; E418-E421 PolarHBondContact O-N 2.68Å; E421-C442 HydrophobicContact CB-CB 4.05Å; E421-C442 HydrophobicContact CG-CB 3.87Å; E421-C442 WeakPolarHBondContact OE2-CB 3.2Å
422	E	73	Confident	71.6	Confident	119 Å²	119	59 Å²	59	56%	0.556	36%	0.356	S	S	*	.	S	Bend	trans	-96.8	-21.1	173.1	-62.8	179	166.7	0	0	111.7	C442 L444	E422-C442 PolarHBondContact N-O 3.34Å; E422-L444 HydrophobicContact CB-CB 4.45Å; E422-L444 HydrophobicContact CB-CD1 4.13Å; E422-L444 HydrophobicContact CB-CG 3.98Å; E422-L444 PolarHBondContact OE2-N 3.31Å
423	C	78	Confident	72	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.007	37%	0.368	C	S	.	.			trans	-159	149.6	-178.9	61.5	0	0	0	0	111.4	C439 C442 T443 L444	C423-C439 HydrophobicContact CB-CB 3.89Å; C423-C439 WeakPolarHBondContact CB-SG 3.21Å; C423-C439 PolarHBondContact O-SG 2.96Å; C423-C439 WeakPolarHBondContact SG-CA 3.37Å; C423-C439 WeakPolarHBondContact SG-CB 3.29Å; C423-C439 CovalentContact SG-SG 2.04Å; C423-C439 PolarHBondContact SG-SG 3.02Å; C423-C442 PolarHBondContact N-O 2.6Å; C423-C442 CarbonylContact O-C 3.47Å; C423-C442 WeakPolarHBondContact O-CA 3.39Å; C423-C442 WeakPolarHBondContact O-CB 3.19Å; C423-C442 PolarHBondContact O-SG 3.04Å; C423-C442 VanDerWaalsContact O-SG 3.38Å; C423-T443 PolarHBondContact SG-O 3.43Å; C423-L444 HydrophobicContact CB-CD2 3.68Å; C423-L444 HydrophobicContact CB-CG 3.98Å
424	D	78.1	Confident	72.1	Confident	0 Å²	0	64 Å²	64	0%	0	37%	0.372	C	S	.	.			trans	-142.6	118.7	166	-169.1	-21.7	0	0	0	109.6	G413 N414 G415 Y416 G426 N452	G413-D424 WeakPolarHBondContact CA-OD1 3.33Å; G413-D424 WeakPolarHBondContact CA-OD2 3.29Å; G413-D424 VanDerWaalsContact N-CG 3.32Å; G413-D424 PolarHBondContact N-OD1 3.42Å; G413-D424 PolarHBondContact N-OD2 3.3Å; N414-D424 PolarHBondContact N-OD2 3.38Å; N414-D424 PolarHBondContact OD1-OD2 2.88Å; G415-D424 VanDerWaalsContact CA-CG 3.46Å; G415-D424 WeakPolarHBondContact CA-OD1 3.4Å; G415-D424 PolarHBondContact N-OD1 2.85Å; G415-D424 PolarHBondContact N-OD2 3.11Å; Y416-D424 PolarHBondContact N-OD2 2.94Å; Y416-D424 WeakPolarHBondContact O-CB 3.22Å; D424-G426 PolarHBondContact OD1-N 2.77Å; D424-N452 PolarHBondContact O-ND2 3.41Å; D424-N452 PolarHBondContact O-OD1 3.26Å
425	C	76.8	Confident	72.9	Confident	12 Å²	12	62.9 Å²	62.9	8%	0.081	37%	0.368	C	S	.	.			trans	-93.3	4.3	-177	48.1	0	0	0	0	113.6	C431 C439	C425-C431 HydrophobicContact CB-CB 3.61Å; C425-C431 WeakPolarHBondContact CB-SG 3.48Å; C425-C431 PolarHBondContact O-N 3.06Å; C425-C431 WeakPolarHBondContact SG-CB 3.29Å; C425-C431 CovalentContact SG-SG 2.01Å; C425-C431 PolarHBondContact SG-SG 3.45Å; C425-C439 HydrophobicContact CB-CB 4.32Å
426	G	72.8	Confident	73.7	Confident	4 Å²	4	63.6 Å²	63.6	4%	0.041	37%	0.372	C	S	.	.			trans	88.4	-164.9	-174.5	0	0	0	0	0	112	G413 D424	G413-G426 CarbonylContact C-O 3.51Å; G413-G426 WeakPolarHBondContact CA-O 3Å; G413-G426 CarbonylContact O-C 3.6Å; D424-G426 PolarHBondContact OD1-N 2.77Å
427	S	72.2	Confident	74.6	Confident	49 Å²	49	68.3 Å²	68.3	34%	0.343	40%	0.4	S	S	.	.	S	Bend	trans	-56.8	160.5	-179.1	63.6	0	0	0	0	111.3	G413 V429 E430 C431	G413-S427 WeakPolarHBondContact O-CA 3.39Å; G413-S427 PolarHBondContact O-N 2.92Å; S427-V429 PolarHBondContact O-N 3.45Å; S427-E430 PolarHBondContact N-OE2 2.81Å; S427-E430 PolarHBondContact O-N 3.48Å; S427-E430 WeakPolarHBondContact OG-CG 3.07Å; S427-E430 PolarHBondContact OG-N 3.1Å; S427-E430 PolarHBondContact OG-OE2 3.21Å; S427-C431 VanDerWaalsContact O-CB 3.29Å; S427-C431 WeakPolarHBondContact O-CB 3.37Å; S427-C431 PolarHBondContact O-N 3Å
428	L	73.3	Confident	75.4	Confident	165 Å²	165	64.6 Å²	64.6	86%	0.864	38%	0.378	S	S	*	.	H	α-helix	trans	-49.4	-35.1	176.8	-76.5	164.7	0	0	0	112.9	S432	L428-S432 WeakPolarHBondContact O-CB 3.37Å; L428-S432 PolarHBondContact O-N 3.11Å; L428-S432 VanDerWaalsContact O-N 3.1Å
429	V	75	Confident	76.4	Confident	97 Å²	97	63.2 Å²	63.2	59%	0.588	37%	0.372	S	S	*	.	H	α-helix	trans	-71.2	-49	177.6	-178.3	0	0	0	0	111.4	S427 S432 Q433	S427-V429 PolarHBondContact O-N 3.45Å; V429-S432 PolarHBondContact O-N 3.16Å; V429-S432 PolarHBondContact O-OG 2.81Å; V429-Q433 PolarHBondContact O-N 3.45Å
430	E	70.2	Confident	77.4	Confident	109 Å²	109	61.6 Å²	61.6	51%	0.509	36%	0.358	S	S	.	.	H	α-helix	trans	-65.5	-43.4	179.3	-69.6	170.1	149.2	0	0	111.6	S427 S432 Q433 S434	S427-E430 PolarHBondContact N-OE2 2.81Å; S427-E430 PolarHBondContact O-N 3.48Å; S427-E430 WeakPolarHBondContact OG-CG 3.07Å; S427-E430 PolarHBondContact OG-N 3.1Å; S427-E430 PolarHBondContact OG-OE2 3.21Å; E430-S432 VanDerWaalsContact C-N 3.26Å; E430-S432 PolarHBondContact O-N 2.83Å; E430-Q433 WeakPolarHBondContact O-CA 3.45Å; E430-Q433 WeakPolarHBondContact O-CB 3.49Å; E430-Q433 PolarHBondContact O-N 3.13Å; E430-S434 PolarHBondContact O-N 3.24Å
431	C	79.6	Confident	78.1	Confident	14 Å²	14	67.2 Å²	67.2	10%	0.095	36%	0.359	C	S	.	.	H	α-helix	trans	-59.7	-39.3	176.7	-168.6	0	0	0	0	111.3	C425 S427 Q433 S434 G435 A436	C425-C431 HydrophobicContact CB-CB 3.61Å; C425-C431 WeakPolarHBondContact CB-SG 3.48Å; C425-C431 PolarHBondContact O-N 3.06Å; C425-C431 WeakPolarHBondContact SG-CB 3.29Å; C425-C431 CovalentContact SG-SG 2.01Å; C425-C431 PolarHBondContact SG-SG 3.45Å; S427-C431 VanDerWaalsContact O-CB 3.29Å; S427-C431 WeakPolarHBondContact O-CB 3.37Å; S427-C431 PolarHBondContact O-N 3Å; C431-Q433 PolarHBondContact O-N 3.36Å; C431-S434 CarbonylContact O-C 3.55Å; C431-S434 VanDerWaalsContact O-C 3.27Å; C431-S434 PolarHBondContact O-N 3.15Å; C431-G435 PolarHBondContact O-N 3.37Å; C431-A436 WeakPolarHBondContact O-CB 3.04Å; C431-A436 PolarHBondContact O-N 2.81Å; C431-A436 VanDerWaalsContact SG-CA 3.52Å; C431-A436 PolarHBondContact SG-N 3.23Å
432	S	80.2	Confident	78.4	Confident	85 Å²	85	66.2 Å²	66.2	59%	0.594	36%	0.355	S	S	*	.	H	α-helix	trans	-60.8	-30.5	175.2	80.6	0	0	0	0	113.2	L428 V429 E430	L428-S432 WeakPolarHBondContact O-CB 3.37Å; L428-S432 PolarHBondContact O-N 3.11Å; L428-S432 VanDerWaalsContact O-N 3.1Å; V429-S432 PolarHBondContact O-N 3.16Å; V429-S432 PolarHBondContact O-OG 2.81Å; E430-S432 VanDerWaalsContact C-N 3.26Å; E430-S432 PolarHBondContact O-N 2.83Å
433	Q	79.3	Confident	78.8	Confident	144 Å²	144	64 Å²	64	67%	0.673	35%	0.349	S	S	*	.	H	α-helix	trans	-81.4	-39.3	177	-61.7	179.2	11.9	0	0	111.9	V429 E430 C431	V429-Q433 PolarHBondContact O-N 3.45Å; E430-Q433 WeakPolarHBondContact O-CA 3.45Å; E430-Q433 WeakPolarHBondContact O-CB 3.49Å; E430-Q433 PolarHBondContact O-N 3.13Å; C431-Q433 PolarHBondContact O-N 3.36Å
434	S	72.9	Confident	79	Confident	51 Å²	51	66 Å²	66	36%	0.357	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.3	100	-176	179.8	0	0	0	0	111.4	E430 C431	E430-S434 PolarHBondContact O-N 3.24Å; C431-S434 CarbonylContact O-C 3.55Å; C431-S434 VanDerWaalsContact O-C 3.27Å; C431-S434 PolarHBondContact O-N 3.15Å
435	G	78.8	Confident	79.3	Confident	11 Å²	11	67.5 Å²	67.5	11%	0.113	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	122.7	-11.2	167.4	0	0	0	0	0	116.2	C431 N437 C438 C439 S451	C431-G435 PolarHBondContact O-N 3.37Å; G435-N437 PolarHBondContact O-N 3.2Å; G435-N437 VanDerWaalsContact O-N 3.11Å; G435-C438 WeakPolarHBondContact O-CA 3.28Å; G435-C438 PolarHBondContact O-N 3.11Å; G435-C439 PolarHBondContact O-N 3.09Å; G435-S451 WeakPolarHBondContact CA-O 3.34Å
436	A	82.1	Confident	79.5	Confident	36 Å²	36	75.1 Å²	75.1	30%	0.298	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-27.1	-179.2	0	0	0	0	0	114.7	C431 C438	C431-A436 WeakPolarHBondContact O-CB 3.04Å; C431-A436 PolarHBondContact O-N 2.81Å; C431-A436 VanDerWaalsContact SG-CA 3.52Å; C431-A436 PolarHBondContact SG-N 3.23Å; A436-C438 VanDerWaalsContact C-N 3.31Å
437	N	85.5	Confident	79.6	Confident	140 Å²	140	80.9 Å²	80.9	75%	0.749	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-20.8	176.4	-65.6	-17.4	0	0	0	112.7	G435 T445	G435-N437 PolarHBondContact O-N 3.2Å; G435-N437 VanDerWaalsContact O-N 3.11Å; N437-T445 PolarHBondContact O-OG1 3.04Å
438	C	86.2	Confident	80.2	Confident	10 Å²	10	79.2 Å²	79.2	7%	0.068	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-30.7	-168.9	-49.7	0	0	0	0	112.3	G435 A436 T445 A448 C450 C459	G435-C438 WeakPolarHBondContact O-CA 3.28Å; G435-C438 PolarHBondContact O-N 3.11Å; A436-C438 VanDerWaalsContact C-N 3.31Å; C438-T445 WeakPolarHBondContact CA-OG1 3.44Å; C438-T445 PolarHBondContact O-N 2.96Å; C438-T445 PolarHBondContact O-OG1 3.2Å; C438-A448 HydrophobicContact CB-CB 4.37Å; C438-C450 VanDerWaalsContact CB-O 3.28Å; C438-C450 WeakPolarHBondContact CB-O 3.35Å; C438-C459 WeakPolarHBondContact CA-SG 3.27Å; C438-C459 HydrophobicContact CB-CB 3.57Å; C438-C459 WeakPolarHBondContact CB-SG 3.09Å; C438-C459 WeakPolarHBondContact SG-CA 3.49Å; C438-C459 WeakPolarHBondContact SG-CB 3.18Å; C438-C459 CovalentContact SG-SG 2.01Å; C438-C459 PolarHBondContact SG-SG 2.93Å
439	C	84.3	Confident	80.7	Confident	5 Å²	5	76.3 Å²	76.3	3%	0.034	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	126.9	-175.8	-165.9	0	0	0	0	110.3	C423 C425 G435	C423-C439 HydrophobicContact CB-CB 3.89Å; C423-C439 WeakPolarHBondContact CB-SG 3.21Å; C423-C439 PolarHBondContact O-SG 2.96Å; C423-C439 WeakPolarHBondContact SG-CA 3.37Å; C423-C439 WeakPolarHBondContact SG-CB 3.29Å; C423-C439 CovalentContact SG-SG 2.04Å; C423-C439 PolarHBondContact SG-SG 3.02Å; C425-C439 HydrophobicContact CB-CB 4.32Å; G435-C439 PolarHBondContact O-N 3.09Å
440	K	84.4	Confident	81	Confident	134 Å²	134	71.9 Å²	71.9	58%	0.583	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.1	125.2	174.7	-71.9	-173.4	-179.5	-179.4	0	109.1	C442 T443 T445	K440-C442 PolarHBondContact O-N 3.15Å; K440-T443 PolarHBondContact N-O 3.5Å; K440-T443 PolarHBondContact O-N 2.81Å; K440-T443 PolarHBondContact O-OG1 3.43Å; K440-T445 HydrophobicContact CB-CG2 4.31Å; K440-T445 HydrophobicContact CD-CG2 3.99Å; K440-T445 HydrophobicContact CG-CG2 3.84Å
441	K	82.8	Confident	81.6	Confident	199 Å²	199	67 Å²	67	87%	0.865	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	41.6	-176.8	-56	-176.3	177.3	-173.7	0	112	T443	K441-T443 PolarHBondContact O-N 2.89Å; K441-T443 VanDerWaalsContact O-N 3.08Å
442	C	79.9	Confident	81.5	Confident	6 Å²	6	67.8 Å²	67.8	4%	0.041	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.8	27.2	-179.2	-58	0	0	0	0	116.4	C412 E421 E422 C423 K440	C412-C442 VanDerWaalsContact C-SG 3.55Å; C412-C442 WeakPolarHBondContact CA-SG 3.36Å; C412-C442 HydrophobicContact CB-CB 3.51Å; C412-C442 WeakPolarHBondContact CB-SG 3.41Å; C412-C442 WeakPolarHBondContact SG-CB 3.22Å; C412-C442 PolarHBondContact SG-N 3.18Å; C412-C442 CovalentContact SG-SG 2.01Å; C412-C442 PolarHBondContact SG-SG 3.17Å; E421-C442 HydrophobicContact CB-CB 4.05Å; E421-C442 HydrophobicContact CG-CB 3.87Å; E421-C442 WeakPolarHBondContact OE2-CB 3.2Å; E422-C442 PolarHBondContact N-O 3.34Å; C423-C442 PolarHBondContact N-O 2.6Å; C423-C442 CarbonylContact O-C 3.47Å; C423-C442 WeakPolarHBondContact O-CA 3.39Å; C423-C442 WeakPolarHBondContact O-CB 3.19Å; C423-C442 PolarHBondContact O-SG 3.04Å; C423-C442 VanDerWaalsContact O-SG 3.38Å; K440-C442 PolarHBondContact O-N 3.15Å
443	T	82.3	Confident	81.4	Confident	71 Å²	71	64.9 Å²	64.9	44%	0.436	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	141.6	168.6	56.8	0	0	0	0	109.2	C423 K440 K441	C423-T443 PolarHBondContact SG-O 3.43Å; K440-T443 PolarHBondContact N-O 3.5Å; K440-T443 PolarHBondContact O-N 2.81Å; K440-T443 PolarHBondContact O-OG1 3.43Å; K441-T443 PolarHBondContact O-N 2.89Å; K441-T443 VanDerWaalsContact O-N 3.08Å
444	L	81.4	Confident	81.6	Confident	43 Å²	43	60.9 Å²	60.9	23%	0.225	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	138.5	178.7	-75	168.1	0	0	0	109.4	E422 C423 A448	E422-L444 HydrophobicContact CB-CB 4.45Å; E422-L444 HydrophobicContact CB-CD1 4.13Å; E422-L444 HydrophobicContact CB-CG 3.98Å; E422-L444 PolarHBondContact OE2-N 3.31Å; C423-L444 HydrophobicContact CB-CD2 3.68Å; C423-L444 HydrophobicContact CB-CG 3.98Å; L444-A448 HydrophobicContact CB-CB 4.23Å; L444-A448 HydrophobicContact CD2-CB 3.99Å
445	T	84.9	Confident	82.3	Confident	33 Å²	33	58.5 Å²	58.5	20%	0.202	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-70.8	160.5	173.8	56.9	0	0	0	0	111.1	N437 C438 K440 N447 A448	N437-T445 PolarHBondContact O-OG1 3.04Å; C438-T445 WeakPolarHBondContact CA-OG1 3.44Å; C438-T445 PolarHBondContact O-N 2.96Å; C438-T445 PolarHBondContact O-OG1 3.2Å; K440-T445 HydrophobicContact CB-CG2 4.31Å; K440-T445 HydrophobicContact CD-CG2 3.99Å; K440-T445 HydrophobicContact CG-CG2 3.84Å; T445-N447 PolarHBondContact O-N 3.05Å; T445-A448 VanDerWaalsContact O-CB 3.23Å; T445-A448 WeakPolarHBondContact O-CB 3.44Å; T445-A448 PolarHBondContact O-N 3.09Å
446	H	80.4	Confident	82.7	Confident	171 Å²	171	58.9 Å²	58.9	79%	0.792	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	126.5	-179.2	-174	-79	0	0	0	111.9	A448	H446-A448 VanDerWaalsContact C-N 3.31Å
447	N	76.9	Confident	83	Confident	125 Å²	125	65.8 Å²	65.8	67%	0.668	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	10.1	-173.3	-57.2	-33	0	0	0	116.6	T445	T445-N447 PolarHBondContact O-N 3.05Å
448	A	84	Confident	83	Confident	15 Å²	15	62.5 Å²	62.5	12%	0.124	33%	0.328	C	S	.	.			trans	-86.9	136.1	170.6	0	0	0	0	0	110.8	C438 L444 T445 H446 C459	C438-A448 HydrophobicContact CB-CB 4.37Å; L444-A448 HydrophobicContact CB-CB 4.23Å; L444-A448 HydrophobicContact CD2-CB 3.99Å; T445-A448 VanDerWaalsContact O-CB 3.23Å; T445-A448 WeakPolarHBondContact O-CB 3.44Å; T445-A448 PolarHBondContact O-N 3.09Å; H446-A448 VanDerWaalsContact C-N 3.31Å; A448-C459 CarbonylContact C-O 3.45Å; A448-C459 WeakPolarHBondContact CA-O 3.45Å; A448-C459 HydrophobicContact CB-CB 3.72Å
449	M	83.3	Confident	83.1	Confident	103 Å²	103	63 Å²	63	51%	0.507	33%	0.332	S	S	.	.	S	Bend	trans	-108.7	-19.2	172.9	-63.6	170.6	168.5	0	0	111.5	C459 Y461	M449-C459 PolarHBondContact N-O 2.81Å; M449-Y461 HydrophobicContact CB-CD2 4.03Å; M449-Y461 HydrophobicContact CB-CE2 3.87Å; M449-Y461 WeakPolarHBondContact O-CE1 3.31Å; M449-Y461 PolarHBondContact O-OH 3.08Å; M449-Y461 HydrophobicContact SD-CD2 4.5Å
450	C	82.5	Confident	83.2	Confident	5 Å²	5	68.5 Å²	68.5	3%	0.034	36%	0.355	C	S	.	.			trans	-148.7	160.5	178.6	63.6	0	0	0	0	111	C438 C456 C459 K460 Y461	C438-C450 VanDerWaalsContact CB-O 3.28Å; C438-C450 WeakPolarHBondContact CB-O 3.35Å; C450-C456 VanDerWaalsContact C-SG 3.51Å; C450-C456 HydrophobicContact CB-CB 3.78Å; C450-C456 WeakPolarHBondContact CB-SG 3.49Å; C450-C456 WeakPolarHBondContact SG-CA 3.16Å; C450-C456 WeakPolarHBondContact SG-CB 3.43Å; C450-C456 CovalentContact SG-SG 2.03Å; C450-C456 PolarHBondContact SG-SG 2.99Å; C450-C459 PolarHBondContact N-O 3.44Å; C450-C459 WeakPolarHBondContact O-CA 3.45Å; C450-C459 VanDerWaalsContact SG-C 3.5Å; C450-K460 PolarHBondContact SG-N 2.84Å; C450-K460 PolarHBondContact SG-O 2.04Å; C450-Y461 HydrophobicContact CB-CD1 3.8Å; C450-Y461 HydrophobicContact CB-CE1 3.66Å
451	S	81.6	Confident	83.3	Confident	7 Å²	7	66 Å²	66	5%	0.049	34%	0.343	C	S	.	.	S	Bend	trans	-106.3	-56.5	177.7	55.8	0	0	0	0	113.7	G435	G435-S451 WeakPolarHBondContact CA-O 3.34Å
452	N	76.9	Confident	83.6	Confident	29 Å²	29	58.3 Å²	58.3	16%	0.155	31%	0.31	C	S	.	.	S	Bend	trans	-139	178.7	-175.8	64.7	-11.8	0	0	0	109.9	D424 C456 S486	D424-N452 PolarHBondContact O-ND2 3.41Å; D424-N452 PolarHBondContact O-OD1 3.26Å; N452-C456 WeakPolarHBondContact O-CB 3.26Å; N452-S486 VanDerWaalsContact O-CB 3.23Å; N452-S486 WeakPolarHBondContact O-CB 2.96Å; N452-S486 PolarHBondContact O-OG 3.44Å
453	G	78.5	Confident	83.9	Confident	25 Å²	25	62.4 Å²	62.4	26%	0.258	33%	0.331	S	S	.	.	S	Bend	trans	109.3	162.1	-180	0	0	0	0	0	113.4	C455 C456 S486	G453-C455 PolarHBondContact O-N 2.66Å; G453-C456 PolarHBondContact O-N 2.81Å; G453-S486 CarbonylContact C-O 3.36Å; G453-S486 VanDerWaalsContact C-O 3.3Å; G453-S486 VanDerWaalsContact CA-O 3.32Å; G453-S486 WeakPolarHBondContact CA-O 3.24Å
454	L	83.2	Confident	84.1	Confident	60 Å²	60	62.1 Å²	62.1	31%	0.314	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-25.6	-175.3	-67.5	174.7	0	0	0	112.7	C468 S486 C488	L454-C468 HydrophobicContact CB-CB 3.92Å; L454-S486 PolarHBondContact N-O 2.87Å; L454-C488 HydrophobicContact CB-CB 4.21Å; L454-C488 HydrophobicContact CD1-CB 3.94Å
455	C	89.1	Confident	84.2	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	24.2	178.4	-65.2	0	0	0	0	112.6	G453 Y461 E462 C468 C481 S485 S486	G453-C455 PolarHBondContact O-N 2.66Å; C455-Y461 WeakPolarHBondContact O-CA 3.21Å; C455-E462 PolarHBondContact O-N 2.84Å; C455-C468 VanDerWaalsContact SG-SG 3.63Å; C455-C481 WeakPolarHBondContact CA-SG 3.04Å; C455-C481 HydrophobicContact CB-CB 3.67Å; C455-C481 WeakPolarHBondContact CB-SG 3.03Å; C455-C481 WeakPolarHBondContact SG-CA 3.37Å; C455-C481 WeakPolarHBondContact SG-CB 3.43Å; C455-C481 CovalentContact SG-SG 2.03Å; C455-C481 PolarHBondContact SG-SG 3.3Å; C455-S485 VanDerWaalsContact CB-O 3.29Å; C455-S485 WeakPolarHBondContact CB-O 3.39Å; C455-S486 WeakPolarHBondContact CA-O 3.3Å; C455-S486 WeakPolarHBondContact CB-O 3.28Å; C455-S486 PolarHBondContact N-O 3.15Å
456	C	87.3	Confident	84.3	Confident	20 Å²	20	62 Å²	62	14%	0.135	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	120.6	177.7	-174.9	0	0	0	0	111.6	C450 N452 G453	C450-C456 VanDerWaalsContact C-SG 3.51Å; C450-C456 HydrophobicContact CB-CB 3.78Å; C450-C456 WeakPolarHBondContact CB-SG 3.49Å; C450-C456 WeakPolarHBondContact SG-CA 3.16Å; C450-C456 WeakPolarHBondContact SG-CB 3.43Å; C450-C456 CovalentContact SG-SG 2.03Å; C450-C456 PolarHBondContact SG-SG 2.99Å; N452-C456 WeakPolarHBondContact O-CB 3.26Å; G453-C456 PolarHBondContact O-N 2.81Å
457	R	87.8	Confident	84.8	Confident	181 Å²	181	57.3 Å²	57.3	68%	0.683	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.9	124.3	177.7	-173	170.6	-179.7	-179.4	0.6	111.8	C459 K460 E462	R457-C459 VanDerWaalsContact C-N 3.25Å; R457-C459 PolarHBondContact O-N 2.76Å; R457-K460 PolarHBondContact N-O 3.47Å; R457-K460 PolarHBondContact O-N 2.84Å; R457-K460 VanDerWaalsContact O-N 3.13Å; R457-K460 VanDerWaalsContact O-O 3.13Å; R457-E462 HydrophobicContact CB-CG 4.07Å; R457-E462 WeakPolarHBondContact CB-OE1 3.47Å; R457-E462 WeakPolarHBondContact CD-OE1 3.29Å; R457-E462 IonicContact NH1-OE1 2.79Å
458	G	85.9	Confident	85.3	Confident	70 Å²	70	52.4 Å²	52.4	72%	0.722	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	38.6	-179.9	0	0	0	0	0	112.8	K460	G458-K460 PolarHBondContact O-N 3.07Å
459	C	86.9	Confident	85.5	Confident	21 Å²	21	52.4 Å²	52.4	14%	0.142	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	13.7	-176.9	-41.6	0	0	0	0	115.4	C438 A448 M449 C450 R457	C438-C459 WeakPolarHBondContact CA-SG 3.27Å; C438-C459 HydrophobicContact CB-CB 3.57Å; C438-C459 WeakPolarHBondContact CB-SG 3.09Å; C438-C459 WeakPolarHBondContact SG-CA 3.49Å; C438-C459 WeakPolarHBondContact SG-CB 3.18Å; C438-C459 CovalentContact SG-SG 2.01Å; C438-C459 PolarHBondContact SG-SG 2.93Å; A448-C459 CarbonylContact C-O 3.45Å; A448-C459 WeakPolarHBondContact CA-O 3.45Å; A448-C459 HydrophobicContact CB-CB 3.72Å; M449-C459 PolarHBondContact N-O 2.81Å; C450-C459 PolarHBondContact N-O 3.44Å; C450-C459 WeakPolarHBondContact O-CA 3.45Å; C450-C459 VanDerWaalsContact SG-C 3.5Å; R457-C459 VanDerWaalsContact C-N 3.25Å; R457-C459 PolarHBondContact O-N 2.76Å
460	K	87.9	Confident	85.8	Confident	121 Å²	121	52 Å²	52	53%	0.526	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	150	174.1	-63.4	-169.9	177.4	-171.3	0	110.2	C450 R457 G458 E462	C450-K460 PolarHBondContact SG-N 2.84Å; C450-K460 PolarHBondContact SG-O 2.04Å; R457-K460 PolarHBondContact N-O 3.47Å; R457-K460 PolarHBondContact O-N 2.84Å; R457-K460 VanDerWaalsContact O-N 3.13Å; R457-K460 VanDerWaalsContact O-O 3.13Å; G458-K460 PolarHBondContact O-N 3.07Å; K460-E462 PolarHBondContact O-N 2.82Å
461	Y	86.4	Confident	86.1	Confident	82 Å²	82	53.3 Å²	53.3	32%	0.322	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	139.3	171.4	-59.1	-52.1	0	0	0	109.5	M449 C450 C455 G483 D484 S485	M449-Y461 HydrophobicContact CB-CD2 4.03Å; M449-Y461 HydrophobicContact CB-CE2 3.87Å; M449-Y461 WeakPolarHBondContact O-CE1 3.31Å; M449-Y461 PolarHBondContact O-OH 3.08Å; M449-Y461 HydrophobicContact SD-CD2 4.5Å; C450-Y461 HydrophobicContact CB-CD1 3.8Å; C450-Y461 HydrophobicContact CB-CE1 3.66Å; C455-Y461 WeakPolarHBondContact O-CA 3.21Å; Y461-G483 WeakPolarHBondContact CB-O 3.47Å; Y461-D484 WeakPolarHBondContact CE2-O 3.4Å; Y461-S485 WeakPolarHBondContact CD1-O 3.03Å
462	E	88.8	Confident	86.4	Confident	36 Å²	36	55.5 Å²	55.5	17%	0.168	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-62.6	150.5	166.7	-80	-72.7	-171	0	0	109.6	C455 R457 K460 V466 C481 G483	C455-E462 PolarHBondContact O-N 2.84Å; R457-E462 HydrophobicContact CB-CG 4.07Å; R457-E462 WeakPolarHBondContact CB-OE1 3.47Å; R457-E462 WeakPolarHBondContact CD-OE1 3.29Å; R457-E462 IonicContact NH1-OE1 2.79Å; K460-E462 PolarHBondContact O-N 2.82Å; E462-V466 HydrophobicContact CB-CB 4.22Å; E462-V466 HydrophobicContact CB-CG1 4.31Å; E462-V466 HydrophobicContact CB-CG2 4.37Å; E462-V466 HydrophobicContact CG-CG1 4.39Å; E462-C481 HydrophobicContact CB-CB 4.23Å; E462-G483 WeakPolarHBondContact O-CA 3.17Å
463	L	85.6	Confident	86.9	Confident	93 Å²	93	56.1 Å²	56.1	49%	0.487	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-61.8	149.6	180	-66.8	171.2	0	0	0	110.7	G465 V466	L463-G465 PolarHBondContact O-N 2.71Å; L463-V466 HydrophobicContact CB-CG2 4.21Å; L463-V466 WeakPolarHBondContact O-CB 3.49Å; L463-V466 VanDerWaalsContact O-CG2 3.3Å; L463-V466 WeakPolarHBondContact O-CG2 3.47Å; L463-V466 PolarHBondContact O-N 3.4Å
464	R	85.9	Confident	87.5	Confident	65 Å²	65	59.1 Å²	59.1	25%	0.245	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	135.5	171.3	-174.3	170.7	66.3	75.1	-3.6	109.5	C481 T482 P669 D680 I682	R464-C481 CarbonylContact C-O 3.55Å; R464-C481 VanDerWaalsContact CA-O 3.29Å; R464-C481 WeakPolarHBondContact CA-O 3.48Å; R464-T482 WeakPolarHBondContact CB-O 3.45Å; R464-T482 WeakPolarHBondContact CG-O 3.4Å; R464-P669 PolarHBondContact NH1-O 3.37Å; R464-D680 IonicContact CZ-OD2 2.76Å; R464-D680 PolarHBondContact NH2-O 3.4Å; R464-D680 IonicContact NH2-OD2 2.74Å; R464-D680 PolarHBondContact NH2-OD2 3.18Å; R464-I682 WeakPolarHBondContact O-CD1 3.02Å
465	G	83.9	Confident	88	Confident	20 Å²	20	56.2 Å²	56.2	21%	0.206	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.4	-6.1	178.9	0	0	0	0	0	115.4	L463 T467 T480 C481	L463-G465 PolarHBondContact O-N 2.71Å; G465-T467 PolarHBondContact O-N 3.48Å; G465-T480 WeakPolarHBondContact O-CG2 3.44Å; G465-C481 PolarHBondContact N-O 2.93Å
466	V	87.7	Confident	88.1	Confident	52 Å²	52	56.6 Å²	56.6	32%	0.315	31%	0.31	S	S	.	.			trans	-67.7	119.2	171.1	173.3	0	0	0	0	109.5	E462 L463 C468 T480 C481	E462-V466 HydrophobicContact CB-CB 4.22Å; E462-V466 HydrophobicContact CB-CG1 4.31Å; E462-V466 HydrophobicContact CB-CG2 4.37Å; E462-V466 HydrophobicContact CG-CG1 4.39Å; L463-V466 HydrophobicContact CB-CG2 4.21Å; L463-V466 WeakPolarHBondContact O-CB 3.49Å; L463-V466 VanDerWaalsContact O-CG2 3.3Å; L463-V466 WeakPolarHBondContact O-CG2 3.47Å; L463-V466 PolarHBondContact O-N 3.4Å; V466-C468 PolarHBondContact O-N 2.76Å; V466-T480 CarbonylContact O-C 3.58Å; V466-T480 VanDerWaalsContact O-CA 3.28Å; V466-T480 WeakPolarHBondContact O-CA 3.4Å; V466-C481 HydrophobicContact CB-CB 4.4Å; V466-C481 PolarHBondContact O-N 3.03Å; V466-C481 PolarHBondContact O-SG 2.97Å; V466-C481 VanDerWaalsContact O-SG 3.36Å
467	T	89.9	Confident	88.3	Confident	73 Å²	73	56.1 Å²	56.1	45%	0.448	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	118.7	177.8	-49.9	0	0	0	0	110.9	G465 R469 P478 E479	G465-T467 PolarHBondContact O-N 3.48Å; T467-R469 VanDerWaalsContact CG2-O 3.28Å; T467-R469 WeakPolarHBondContact CG2-O 3.41Å; T467-P478 HydrophobicContact CG2-CB 4.22Å; T467-E479 WeakPolarHBondContact CA-O 3.26Å
468	C	87.9	Confident	88.5	Confident	22 Å²	22	50.4 Å²	50.4	15%	0.149	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-27.6	176.2	50.4	0	0	0	0	112.6	L454 C455 V466 E479 C488	L454-C468 HydrophobicContact CB-CB 3.92Å; C455-C468 VanDerWaalsContact SG-SG 3.63Å; V466-C468 PolarHBondContact O-N 2.76Å; C468-E479 PolarHBondContact N-O 3.39Å; C468-E479 PolarHBondContact SG-O 3.2Å; C468-E479 VanDerWaalsContact SG-O 3.34Å; C468-C488 HydrophobicContact CB-CB 3.71Å; C468-C488 WeakPolarHBondContact CB-SG 3.24Å; C468-C488 WeakPolarHBondContact SG-CA 3.42Å; C468-C488 WeakPolarHBondContact SG-CB 3.48Å; C468-C488 CovalentContact SG-SG 2.03Å; C468-C488 PolarHBondContact SG-SG 2.92Å
469	R	88.2	Confident	88.7	Confident	15 Å²	15	47.5 Å²	47.5	6%	0.057	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	132	170.4	-170.6	-172.2	72	84.3	-2.2	110.2	T467 D476 I477 P478 E479 N491	T467-R469 VanDerWaalsContact CG2-O 3.28Å; T467-R469 WeakPolarHBondContact CG2-O 3.41Å; R469-D476 IonicContact CZ-OD1 3.64Å; R469-D476 IonicContact CZ-OD2 3.31Å; R469-D476 IonicContact NH1-OD1 2.95Å; R469-D476 IonicContact NH1-OD2 3.43Å; R469-D476 PolarHBondContact NH1-OD2 3.07Å; R469-D476 IonicContact NH2-OD1 3.74Å; R469-D476 PolarHBondContact NH2-OD1 3.11Å; R469-D476 IonicContact NH2-OD2 2.92Å; R469-D476 PolarHBondContact NH2-OD2 3.37Å; R469-I477 PolarHBondContact NH2-O 2.81Å; R469-I477 VanDerWaalsContact NH2-O 3.07Å; R469-P478 WeakPolarHBondContact O-CA 3.49Å; R469-E479 WeakPolarHBondContact CB-OE2 3.4Å; R469-E479 IonicContact CZ-OE1 2.79Å; R469-E479 IonicContact CZ-OE2 2.66Å; R469-E479 PolarHBondContact N-O 3.35Å; R469-E479 IonicContact NE-OE1 3.74Å; R469-E479 IonicContact NE-OE2 3.88Å; R469-E479 PolarHBondContact NE-OE2 3.46Å; R469-E479 IonicContact NH2-OE1 3.22Å; R469-E479 PolarHBondContact NH2-OE1 3.09Å; R469-E479 IonicContact NH2-OE2 3.71Å; R469-E479 PolarHBondContact NH2-OE2 2.8Å; R469-E479 PolarHBondContact O-N 3.05Å; R469-E479 VanDerWaalsContact O-N 3.14Å; R469-N491 VanDerWaalsContact NH2-CG 3.35Å; R469-N491 PolarHBondContact NH2-OD1 3Å
470	D	89.1	Confident	88.9	Confident	94 Å²	94	48.7 Å²	48.7	50%	0.503	27%	0.267	S	S	.	.			trans	-79.9	143.4	174	-63.9	-49.4	0	0	0	110.2	Q196	Q196-D470 PolarHBondContact NE2-OD2 3.49Å
471	G	88.9	Confident	88.9	Confident	34 Å²	34	42.9 Å²	42.9	35%	0.351	24%	0.241	S	C	.	.			trans	-67.1	136	172.7	0	0	0	0	0	111.2	D476	G471-D476 WeakPolarHBondContact CA-OD2 3.4Å
472	V	87.8	Confident	88.8	Confident	52 Å²	52	42 Å²	42	32%	0.315	25%	0.245	S	C	.	.	S	Bend	trans	-80.2	-23	-177.4	-57.8	0	0	0	0	113.6	V199 Q392 D476	V199-V472 HydrophobicContact CG2-CG1 3.58Å; Q392-V472 VanDerWaalsContact O-CG2 3.29Å; Q392-V472 WeakPolarHBondContact O-CG2 3.21Å; V472-D476 HydrophobicContact CG2-CB 4.03Å; V472-D476 WeakPolarHBondContact CG2-OD2 3.3Å; V472-D476 PolarHBondContact N-OD2 3.35Å
473	N	88.1	Confident	88.6	Confident	42 Å²	42	41.7 Å²	41.7	23%	0.225	25%	0.251	C	S	.	.	S	Bend	trans	-156.3	176.2	179.4	66.5	55.3	0	0	0	111	Q393 C475 D476 G510	Q393-N473 PolarHBondContact O-ND2 3.27Å; N473-C475 PolarHBondContact O-N 2.03Å; N473-C475 VanDerWaalsContact O-N 3.09Å; N473-C475 VanDerWaalsContact OD1-CA 3.24Å; N473-C475 WeakPolarHBondContact OD1-CA 3.17Å; N473-C475 WeakPolarHBondContact OD1-CB 3.46Å; N473-C475 PolarHBondContact OD1-N 3.33Å; N473-D476 PolarHBondContact O-N 2.83Å; N473-D476 VanDerWaalsContact O-N 3.08Å; N473-D476 PolarHBondContact OD1-N 3.4Å; N473-G510 PolarHBondContact ND2-O 3.19Å
474	D	91.9	Very high	88.5	Confident	88 Å²	88	42.6 Å²	42.6	47%	0.471	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-19.6	-179.4	-68.8	-7.7	0	0	0	114.9	K494 C500 E501	D474-K494 WeakPolarHBondContact O-CD 3.45Å; D474-K494 WeakPolarHBondContact O-CE 3.29Å; D474-K494 PolarHBondContact O-NZ 3.38Å; D474-C500 HydrophobicContact CB-CB 3.73Å; D474-E501 PolarHBondContact OD2-N 3.22Å
475	C	92.8	Very high	88.3	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-11.7	179.8	-62	0	0	0	0	113.5	N473 H493 K494 C507	N473-C475 PolarHBondContact O-N 2.03Å; N473-C475 VanDerWaalsContact O-N 3.09Å; N473-C475 VanDerWaalsContact OD1-CA 3.24Å; N473-C475 WeakPolarHBondContact OD1-CA 3.17Å; N473-C475 WeakPolarHBondContact OD1-CB 3.46Å; N473-C475 PolarHBondContact OD1-N 3.33Å; C475-H493 WeakPolarHBondContact O-CB 3.44Å; C475-K494 WeakPolarHBondContact O-CB 3.32Å; C475-K494 WeakPolarHBondContact O-CG 3.38Å; C475-K494 PolarHBondContact O-N 2.93Å; C475-C507 WeakPolarHBondContact CA-SG 3.38Å; C475-C507 HydrophobicContact CB-CB 3.63Å; C475-C507 WeakPolarHBondContact CB-SG 3.38Å; C475-C507 WeakPolarHBondContact SG-CA 3.32Å; C475-C507 WeakPolarHBondContact SG-CB 3.5Å; C475-C507 CovalentContact SG-SG 2.03Å; C475-C507 PolarHBondContact SG-SG 2.95Å
476	D	92.1	Very high	88.2	Confident	8 Å²	8	41.6 Å²	41.6	4%	0.043	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-88.7	146.6	176.2	-168.9	17.8	0	0	0	110.1	R469 G471 V472 N473 N491	R469-D476 IonicContact CZ-OD1 3.64Å; R469-D476 IonicContact CZ-OD2 3.31Å; R469-D476 IonicContact NH1-OD1 2.95Å; R469-D476 IonicContact NH1-OD2 3.43Å; R469-D476 PolarHBondContact NH1-OD2 3.07Å; R469-D476 IonicContact NH2-OD1 3.74Å; R469-D476 PolarHBondContact NH2-OD1 3.11Å; R469-D476 IonicContact NH2-OD2 2.92Å; R469-D476 PolarHBondContact NH2-OD2 3.37Å; G471-D476 WeakPolarHBondContact CA-OD2 3.4Å; V472-D476 HydrophobicContact CG2-CB 4.03Å; V472-D476 WeakPolarHBondContact CG2-OD2 3.3Å; V472-D476 PolarHBondContact N-OD2 3.35Å; N473-D476 PolarHBondContact O-N 2.83Å; N473-D476 VanDerWaalsContact O-N 3.08Å; N473-D476 PolarHBondContact OD1-N 3.4Å; D476-N491 PolarHBondContact OD1-OD1 2.02Å
477	I	91.7	Very high	87.9	Confident	9 Å²	9	44 Å²	44	5%	0.046	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-101.9	127.3	178.7	-59.6	175	0	0	0	107.7	R469 E479 V492 K494 T658 I666	R469-I477 PolarHBondContact NH2-O 2.81Å; R469-I477 VanDerWaalsContact NH2-O 3.07Å; I477-E479 PolarHBondContact O-N 2.9Å; I477-E479 VanDerWaalsContact O-OE1 3.07Å; I477-V492 HydrophobicContact CB-CG2 4.44Å; I477-V492 WeakPolarHBondContact CB-O 3.24Å; I477-V492 HydrophobicContact CD1-CG2 4.4Å; I477-V492 PolarHBondContact N-O 3.46Å; I477-K494 HydrophobicContact CD1-CG 4.17Å; I477-K494 HydrophobicContact CG1-CG 3.69Å; I477-T658 HydrophobicContact CD1-CG2 4.03Å; I477-T658 HydrophobicContact CG1-CG2 4.33Å; I477-I666 HydrophobicContact CD1-CG1 4.15Å; I477-I666 HydrophobicContact CG2-CB 4.44Å; I477-I666 HydrophobicContact CG2-CG1 4.43Å; I477-I666 HydrophobicContact CG2-CG2 4.09Å
478	P	91.4	Very high	87.7	Confident	62 Å²	62	41.9 Å²	41.9	40%	0.403	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-69.1	127.4	172.8	28.4	-33	0	0	0	110.3	T467 R469	T467-P478 HydrophobicContact CG2-CB 4.22Å; R469-P478 WeakPolarHBondContact O-CA 3.49Å
479	E	89.9	Confident	87.6	Confident	8 Å²	8	43 Å²	43	4%	0.037	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	135	176.6	-66.9	73.2	-164.8	0	0	111.2	T467 C468 R469 I477 P489 N491 V492	T467-E479 WeakPolarHBondContact CA-O 3.26Å; C468-E479 PolarHBondContact N-O 3.39Å; C468-E479 PolarHBondContact SG-O 3.2Å; C468-E479 VanDerWaalsContact SG-O 3.34Å; R469-E479 WeakPolarHBondContact CB-OE2 3.4Å; R469-E479 IonicContact CZ-OE1 2.79Å; R469-E479 IonicContact CZ-OE2 2.66Å; R469-E479 PolarHBondContact N-O 3.35Å; R469-E479 IonicContact NE-OE1 3.74Å; R469-E479 IonicContact NE-OE2 3.88Å; R469-E479 PolarHBondContact NE-OE2 3.46Å; R469-E479 IonicContact NH2-OE1 3.22Å; R469-E479 PolarHBondContact NH2-OE1 3.09Å; R469-E479 IonicContact NH2-OE2 3.71Å; R469-E479 PolarHBondContact NH2-OE2 2.8Å; R469-E479 PolarHBondContact O-N 3.05Å; R469-E479 VanDerWaalsContact O-N 3.14Å; I477-E479 PolarHBondContact O-N 2.9Å; I477-E479 VanDerWaalsContact O-OE1 3.07Å; E479-P489 HydrophobicContact CB-CB 4.39Å; E479-P489 HydrophobicContact CG-CB 4.23Å; E479-N491 WeakPolarHBondContact OE1-CA 3.33Å; E479-V492 PolarHBondContact OE1-N 3.4Å
480	T	90.1	Very high	87.4	Confident	46 Å²	46	46.2 Å²	46.2	28%	0.282	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	142.3	176.9	57.3	0	0	0	0	110.2	G465 V466 T482 P489	G465-T480 WeakPolarHBondContact O-CG2 3.44Å; V466-T480 CarbonylContact O-C 3.58Å; V466-T480 VanDerWaalsContact O-CA 3.28Å; V466-T480 WeakPolarHBondContact O-CA 3.4Å; T480-T482 PolarHBondContact O-N 3.44Å; T480-P489 WeakPolarHBondContact O-CG 3.27Å
481	C	88.3	Confident	87.2	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	26%	0.255	C	S	.	.			trans	-54.1	137.8	172.2	-59	0	0	0	0	110.7	C455 E462 R464 G465 V466 G483	C455-C481 WeakPolarHBondContact CA-SG 3.04Å; C455-C481 HydrophobicContact CB-CB 3.67Å; C455-C481 WeakPolarHBondContact CB-SG 3.03Å; C455-C481 WeakPolarHBondContact SG-CA 3.37Å; C455-C481 WeakPolarHBondContact SG-CB 3.43Å; C455-C481 CovalentContact SG-SG 2.03Å; C455-C481 PolarHBondContact SG-SG 3.3Å; E462-C481 HydrophobicContact CB-CB 4.23Å; R464-C481 CarbonylContact C-O 3.55Å; R464-C481 VanDerWaalsContact CA-O 3.29Å; R464-C481 WeakPolarHBondContact CA-O 3.48Å; G465-C481 PolarHBondContact N-O 2.93Å; V466-C481 HydrophobicContact CB-CB 4.4Å; V466-C481 PolarHBondContact O-N 3.03Å; V466-C481 PolarHBondContact O-SG 2.97Å; V466-C481 VanDerWaalsContact O-SG 3.36Å; C481-G483 VanDerWaalsContact C-N 3.34Å
482	T	84.7	Confident	87.2	Confident	63 Å²	63	41.5 Å²	41.5	39%	0.387	24%	0.241	S	C	.	.			trans	-78.3	-21.6	-179.2	50.5	0	0	0	0	112.6	R464 T480 D484 P489	R464-T482 WeakPolarHBondContact CB-O 3.45Å; R464-T482 WeakPolarHBondContact CG-O 3.4Å; T480-T482 PolarHBondContact O-N 3.44Å; T482-D484 WeakPolarHBondContact CB-OD1 3.21Å; T482-D484 PolarHBondContact OG1-OD1 2.74Å; T482-P489 HydrophobicContact CG2-CG 4.06Å
483	G	85.2	Confident	87.3	Confident	29 Å²	29	39.9 Å²	39.9	30%	0.299	23%	0.23	S	C	.	.	S	Bend	trans	96.9	-10	-177.9	0	0	0	0	0	114.5	Y461 E462 C481	Y461-G483 WeakPolarHBondContact CB-O 3.47Å; E462-G483 WeakPolarHBondContact O-CA 3.17Å; C481-G483 VanDerWaalsContact C-N 3.34Å
484	D	81.8	Confident	87.5	Confident	113 Å²	113	40.2 Å²	40.2	60%	0.604	23%	0.23	S	C	*	.	S	Bend	trans	-127.7	2.9	-176.1	64.4	-14.8	0	0	0	113.4	Y461 T482	Y461-D484 WeakPolarHBondContact CE2-O 3.4Å; T482-D484 WeakPolarHBondContact CB-OD1 3.21Å; T482-D484 PolarHBondContact OG1-OD1 2.74Å
485	S	83.6	Confident	87.4	Confident	42 Å²	42	37.2 Å²	37.2	29%	0.294	21%	0.214	S	C	.	.			trans	-130.8	146.5	178.8	-179.2	0	0	0	0	111.1	C455 Y461 Q487	C455-S485 VanDerWaalsContact CB-O 3.29Å; C455-S485 WeakPolarHBondContact CB-O 3.39Å; Y461-S485 WeakPolarHBondContact CD1-O 3.03Å; S485-Q487 PolarHBondContact OG-N 3.05Å; S485-Q487 PolarHBondContact OG-O 3.33Å
486	S	81.1	Confident	87.3	Confident	22 Å²	22	39.1 Å²	39.1	15%	0.154	22%	0.224	C	C	.	.	S	Bend	trans	-85.2	-19.4	174.8	68.4	0	0	0	0	112.8	N452 G453 L454 C455	N452-S486 VanDerWaalsContact O-CB 3.23Å; N452-S486 WeakPolarHBondContact O-CB 2.96Å; N452-S486 PolarHBondContact O-OG 3.44Å; G453-S486 CarbonylContact C-O 3.36Å; G453-S486 VanDerWaalsContact C-O 3.3Å; G453-S486 VanDerWaalsContact CA-O 3.32Å; G453-S486 WeakPolarHBondContact CA-O 3.24Å; L454-S486 PolarHBondContact N-O 2.87Å; C455-S486 WeakPolarHBondContact CA-O 3.3Å; C455-S486 WeakPolarHBondContact CB-O 3.28Å; C455-S486 PolarHBondContact N-O 3.15Å
487	Q	81.4	Confident	87.1	Confident	102 Å²	102	39.2 Å²	39.2	48%	0.477	23%	0.227	S	C	.	.	S	Bend	trans	-89.7	147.4	178.1	-60	-61.2	-17	0	0	110.6	S485	S485-Q487 PolarHBondContact OG-N 3.05Å; S485-Q487 PolarHBondContact OG-O 3.33Å
488	C	84.8	Confident	87	Confident	28 Å²	28	41.8 Å²	41.8	19%	0.189	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-69.7	139.7	168.1	-164.1	0	0	0	0	108.4	L454 C468	L454-C488 HydrophobicContact CB-CB 4.21Å; L454-C488 HydrophobicContact CD1-CB 3.94Å; C468-C488 HydrophobicContact CB-CB 3.71Å; C468-C488 WeakPolarHBondContact CB-SG 3.24Å; C468-C488 WeakPolarHBondContact SG-CA 3.42Å; C468-C488 WeakPolarHBondContact SG-CB 3.48Å; C468-C488 CovalentContact SG-SG 2.03Å; C468-C488 PolarHBondContact SG-SG 2.92Å
489	P	86.7	Confident	87.1	Confident	46 Å²	46	42.9 Å²	42.9	30%	0.299	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-51.6	154.4	170.9	-26.9	35.7	0	0	0	112.1	E479 T480 T482	E479-P489 HydrophobicContact CB-CB 4.39Å; E479-P489 HydrophobicContact CG-CB 4.23Å; T480-P489 WeakPolarHBondContact O-CG 3.27Å; T482-P489 HydrophobicContact CG2-CG 4.06Å
490	H	83.2	Confident	87.3	Confident	83 Å²	83	42.7 Å²	42.7	38%	0.384	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-65.8	151.1	178.6	66.5	-79	0	0	0	111.3	V492 E662	H490-V492 PolarHBondContact O-N 2.66Å; H490-E662 IonicContact CD2-OE1 3.15Å; H490-E662 IonicContact CE1-OE1 3.92Å; H490-E662 IonicContact NE2-OE1 3.72Å; H490-E662 PolarHBondContact NE2-OE1 3.06Å; H490-E662 IonicContact NE2-OE2 3.81Å
491	N	84.9	Confident	87.2	Confident	18 Å²	18	43.8 Å²	43.8	10%	0.096	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-65.7	121.9	-174.1	-178.3	-12.2	0	0	0	111.3	F400 R469 D476 E479	F400-N491 HydrophobicContact CB-CB 4.01Å; F400-N491 HydrophobicContact CD2-CB 3.94Å; F400-N491 HydrophobicContact CG-CB 4.13Å; R469-N491 VanDerWaalsContact NH2-CG 3.35Å; R469-N491 PolarHBondContact NH2-OD1 3Å; D476-N491 PolarHBondContact OD1-OD1 2.02Å; E479-N491 WeakPolarHBondContact OE1-CA 3.33Å
492	V	89.7	Confident	87.2	Confident	11 Å²	11	49 Å²	49	7%	0.067	29%	0.286	C	S	.	.			trans	-128	150	175.8	-66.4	0	0	0	0	110.7	I477 E479 H490 I666	I477-V492 HydrophobicContact CB-CG2 4.44Å; I477-V492 WeakPolarHBondContact CB-O 3.24Å; I477-V492 HydrophobicContact CD1-CG2 4.4Å; I477-V492 PolarHBondContact N-O 3.46Å; E479-V492 PolarHBondContact OE1-N 3.4Å; H490-V492 PolarHBondContact O-N 2.66Å; V492-I666 HydrophobicContact CG2-CD1 4.41Å; V492-I666 HydrophobicContact CG2-CG1 4.47Å
493	H	90.3	Very high	87.2	Confident	17 Å²	17	48.3 Å²	48.3	8%	0.079	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-119.5	166.6	178	63.5	75.2	0	0	0	110.9	C475 G510 S660 N661	C475-H493 WeakPolarHBondContact O-CB 3.44Å; H493-G510 PolarHBondContact CE1-N 2.81Å; H493-G510 VanDerWaalsContact CE1-N 3.33Å; H493-G510 VanDerWaalsContact CG-CA 3.42Å; H493-G510 WeakPolarHBondContact ND1-CA 3.37Å; H493-G510 PolarHBondContact ND1-N 2.75Å; H493-S660 CarbonylContact O-C 3.6Å; H493-S660 VanDerWaalsContact O-CA 3.31Å; H493-S660 WeakPolarHBondContact O-CA 3.49Å; H493-N661 WeakPolarHBondContact CE1-CB 2.99Å; H493-N661 PolarHBondContact N-OD1 3.01Å; H493-N661 PolarHBondContact O-N 3.43Å; H493-N661 PolarHBondContact O-OD1 2.91Å
494	K	91.8	Very high	87.3	Confident	49 Å²	49	52.6 Å²	52.6	21%	0.213	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-59.8	144.9	176.6	-61.8	-174.6	-176	170.8	0	109.8	D474 C475 I477 Y498 T658	D474-K494 WeakPolarHBondContact O-CD 3.45Å; D474-K494 WeakPolarHBondContact O-CE 3.29Å; D474-K494 PolarHBondContact O-NZ 3.38Å; C475-K494 WeakPolarHBondContact O-CB 3.32Å; C475-K494 WeakPolarHBondContact O-CG 3.38Å; C475-K494 PolarHBondContact O-N 2.93Å; I477-K494 HydrophobicContact CD1-CG 4.17Å; I477-K494 HydrophobicContact CG1-CG 3.69Å; K494-Y498 HydrophobicContact CB-CD2 4.26Å; K494-Y498 HydrophobicContact CB-CG 4.11Å; K494-Y498 HydrophobicContact CD-CD1 3.96Å; K494-Y498 HydrophobicContact CD-CG 4.23Å; K494-T658 HydrophobicContact CD-CG2 4.08Å; K494-T658 HydrophobicContact CG-CG2 3.76Å
495	L	90.2	Very high	87.8	Confident	26 Å²	26	47.3 Å²	47.3	14%	0.136	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-56.7	149.2	172.2	-171.6	71.8	0	0	0	110.3	Y498 S642 C659	L495-Y498 HydrophobicContact CB-CD2 4.34Å; L495-Y498 HydrophobicContact CB-CE2 4.09Å; L495-Y498 WeakPolarHBondContact O-CD2 3.38Å; L495-S642 WeakPolarHBondContact CD2-O 3.49Å; L495-C659 HydrophobicContact CB-CB 4.48Å; L495-C659 PolarHBondContact N-O 2.04Å
496	D	89.6	Confident	88.3	Confident	40 Å²	40	46.5 Å²	46.5	21%	0.214	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	141.5	177.4	-66.1	-13.9	0	0	0	111.2	C507 Y508 G509 L641	D496-C507 CarbonylContact C-O 3.54Å; D496-C507 WeakPolarHBondContact CA-O 3.47Å; D496-Y508 HydrophobicContact CB-CD2 4.03Å; D496-Y508 WeakPolarHBondContact OD1-CA 3.31Å; D496-G509 PolarHBondContact OD1-N 2.92Å; D496-L641 HydrophobicContact CB-CD2 3.73Å; D496-L641 WeakPolarHBondContact O-CD1 3.39Å
497	G	88.6	Confident	88.8	Confident	10 Å²	10	45.5 Å²	45.5	10%	0.103	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	102	-14.5	-179.7	0	0	0	0	0	115.5	R506 C507	G497-R506 PolarHBondContact O-NH1 2.86Å; G497-C507 PolarHBondContact N-O 2.77Å
498	Y	90.8	Very high	89.2	Confident	63 Å²	63	43.6 Å²	43.6	25%	0.247	25%	0.248	C	C	.	.			trans	-58.5	146.4	171.4	-86	-108.3	0	0	0	111.1	K494 L495 R506 C507 T658 C659	K494-Y498 HydrophobicContact CB-CD2 4.26Å; K494-Y498 HydrophobicContact CB-CG 4.11Å; K494-Y498 HydrophobicContact CD-CD1 3.96Å; K494-Y498 HydrophobicContact CD-CG 4.23Å; L495-Y498 HydrophobicContact CB-CD2 4.34Å; L495-Y498 HydrophobicContact CB-CE2 4.09Å; L495-Y498 WeakPolarHBondContact O-CD2 3.38Å; Y498-R506 CarbonylContact O-C 3.59Å; Y498-R506 VanDerWaalsContact O-CA 3.23Å; Y498-R506 WeakPolarHBondContact O-CA 3.39Å; Y498-C507 PolarHBondContact O-N 2.58Å; Y498-T658 HydrophobicContact CE1-CG2 4Å; Y498-C659 HydrophobicContact CE2-CB 4.27Å; Y498-C659 WeakPolarHBondContact OH-CB 3.48Å; Y498-C659 PolarHBondContact OH-N 2.9Å; Y498-C659 VanDerWaalsContact OH-N 3.08Å
499	T	92.4	Very high	89.2	Confident	85 Å²	85	44 Å²	44	52%	0.521	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	143.8	177.8	52.4	0	0	0	0	111.7	G505	T499-G505 WeakPolarHBondContact CA-O 3.35Å
500	C	93.4	Very high	89.2	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.02	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	170.2	178.7	55.8	0	0	0	0	111.1	D474 A502 G503 Q504 G505 R506 C512	D474-C500 HydrophobicContact CB-CB 3.73Å; C500-A502 PolarHBondContact O-N 3.29Å; C500-G503 PolarHBondContact O-N 2.94Å; C500-Q504 PolarHBondContact O-N 2.88Å; C500-G505 PolarHBondContact N-O 3.37Å; C500-G505 PolarHBondContact O-N 3.41Å; C500-R506 PolarHBondContact SG-N 3.35Å; C500-R506 VanDerWaalsContact SG-N 3.37Å; C500-C512 HydrophobicContact CB-CB 3.79Å; C500-C512 WeakPolarHBondContact CB-SG 3.01Å; C500-C512 WeakPolarHBondContact SG-CA 3.43Å; C500-C512 WeakPolarHBondContact SG-CB 3.38Å; C500-C512 CovalentContact SG-SG 2.02Å; C500-C512 PolarHBondContact SG-SG 3.37Å
501	E	89.6	Confident	89.5	Confident	70 Å²	70	41 Å²	41	33%	0.327	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	51.1	52.4	-177.3	-70.6	-171.1	169.4	0	0	112.1	D474 G503 Q504 T514	D474-E501 PolarHBondContact OD2-N 3.22Å; E501-G503 PolarHBondContact O-N 2.84Å; E501-G503 VanDerWaalsContact O-N 3.14Å; E501-Q504 HydrophobicContact CB-CB 4.4Å; E501-Q504 WeakPolarHBondContact O-CB 3.37Å; E501-Q504 WeakPolarHBondContact O-CG 3.15Å; E501-Q504 PolarHBondContact O-N 3.28Å; E501-Q504 VanDerWaalsContact O-N 3.11Å; E501-T514 WeakPolarHBondContact OE2-CG2 2.99Å
502	A	86.7	Confident	89.9	Confident	108 Å²	108	41.8 Å²	41.8	89%	0.893	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	53.9	32.5	-177.8	0	0	0	0	0	114.5	C500	C500-A502 PolarHBondContact O-N 3.29Å
503	G	85.1	Confident	90	Very high	49 Å²	49	42.6 Å²	42.6	51%	0.505	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	90.7	2.1	177.3	0	0	0	0	0	114.7	C500 E501	C500-G503 PolarHBondContact O-N 2.94Å; E501-G503 PolarHBondContact O-N 2.84Å; E501-G503 VanDerWaalsContact O-N 3.14Å
504	Q	87.6	Confident	90.2	Very high	120 Å²	120	42.2 Å²	42.2	56%	0.561	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-24.3	175.3	-62.1	-178.1	9.2	0	0	112.6	C500 E501 P621	C500-Q504 PolarHBondContact O-N 2.88Å; E501-Q504 HydrophobicContact CB-CB 4.4Å; E501-Q504 WeakPolarHBondContact O-CB 3.37Å; E501-Q504 WeakPolarHBondContact O-CG 3.15Å; E501-Q504 PolarHBondContact O-N 3.28Å; E501-Q504 VanDerWaalsContact O-N 3.11Å; Q504-P621 WeakPolarHBondContact O-CG 3.29Å
505	G	92.9	Very high	90.4	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	173.6	-178.2	0	0	0	0	0	114.2	T499 C500 K513	T499-G505 WeakPolarHBondContact CA-O 3.35Å; C500-G505 PolarHBondContact N-O 3.37Å; C500-G505 PolarHBondContact O-N 3.41Å; G505-K513 VanDerWaalsContact CA-O 3.26Å; G505-K513 WeakPolarHBondContact CA-O 3.27Å
506	R	92.7	Very high	90.5	Very high	26 Å²	26	43.5 Å²	43.5	10%	0.098	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	147.6	169.8	-71.2	-177.4	179.6	-79.3	-8.7	111.6	G497 Y498 C500 K513 P621	G497-R506 PolarHBondContact O-NH1 2.86Å; Y498-R506 CarbonylContact O-C 3.59Å; Y498-R506 VanDerWaalsContact O-CA 3.23Å; Y498-R506 WeakPolarHBondContact O-CA 3.39Å; C500-R506 PolarHBondContact SG-N 3.35Å; C500-R506 VanDerWaalsContact SG-N 3.37Å; R506-K513 PolarHBondContact N-O 2.95Å; R506-K513 PolarHBondContact O-N 3.01Å; R506-P621 HydrophobicContact CG-CB 4.27Å
507	C	92.3	Very high	90.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	128.6	174.2	-58.1	0	0	0	0	110.1	C475 D496 G497 Y498 R511	C475-C507 WeakPolarHBondContact CA-SG 3.38Å; C475-C507 HydrophobicContact CB-CB 3.63Å; C475-C507 WeakPolarHBondContact CB-SG 3.38Å; C475-C507 WeakPolarHBondContact SG-CA 3.32Å; C475-C507 WeakPolarHBondContact SG-CB 3.5Å; C475-C507 CovalentContact SG-SG 2.03Å; C475-C507 PolarHBondContact SG-SG 2.95Å; D496-C507 CarbonylContact C-O 3.54Å; D496-C507 WeakPolarHBondContact CA-O 3.47Å; G497-C507 PolarHBondContact N-O 2.77Å; Y498-C507 PolarHBondContact O-N 2.58Å; C507-R511 WeakPolarHBondContact CA-O 3.23Å
508	Y	89.4	Confident	90.9	Very high	63 Å²	63	42.8 Å²	42.8	25%	0.247	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	114.9	175	-165.8	-103.8	0	0	0	109.7	D496 R511 D618 M627	D496-Y508 HydrophobicContact CB-CD2 4.03Å; D496-Y508 WeakPolarHBondContact OD1-CA 3.31Å; Y508-R511 PolarHBondContact N-O 2.87Å; Y508-R511 PolarHBondContact O-N 3.24Å; Y508-D618 HydrophobicContact CE1-CB 4.1Å; Y508-M627 HydrophobicContact CD2-CE 3.62Å; Y508-M627 HydrophobicContact CE2-CE 3.79Å
509	G	84.8	Confident	91	Very high	36 Å²	36	39.8 Å²	39.8	37%	0.371	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	45.4	-173.2	0	0	0	0	0	112.7	D496 R511	D496-G509 PolarHBondContact OD1-N 2.92Å; G509-R511 PolarHBondContact O-N 2.89Å
510	G	87.3	Confident	90.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	1.2	178.3	0	0	0	0	0	115.7	N473 H493	N473-G510 PolarHBondContact ND2-O 3.19Å; H493-G510 PolarHBondContact CE1-N 2.81Å; H493-G510 VanDerWaalsContact CE1-N 3.33Å; H493-G510 VanDerWaalsContact CG-CA 3.42Å; H493-G510 WeakPolarHBondContact ND1-CA 3.37Å; H493-G510 PolarHBondContact ND1-N 2.75Å
511	R	89.1	Confident	90.6	Very high	66 Å²	66	42.8 Å²	42.8	25%	0.249	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	143.5	-177.1	-58.8	-176.1	-79.1	-174.1	-9.5	111.3	Q393 C507 Y508 G509 K513	Q393-R511 WeakPolarHBondContact O-CG 3.49Å; C507-R511 WeakPolarHBondContact CA-O 3.23Å; Y508-R511 PolarHBondContact N-O 2.87Å; Y508-R511 PolarHBondContact O-N 3.24Å; G509-R511 PolarHBondContact O-N 2.89Å; R511-K513 PolarHBondContact O-N 3.35Å
512	C	92.9	Very high	90.5	Very high	35 Å²	35	39.7 Å²	39.7	24%	0.236	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	118.3	171.7	-172.3	0	0	0	0	110.8	C500	C500-C512 HydrophobicContact CB-CB 3.79Å; C500-C512 WeakPolarHBondContact CB-SG 3.01Å; C500-C512 WeakPolarHBondContact SG-CA 3.43Å; C500-C512 WeakPolarHBondContact SG-CB 3.38Å; C500-C512 CovalentContact SG-SG 2.02Å; C500-C512 PolarHBondContact SG-SG 3.37Å
513	K	93.6	Very high	90.5	Very high	28 Å²	28	34.8 Å²	34.8	12%	0.122	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	119.4	179.9	-65	-60.8	-164.5	169.2	0	111.3	G505 R506 R511 D617 P621	G505-K513 VanDerWaalsContact CA-O 3.26Å; G505-K513 WeakPolarHBondContact CA-O 3.27Å; R506-K513 PolarHBondContact N-O 2.95Å; R506-K513 PolarHBondContact O-N 3.01Å; R511-K513 PolarHBondContact O-N 3.35Å; K513-D617 HydrophobicContact CD-CB 4.36Å; K513-D617 IonicContact NZ-OD2 3.02Å; K513-D617 PolarHBondContact NZ-OD2 2.8Å; K513-P621 WeakPolarHBondContact O-CD 3.42Å
514	T	94.4	Very high	90.6	Very high	9 Å²	9	33.9 Å²	33.9	6%	0.055	18%	0.176	C	C	.	.			trans	-139.3	147.6	173.4	58.7	0	0	0	0	110.8	E501 D516 G517 Q518	E501-T514 WeakPolarHBondContact OE2-CG2 2.99Å; T514-D516 VanDerWaalsContact C-N 3.29Å; T514-D516 PolarHBondContact O-N 3.13Å; T514-G517 PolarHBondContact O-N 2.98Å; T514-G517 WeakPolarHBondContact OG1-CA 3.46Å; T514-G517 PolarHBondContact OG1-N 2.04Å; T514-Q518 PolarHBondContact O-N 3.11Å
515	R	94.8	Very high	90.7	Very high	57 Å²	57	31.3 Å²	31.3	22%	0.215	16%	0.162	C	C	.	.	H	α-helix	trans	-59.6	-41.8	172.6	-71.5	-177	-73.7	-82.1	-10.4	111.3	Q518 C519 L568 V616 T620 P621	R515-Q518 PolarHBondContact O-N 3.06Å; R515-C519 PolarHBondContact O-N 2.8Å; R515-L568 HydrophobicContact CB-CD1 4.42Å; R515-L568 HydrophobicContact CG-CD1 4.5Å; R515-V616 HydrophobicContact CG-CG1 4.22Å; R515-V616 HydrophobicContact CG-CG2 4.34Å; R515-T620 HydrophobicContact CG-CG2 3.72Å; R515-P621 PolarHBondContact NH1-O 2.83Å
516	D	93.6	Very high	90.7	Very high	44 Å²	44	35.1 Å²	35.1	24%	0.235	18%	0.182	C	C	.	.	H	α-helix	trans	-63.8	-44.8	176.5	-74.6	-38.9	0	0	0	112.2	T514 Q518 C519 R520 S527	T514-D516 VanDerWaalsContact C-N 3.29Å; T514-D516 PolarHBondContact O-N 3.13Å; D516-Q518 VanDerWaalsContact C-N 3.28Å; D516-Q518 PolarHBondContact O-N 3.08Å; D516-C519 PolarHBondContact O-N 2.9Å; D516-R520 WeakPolarHBondContact O-CB 3.24Å; D516-R520 VanDerWaalsContact O-CG 3.31Å; D516-R520 WeakPolarHBondContact O-CG 3.32Å; D516-R520 PolarHBondContact O-N 2.86Å; D516-S527 VanDerWaalsContact CG-OG 3.32Å; D516-S527 WeakPolarHBondContact OD1-CA 3.45Å; D516-S527 VanDerWaalsContact OD1-CB 3.23Å; D516-S527 WeakPolarHBondContact OD1-CB 3.36Å; D516-S527 PolarHBondContact OD1-N 2.86Å; D516-S527 PolarHBondContact OD1-OG 3.14Å
517	G	91.9	Very high	90.7	Very high	17 Å²	17	34.9 Å²	34.9	18%	0.175	19%	0.185	C	C	.	.	H	α-helix	trans	-60.3	-39.7	176.4	0	0	0	0	0	112.2	T514 T521	T514-G517 PolarHBondContact O-N 2.98Å; T514-G517 WeakPolarHBondContact OG1-CA 3.46Å; T514-G517 PolarHBondContact OG1-N 2.04Å; G517-T521 VanDerWaalsContact O-CB 3.3Å; G517-T521 WeakPolarHBondContact O-CB 3.35Å; G517-T521 PolarHBondContact O-N 2.79Å; G517-T521 PolarHBondContact O-OG1 2.95Å
518	Q	93.1	Very high	90.8	Very high	18 Å²	18	35.2 Å²	35.2	8%	0.084	19%	0.187	C	C	.	.	H	α-helix	trans	-65.5	-50.4	175.8	-167.1	179.6	-0.7	0	0	111.7	T514 R515 D516 R520 T521 L522 L568 L613 Y615 D617	T514-Q518 PolarHBondContact O-N 3.11Å; R515-Q518 PolarHBondContact O-N 3.06Å; D516-Q518 VanDerWaalsContact C-N 3.28Å; D516-Q518 PolarHBondContact O-N 3.08Å; Q518-R520 PolarHBondContact O-N 2.8Å; Q518-T521 PolarHBondContact O-N 2.92Å; Q518-L522 WeakPolarHBondContact O-CB 3.38Å; Q518-L522 PolarHBondContact O-N 3.4Å; Q518-L568 HydrophobicContact CB-CD1 4.49Å; Q518-L568 HydrophobicContact CB-CD2 4.29Å; Q518-L568 HydrophobicContact CG-CD2 3.74Å; Q518-L613 PolarHBondContact NE2-O 3.42Å; Q518-L613 VanDerWaalsContact NE2-O 3.17Å; Q518-Y615 PolarHBondContact NE2-O 3.39Å; Q518-D617 PolarHBondContact NE2-OD1 3.47Å
519	C	93	Very high	91	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.3	-41.7	176.3	-77.2	0	0	0	0	112.4	R515 D516 T521 L522 W523 G524 Y525 S527 C570	R515-C519 PolarHBondContact O-N 2.8Å; D516-C519 PolarHBondContact O-N 2.9Å; C519-T521 VanDerWaalsContact C-N 3.3Å; C519-T521 PolarHBondContact O-N 3.34Å; C519-L522 PolarHBondContact O-N 2.85Å; C519-W523 WeakPolarHBondContact O-CA 3.45Å; C519-W523 PolarHBondContact O-N 2.89Å; C519-G524 PolarHBondContact O-N 3.22Å; C519-G524 VanDerWaalsContact O-N 3.16Å; C519-Y525 CarbonylContact C-O 3.59Å; C519-Y525 WeakPolarHBondContact CB-O 3.1Å; C519-S527 VanDerWaalsContact SG-CA 3.56Å; C519-C570 HydrophobicContact CB-CB 3.82Å; C519-C570 WeakPolarHBondContact CB-SG 3.47Å; C519-C570 WeakPolarHBondContact SG-CB 3.39Å; C519-C570 CovalentContact SG-SG 2.04Å; C519-C570 PolarHBondContact SG-SG 2.93Å
520	R	91.1	Very high	91.3	Very high	102 Å²	102	40.9 Å²	40.9	39%	0.385	20%	0.203	S	C	.	.	H	α-helix	trans	-65.1	-37.7	178.9	-77.6	-174.1	-117.1	132.4	-2.6	111.3	D516 Q518 G524 Y525 N526	D516-R520 WeakPolarHBondContact O-CB 3.24Å; D516-R520 VanDerWaalsContact O-CG 3.31Å; D516-R520 WeakPolarHBondContact O-CG 3.32Å; D516-R520 PolarHBondContact O-N 2.86Å; Q518-R520 PolarHBondContact O-N 2.8Å; R520-G524 WeakPolarHBondContact O-CA 3.39Å; R520-G524 PolarHBondContact O-N 3.37Å; R520-G524 VanDerWaalsContact O-N 3.11Å; R520-Y525 VanDerWaalsContact CA-O 3.24Å; R520-Y525 WeakPolarHBondContact CA-O 2.98Å; R520-Y525 WeakPolarHBondContact CG-O 3.39Å; R520-Y525 PolarHBondContact N-O 3.04Å; R520-N526 WeakPolarHBondContact CD-OD1 3.4Å; R520-N526 WeakPolarHBondContact CG-OD1 3.16Å; R520-N526 PolarHBondContact NE-OD1 2.91Å
521	T	86.4	Confident	91.6	Very high	50 Å²	50	43.3 Å²	43.3	31%	0.307	21%	0.214	S	C	.	.	H	α-helix	trans	-69.9	-49.3	177.9	-61.3	0	0	0	0	110.9	G517 Q518 C519 F579	G517-T521 VanDerWaalsContact O-CB 3.3Å; G517-T521 WeakPolarHBondContact O-CB 3.35Å; G517-T521 PolarHBondContact O-N 2.79Å; G517-T521 PolarHBondContact O-OG1 2.95Å; Q518-T521 PolarHBondContact O-N 2.92Å; C519-T521 VanDerWaalsContact C-N 3.3Å; C519-T521 PolarHBondContact O-N 3.34Å; T521-F579 HydrophobicContact CG2-CD2 4.14Å; T521-F579 HydrophobicContact CG2-CE2 3.66Å; T521-F579 WeakPolarHBondContact O-CE2 3.04Å
522	L	87.1	Confident	91.8	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-77.9	-42	-172.5	-175.5	58.2	0	0	0	113.2	Q518 C519 L568 P577 R578 F579 A605 L613	Q518-L522 WeakPolarHBondContact O-CB 3.38Å; Q518-L522 PolarHBondContact O-N 3.4Å; C519-L522 PolarHBondContact O-N 2.85Å; L522-L568 HydrophobicContact CD2-CD2 4.43Å; L522-P577 HydrophobicContact CD1-CB 3.92Å; L522-P577 HydrophobicContact CG-CB 4.37Å; L522-R578 WeakPolarHBondContact O-CB 3.12Å; L522-R578 PolarHBondContact O-N 2.84Å; L522-F579 HydrophobicContact CD1-CB 4.35Å; L522-F579 WeakPolarHBondContact CD1-O 3.4Å; L522-A605 HydrophobicContact CD1-CB 3.79Å; L522-A605 HydrophobicContact CD2-CB 3.91Å; L522-A605 HydrophobicContact CG-CB 4.28Å; L522-L613 HydrophobicContact CD1-CB 4.19Å; L522-L613 HydrophobicContact CD1-CD1 3.92Å; L522-L613 HydrophobicContact CD2-CB 3.9Å; L522-L613 WeakPolarHBondContact CD2-O 3.13Å
523	W	86.8	Confident	91.9	Very high	5 Å²	5	38.5 Å²	38.5	2%	0.019	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.1	-16.5	-171.3	-56.1	104.1	0	0	0	113.9	C519 Y525 L573 P577 L582 L586 A605	C519-W523 WeakPolarHBondContact O-CA 3.45Å; C519-W523 PolarHBondContact O-N 2.89Å; W523-Y525 HydrophobicContact CB-CD2 4.26Å; W523-Y525 VanDerWaalsContact O-CD2 3.27Å; W523-Y525 WeakPolarHBondContact O-CD2 3.25Å; W523-L573 HydrophobicContact CB-CD2 3.33Å; W523-L573 HydrophobicContact CD2-CD1 4.24Å; W523-L573 HydrophobicContact CD2-CD2 3.65Å; W523-L573 HydrophobicContact CE3-CD2 3.98Å; W523-L573 HydrophobicContact CG-CD1 4.47Å; W523-L573 HydrophobicContact CG-CD2 3.35Å; W523-P577 HydrophobicContact CD2-CB 4.47Å; W523-P577 HydrophobicContact CE3-CB 4.01Å; W523-P577 HydrophobicContact CH2-CB 3.56Å; W523-P577 HydrophobicContact CH2-CG 3.86Å; W523-P577 HydrophobicContact CZ2-CB 4.07Å; W523-P577 VanDerWaalsContact CZ3-CA 3.43Å; W523-P577 HydrophobicContact CZ3-CB 3.56Å; W523-P577 VanDerWaalsContact CZ3-CD 3.4Å; W523-P577 HydrophobicContact CZ3-CG 3.99Å; W523-L582 HydrophobicContact CH2-CD1 4.03Å; W523-L586 HydrophobicContact CH2-CD2 4.05Å; W523-L586 HydrophobicContact CZ3-CD2 4.15Å; W523-A605 HydrophobicContact CZ2-CB 4.19Å
524	G	87	Confident	91.9	Very high	30 Å²	30	41 Å²	41	31%	0.309	20%	0.203	S	C	.	.	S	Bend	trans	86.3	2.6	-174.7	0	0	0	0	0	115	C519 R520	C519-G524 PolarHBondContact O-N 3.22Å; C519-G524 VanDerWaalsContact O-N 3.16Å; R520-G524 WeakPolarHBondContact O-CA 3.39Å; R520-G524 PolarHBondContact O-N 3.37Å; R520-G524 VanDerWaalsContact O-N 3.11Å
525	Y	90.6	Very high	91.8	Very high	67 Å²	67	45.3 Å²	45.3	26%	0.263	22%	0.221	S	C	.	.	S	Bend	trans	-118.9	168.8	-177.2	-62.4	-79.8	0	0	0	111.9	C519 R520 W523 T571 N572 L573	C519-Y525 CarbonylContact C-O 3.59Å; C519-Y525 WeakPolarHBondContact CB-O 3.1Å; R520-Y525 VanDerWaalsContact CA-O 3.24Å; R520-Y525 WeakPolarHBondContact CA-O 2.98Å; R520-Y525 WeakPolarHBondContact CG-O 3.39Å; R520-Y525 PolarHBondContact N-O 3.04Å; W523-Y525 HydrophobicContact CB-CD2 4.26Å; W523-Y525 VanDerWaalsContact O-CD2 3.27Å; W523-Y525 WeakPolarHBondContact O-CD2 3.25Å; Y525-T571 WeakPolarHBondContact CB-O 3.42Å; Y525-T571 VanDerWaalsContact CG-O 3.28Å; Y525-N572 HydrophobicContact CD1-CB 3.86Å; Y525-N572 HydrophobicContact CE1-CB 3.85Å; Y525-N572 WeakPolarHBondContact CE2-O 3.5Å; Y525-N572 HydrophobicContact CG-CB 4.44Å; Y525-L573 HydrophobicContact CD2-CD2 4.13Å
526	N	92.4	Very high	91.7	Very high	80 Å²	80	42.6 Å²	42.6	43%	0.428	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-82.9	163.9	176.2	-68.4	-41.6	0	0	0	111.9	R520 C570 T571	R520-N526 WeakPolarHBondContact CD-OD1 3.4Å; R520-N526 WeakPolarHBondContact CG-OD1 3.16Å; R520-N526 PolarHBondContact NE-OD1 2.91Å; N526-C570 WeakPolarHBondContact O-CA 3.41Å; N526-T571 PolarHBondContact O-N 3.2Å; N526-T571 PolarHBondContact O-OG1 2.88Å; N526-T571 VanDerWaalsContact O-OG1 3.11Å
527	S	93.6	Very high	91.9	Very high	22 Å²	22	40.5 Å²	40.5	15%	0.154	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-64.5	152.4	174.5	70	0	0	0	0	111.6	D516 C519 L569	D516-S527 VanDerWaalsContact CG-OG 3.32Å; D516-S527 WeakPolarHBondContact OD1-CA 3.45Å; D516-S527 VanDerWaalsContact OD1-CB 3.23Å; D516-S527 WeakPolarHBondContact OD1-CB 3.36Å; D516-S527 PolarHBondContact OD1-N 2.86Å; D516-S527 PolarHBondContact OD1-OG 3.14Å; C519-S527 VanDerWaalsContact SG-CA 3.56Å; S527-L569 WeakPolarHBondContact CA-O 3.41Å
528	A	93.9	Very high	92	Very high	6 Å²	6	41.4 Å²	41.4	5%	0.05	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-73.7	163.7	176.4	0	0	0	0	0	111	C532 Y533 L569 T571	A528-C532 HydrophobicContact CB-CB 3.94Å; A528-Y533 HydrophobicContact CB-CE2 4.5Å; A528-L569 HydrophobicContact CB-CB 3.77Å; A528-L569 WeakPolarHBondContact CB-O 3.19Å; A528-L569 PolarHBondContact N-O 3.45Å; A528-T571 HydrophobicContact CB-CG2 4.42Å
529	D	93	Very high	92	Very high	87 Å²	87	44.3 Å²	44.3	47%	0.465	22%	0.217	S	C	.	.	P	Polyproline II helix	trans	-59.9	148.7	177.1	-168.2	-83.7	0	0	0	111.2	F531 C532 M598	D529-F531 PolarHBondContact O-N 3.37Å; D529-F531 VanDerWaalsContact O-N 3.07Å; D529-F531 WeakPolarHBondContact OD1-CB 3.33Å; D529-F531 PolarHBondContact OD1-N 3.25Å; D529-C532 VanDerWaalsContact O-CB 3.23Å; D529-C532 WeakPolarHBondContact O-CB 3.39Å; D529-C532 PolarHBondContact O-N 3.02Å; D529-M598 HydrophobicContact CB-SD 3.75Å
530	R	92.2	Very high	91.9	Very high	132 Å²	132	45 Å²	45	50%	0.498	22%	0.224	S	C	.	.	H	α-helix	trans	-49.1	-37.2	176.3	177.8	176.8	176.4	115.8	10.3	112	C532 Y533 E534 L564	R530-C532 VanDerWaalsContact C-N 3.25Å; R530-C532 PolarHBondContact O-N 2.9Å; R530-Y533 WeakPolarHBondContact O-CB 3.33Å; R530-Y533 PolarHBondContact O-N 2.59Å; R530-Y533 VanDerWaalsContact O-N 3.16Å; R530-E534 HydrophobicContact CG-CG 4.43Å; R530-E534 IonicContact CZ-OE1 3.77Å; R530-E534 IonicContact NE-OE1 3.44Å; R530-E534 PolarHBondContact NE-OE1 3.34Å; R530-E534 IonicContact NH2-OE1 2.76Å; R530-E534 PolarHBondContact NH2-OE1 2.82Å; R530-E534 PolarHBondContact O-N 3.2Å; R530-E534 VanDerWaalsContact O-N 3.13Å; R530-L564 HydrophobicContact CG-CD2 4.26Å
531	F	92.1	Very high	91.8	Very high	50 Å²	50	42.7 Å²	42.7	22%	0.219	22%	0.221	C	C	.	.	H	α-helix	trans	-60.4	-33.7	179	-172.5	-90.8	0	0	0	113.1	D529 Y533 E534 K535 I591 H593 M598	D529-F531 PolarHBondContact O-N 3.37Å; D529-F531 VanDerWaalsContact O-N 3.07Å; D529-F531 WeakPolarHBondContact OD1-CB 3.33Å; D529-F531 PolarHBondContact OD1-N 3.25Å; F531-Y533 VanDerWaalsContact C-N 3.32Å; F531-Y533 PolarHBondContact O-N 2.9Å; F531-E534 PolarHBondContact O-N 2.77Å; F531-K535 HydrophobicContact CE1-CB 4.37Å; F531-K535 WeakPolarHBondContact O-CB 3.41Å; F531-K535 PolarHBondContact O-N 2.87Å; F531-I591 HydrophobicContact CD1-CD1 4.48Å; F531-I591 HydrophobicContact CE1-CD1 4.32Å; F531-I591 HydrophobicContact CE1-CG2 3.92Å; F531-H593 AromaticContact CD2-CD2 3.92Å; F531-H593 AromaticContact CD2-NE2 3.9Å; F531-H593 HydrophobicContact CE1-CB 4.33Å; F531-H593 AromaticContact CE2-CE1 3.55Å; F531-H593 AromaticContact CE2-ND1 3.71Å; F531-H593 AromaticContact CE2-NE2 3.78Å; F531-H593 AromaticContact CZ-CE1 3.98Å; F531-H593 AromaticContact CZ-CG 3.99Å; F531-H593 AromaticContact CZ-ND1 3.67Å; F531-M598 HydrophobicContact CB-CE 3.74Å; F531-M598 HydrophobicContact CB-SD 4.24Å; F531-M598 HydrophobicContact CD1-CE 3.26Å; F531-M598 HydrophobicContact CE1-CE 4.06Å; F531-M598 HydrophobicContact CG-CE 3.68Å
532	C	93.8	Very high	91.9	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.1	-43.9	176.4	-70.4	0	0	0	0	111.4	A528 D529 R530 K535 L536 L569 C600	A528-C532 HydrophobicContact CB-CB 3.94Å; D529-C532 VanDerWaalsContact O-CB 3.23Å; D529-C532 WeakPolarHBondContact O-CB 3.39Å; D529-C532 PolarHBondContact O-N 3.02Å; R530-C532 VanDerWaalsContact C-N 3.25Å; R530-C532 PolarHBondContact O-N 2.9Å; C532-K535 PolarHBondContact O-N 3.23Å; C532-L536 WeakPolarHBondContact O-CB 3.3Å; C532-L536 PolarHBondContact O-N 3.15Å; C532-L569 VanDerWaalsContact C-CD1 3.46Å; C532-L569 HydrophobicContact CB-CD1 3.79Å; C532-L569 WeakPolarHBondContact O-CD1 3.27Å; C532-C600 VanDerWaalsContact CA-SG 3.56Å; C532-C600 HydrophobicContact CB-CB 3.56Å; C532-C600 WeakPolarHBondContact CB-SG 3.01Å; C532-C600 VanDerWaalsContact SG-CA 3.58Å; C532-C600 WeakPolarHBondContact SG-CB 3.18Å; C532-C600 CovalentContact SG-SG 2.03Å; C532-C600 PolarHBondContact SG-SG 3.46Å
533	Y	95.1	Very high	91.9	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.7	-48.8	177.8	-69	-94.5	0	0	0	111.1	A528 R530 F531 K535 N537 L564 L567 L569 V616	A528-Y533 HydrophobicContact CB-CE2 4.5Å; R530-Y533 WeakPolarHBondContact O-CB 3.33Å; R530-Y533 PolarHBondContact O-N 2.59Å; R530-Y533 VanDerWaalsContact O-N 3.16Å; F531-Y533 VanDerWaalsContact C-N 3.32Å; F531-Y533 PolarHBondContact O-N 2.9Å; Y533-K535 PolarHBondContact O-N 3.25Å; Y533-N537 WeakPolarHBondContact CD1-ND2 3.17Å; Y533-N537 VanDerWaalsContact O-CB 3.28Å; Y533-N537 WeakPolarHBondContact O-CB 3.14Å; Y533-N537 PolarHBondContact O-N 3.21Å; Y533-L564 HydrophobicContact CD1-CD2 4.25Å; Y533-L564 HydrophobicContact CD2-CD2 4Å; Y533-L564 HydrophobicContact CG-CD2 3.75Å; Y533-L567 VanDerWaalsContact CE1-O 3.31Å; Y533-L567 WeakPolarHBondContact CE1-O 3.37Å; Y533-L569 HydrophobicContact CD1-CD1 4.15Å; Y533-L569 HydrophobicContact CD1-CG 4.34Å; Y533-L569 HydrophobicContact CD2-CB 4.46Å; Y533-L569 HydrophobicContact CD2-CD1 4.32Å; Y533-L569 HydrophobicContact CE1-CB 4.15Å; Y533-L569 HydrophobicContact CE1-CD1 4.5Å; Y533-L569 HydrophobicContact CE1-CG 4.22Å; Y533-L569 HydrophobicContact CE2-CB 4Å; Y533-L569 HydrophobicContact CG-CD1 4.06Å; Y533-L569 PolarHBondContact OH-N 2.89Å; Y533-L569 VanDerWaalsContact OH-N 3.16Å; Y533-L569 PolarHBondContact OH-O 3.42Å; Y533-V616 HydrophobicContact CE1-CG2 4.05Å
534	E	94	Very high	92.1	Very high	80 Å²	80	49 Å²	49	37%	0.374	25%	0.246	S	C	.	.	H	α-helix	trans	-58.5	-36.6	179.3	-71.8	177.6	176.4	0	0	112	R530 F531 S538 V563	R530-E534 HydrophobicContact CG-CG 4.43Å; R530-E534 IonicContact CZ-OE1 3.77Å; R530-E534 IonicContact NE-OE1 3.44Å; R530-E534 PolarHBondContact NE-OE1 3.34Å; R530-E534 IonicContact NH2-OE1 2.76Å; R530-E534 PolarHBondContact NH2-OE1 2.82Å; R530-E534 PolarHBondContact O-N 3.2Å; R530-E534 VanDerWaalsContact O-N 3.13Å; F531-E534 PolarHBondContact O-N 2.77Å; E534-S538 VanDerWaalsContact O-CB 3.26Å; E534-S538 WeakPolarHBondContact O-CB 3.4Å; E534-S538 PolarHBondContact O-OG 3.47Å; E534-V563 HydrophobicContact CG-CG2 3.91Å
535	K	92.2	Very high	92.5	Very high	100 Å²	100	47.6 Å²	47.6	44%	0.435	23%	0.231	S	C	.	.	H	α-helix	trans	-76.7	-61.2	177.4	-174.6	61.1	-174.6	170	0	112	F531 C532 Y533 S538 E539 I591	F531-K535 HydrophobicContact CE1-CB 4.37Å; F531-K535 WeakPolarHBondContact O-CB 3.41Å; F531-K535 PolarHBondContact O-N 2.87Å; C532-K535 PolarHBondContact O-N 3.23Å; Y533-K535 PolarHBondContact O-N 3.25Å; K535-S538 PolarHBondContact O-OG 3.22Å; K535-E539 WeakPolarHBondContact O-CG 3.23Å; K535-I591 HydrophobicContact CB-CD1 4.2Å; K535-I591 HydrophobicContact CG-CD1 4.05Å
536	L	93.7	Very high	92.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-74	-45.6	-168.8	-69.6	177.4	0	0	0	113	C532 S538 E539 G544 L569 T587 L589 C600	C532-L536 WeakPolarHBondContact O-CB 3.3Å; C532-L536 PolarHBondContact O-N 3.15Å; L536-S538 PolarHBondContact O-N 3.08Å; L536-E539 WeakPolarHBondContact O-CB 3.39Å; L536-E539 PolarHBondContact O-N 2.88Å; L536-G544 CarbonylContact O-C 3.55Å; L536-G544 WeakPolarHBondContact O-CA 3.26Å; L536-L569 HydrophobicContact CB-CD1 4.22Å; L536-L569 HydrophobicContact CD1-CD1 3.99Å; L536-L569 HydrophobicContact CD1-CD2 4.09Å; L536-T587 HydrophobicContact CD1-CG2 4.31Å; L536-L589 HydrophobicContact CD2-CD2 3.73Å; L536-C600 HydrophobicContact CD1-CB 3.71Å
537	N	95.9	Very high	92.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-22	-176.7	-73.8	-16.1	0	0	0	112.6	Y533 E539 G544 N545 C558 V563 L567	Y533-N537 WeakPolarHBondContact CD1-ND2 3.17Å; Y533-N537 VanDerWaalsContact O-CB 3.28Å; Y533-N537 WeakPolarHBondContact O-CB 3.14Å; Y533-N537 PolarHBondContact O-N 3.21Å; N537-E539 VanDerWaalsContact C-N 3.26Å; N537-E539 PolarHBondContact O-N 2.89Å; N537-G544 WeakPolarHBondContact OD1-CA 3.45Å; N537-N545 PolarHBondContact OD1-N 2.95Å; N537-C558 HydrophobicContact CB-CB 4.18Å; N537-C558 WeakPolarHBondContact O-CB 3.4Å; N537-C558 PolarHBondContact O-N 2.02Å; N537-C558 PolarHBondContact O-SG 2.98Å; N537-V563 HydrophobicContact CB-CB 4.29Å; N537-V563 PolarHBondContact ND2-O 2.94Å; N537-L567 PolarHBondContact ND2-N 3.45Å; N537-L567 PolarHBondContact ND2-O 3.39Å; N537-L567 WeakPolarHBondContact OD1-CB 3.37Å; N537-L567 PolarHBondContact OD1-N 3.49Å
538	S	94.6	Very high	92.3	Very high	37 Å²	37	44 Å²	44	26%	0.259	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-5.3	171.3	79.9	0	0	0	0	114.2	E534 K535 L536 Q557	E534-S538 VanDerWaalsContact O-CB 3.26Å; E534-S538 WeakPolarHBondContact O-CB 3.4Å; E534-S538 PolarHBondContact O-OG 3.47Å; K535-S538 PolarHBondContact O-OG 3.22Å; L536-S538 PolarHBondContact O-N 3.08Å; S538-Q557 VanDerWaalsContact O-CD 3.27Å; S538-Q557 WeakPolarHBondContact O-CG 3.48Å; S538-Q557 PolarHBondContact O-NE2 3.42Å
539	E	92.7	Very high	91.8	Very high	78 Å²	78	47.3 Å²	47.3	36%	0.364	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-30	178.7	-65.6	-179.5	177.9	0	0	112.3	K535 L536 N537 T541	K535-E539 WeakPolarHBondContact O-CG 3.23Å; L536-E539 WeakPolarHBondContact O-CB 3.39Å; L536-E539 PolarHBondContact O-N 2.88Å; N537-E539 VanDerWaalsContact C-N 3.26Å; N537-E539 PolarHBondContact O-N 2.89Å; E539-T541 HydrophobicContact CB-CG2 4.09Å
540	G	91.1	Very high	91	Very high	16 Å²	16	49.2 Å²	49.2	17%	0.165	25%	0.254	C	S	.	.			trans	67.4	45.8	-177.2	0	0	0	0	0	112.3	G544 W555	G540-G544 WeakPolarHBondContact CA-O 3.41Å; G540-G544 PolarHBondContact N-O 3.36Å; G540-G544 VanDerWaalsContact N-O 3.11Å; G540-W555 WeakPolarHBondContact O-CB 3.46Å
541	T	90.1	Very high	90.3	Very high	52 Å²	52	46.2 Å²	46.2	32%	0.319	26%	0.264	S	S	.	.	B	Isolated β-bridge	trans	-125.6	176.2	178.9	70.4	0	0	0	0	110.5	E539 K543 G544 N545 W555	E539-T541 HydrophobicContact CB-CG2 4.09Å; T541-K543 PolarHBondContact O-N 3.26Å; T541-K543 PolarHBondContact OG1-N 3.22Å; T541-G544 PolarHBondContact N-O 2.9Å; T541-G544 CarbonylContact O-C 3.27Å; T541-G544 VanDerWaalsContact O-C 3.27Å; T541-G544 PolarHBondContact O-N 3.22Å; T541-G544 VanDerWaalsContact O-O 3.04Å; T541-N545 WeakPolarHBondContact O-CB 3.5Å; T541-N545 PolarHBondContact O-ND2 2.93Å; T541-W555 VanDerWaalsContact C-CD1 3.46Å
542	E	87.1	Confident	89.1	Confident	83 Å²	83	47 Å²	47	39%	0.388	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-25.3	172.1	-170.4	-177.5	-179.8	0	0	111.8	W555	E542-W555 HydrophobicContact CB-CZ2 4.2Å; E542-W555 HydrophobicContact CG-CZ2 3.99Å
543	K	87.4	Confident	88.2	Confident	110 Å²	110	55.3 Å²	55.3	48%	0.478	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-15.8	179.2	-61.4	-177.8	-176	176.5	0	114.8	T541 T587	T541-K543 PolarHBondContact O-N 3.26Å; T541-K543 PolarHBondContact OG1-N 3.22Å; K543-T587 WeakPolarHBondContact CA-OG1 3.31Å; K543-T587 HydrophobicContact CB-CG2 3.65Å; K543-T587 HydrophobicContact CG-CG2 3.95Å; K543-T587 WeakPolarHBondContact O-CG2 3.06Å
544	G	92.2	Very high	87.7	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	178.3	123.7	-179.5	0	0	0	0	0	110.6	L536 N537 G540 T541	L536-G544 CarbonylContact O-C 3.55Å; L536-G544 WeakPolarHBondContact O-CA 3.26Å; N537-G544 WeakPolarHBondContact OD1-CA 3.45Å; G540-G544 WeakPolarHBondContact CA-O 3.41Å; G540-G544 PolarHBondContact N-O 3.36Å; G540-G544 VanDerWaalsContact N-O 3.11Å; T541-G544 PolarHBondContact N-O 2.9Å; T541-G544 CarbonylContact O-C 3.27Å; T541-G544 VanDerWaalsContact O-C 3.27Å; T541-G544 PolarHBondContact O-N 3.22Å; T541-G544 VanDerWaalsContact O-O 3.04Å
545	N	94.1	Very high	87.5	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	35%	0.349	C	S	.	.			trans	-166	174.3	-172.7	63.2	77.6	0	0	0	111.6	N537 T541 G547 W555 V556 G566 L567 Y615	N537-N545 PolarHBondContact OD1-N 2.95Å; T541-N545 WeakPolarHBondContact O-CB 3.5Å; T541-N545 PolarHBondContact O-ND2 2.93Å; N545-G547 WeakPolarHBondContact OD1-CA 3.46Å; N545-G547 PolarHBondContact OD1-N 2.69Å; N545-W555 HydrophobicContact CB-CB 3.69Å; N545-W555 HydrophobicContact CB-CE3 4.3Å; N545-W555 HydrophobicContact CB-CG 4.33Å; N545-W555 VanDerWaalsContact ND2-CE3 3.26Å; N545-V556 WeakPolarHBondContact CA-O 3.34Å; N545-V556 WeakPolarHBondContact CB-O 3.28Å; N545-G566 CarbonylContact O-C 3.56Å; N545-G566 VanDerWaalsContact O-CA 3.28Å; N545-G566 WeakPolarHBondContact O-CA 3.35Å; N545-L567 PolarHBondContact O-N 2.7Å; N545-Y615 WeakPolarHBondContact OD1-CE1 3.5Å; N545-Y615 PolarHBondContact OD1-OH 3.46Å
546	C	94.3	Very high	87.6	Confident	18 Å²	18	55.8 Å²	55.8	12%	0.122	34%	0.343	C	S	.	.	S	Bend	trans	-109.2	32.6	175.9	-87.5	0	0	0	0	112.1	V556 C558 R631	C546-V556 HydrophobicContact CB-CG1 4.46Å; C546-V556 PolarHBondContact N-O 3.33Å; C546-C558 WeakPolarHBondContact CA-SG 3.19Å; C546-C558 HydrophobicContact CB-CB 4.06Å; C546-C558 WeakPolarHBondContact CB-SG 3.31Å; C546-C558 PolarHBondContact N-SG 2.86Å; C546-C558 WeakPolarHBondContact SG-CA 3.3Å; C546-C558 WeakPolarHBondContact SG-CB 2.98Å; C546-C558 CovalentContact SG-SG 2.02Å; C546-C558 PolarHBondContact SG-SG 2.99Å; C546-R631 WeakPolarHBondContact O-CD 3.41Å
547	G	90.1	Very high	87.6	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	37%	0.371	C	S	.	.	S	Bend	trans	112.6	167.9	179.5	0	0	0	0	0	114	N545 V556 Y615	N545-G547 WeakPolarHBondContact OD1-CA 3.46Å; N545-G547 PolarHBondContact OD1-N 2.69Å; G547-V556 PolarHBondContact O-N 3.33Å; G547-Y615 WeakPolarHBondContact CA-OH 3.33Å
548	P	88.3	Confident	87.6	Confident	75 Å²	75	62.1 Å²	62.1	49%	0.487	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-65.4	146.7	169.1	28.9	-34.4	0	0	0	110.7
549	N	84.4	Confident	87.7	Confident	75 Å²	75	65.2 Å²	65.2	40%	0.401	39%	0.387	S	S	.	.			trans	-67.3	132.2	177.8	-166	9.2	0	0	0	110.7	G551 G552 Q553 G554 V556	N549-G551 PolarHBondContact O-N 3.22Å; N549-G552 PolarHBondContact O-N 3.08Å; N549-Q553 WeakPolarHBondContact CB-O 3Å; N549-Q553 PolarHBondContact ND2-O 2.88Å; N549-G554 WeakPolarHBondContact CB-O 3.02Å; N549-G554 PolarHBondContact N-O 3.15Å; N549-V556 HydrophobicContact CB-CG2 4.25Å
550	P	76.8	Confident	87.7	Confident	128 Å²	128	70.8 Å²	70.8	83%	0.831	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-24.4	-179.7	-27.6	34.8	0	0	0	114.7	G552	P550-G552 VanDerWaalsContact C-N 3.28Å; P550-G552 PolarHBondContact O-N 2.04Å
551	G	75.6	Confident	87.8	Confident	69 Å²	69	77.1 Å²	77.1	71%	0.711	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	5.2	176.4	0	0	0	0	0	115.5	N549 Q553	N549-G551 PolarHBondContact O-N 3.22Å; G551-Q553 PolarHBondContact O-N 3.49Å
552	G	67.1	Low	88.1	Confident	67 Å²	67	75.1 Å²	75.1	69%	0.691	42%	0.422	S	S	*	.	S	Bend	trans	85.3	0.7	168.9	0	0	0	0	0	116.7	N549 P550	N549-G552 PolarHBondContact O-N 3.08Å; P550-G552 VanDerWaalsContact C-N 3.28Å; P550-G552 PolarHBondContact O-N 2.04Å
553	Q	74.8	Confident	88.5	Confident	173 Å²	173	71.4 Å²	71.4	81%	0.808	41%	0.405	S	S	*	.	S	Bend	trans	-136	126.1	172.5	-68.7	-171.7	-11.8	0	0	112.1	N549 G551	N549-Q553 WeakPolarHBondContact CB-O 3Å; N549-Q553 PolarHBondContact ND2-O 2.88Å; G551-Q553 PolarHBondContact O-N 3.49Å
554	G	84.9	Confident	88.9	Confident	51 Å²	51	66.3 Å²	66.3	53%	0.526	38%	0.383	S	S	.	.	S	Bend	trans	87.9	-174.6	175.5	0	0	0	0	0	114.8	N549	N549-G554 WeakPolarHBondContact CB-O 3.02Å; N549-G554 PolarHBondContact N-O 3.15Å
555	W	90.7	Very high	89.1	Confident	88 Å²	88	66.3 Å²	66.3	33%	0.333	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-116.2	145.5	-174.3	-60.6	98.2	0	0	0	110.5	G540 T541 E542 N545 H604 Y615	G540-W555 WeakPolarHBondContact O-CB 3.46Å; T541-W555 VanDerWaalsContact C-CD1 3.46Å; E542-W555 HydrophobicContact CB-CZ2 4.2Å; E542-W555 HydrophobicContact CG-CZ2 3.99Å; N545-W555 HydrophobicContact CB-CB 3.69Å; N545-W555 HydrophobicContact CB-CE3 4.3Å; N545-W555 HydrophobicContact CB-CG 4.33Å; N545-W555 VanDerWaalsContact ND2-CE3 3.26Å; W555-H604 AromaticContact CH2-CE1 3.83Å; W555-H604 AromaticContact CH2-NE2 3.63Å; W555-H604 AromaticContact CZ3-CE1 3.93Å; W555-Y615 WeakPolarHBondContact CZ3-OH 3.49Å
556	V	93.6	Very high	89.2	Confident	52 Å²	52	66.3 Å²	66.3	32%	0.315	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-80.3	122.3	178	-177.9	0	0	0	0	109.1	N545 C546 G547 N549 C558	N545-V556 WeakPolarHBondContact CA-O 3.34Å; N545-V556 WeakPolarHBondContact CB-O 3.28Å; C546-V556 HydrophobicContact CB-CG1 4.46Å; C546-V556 PolarHBondContact N-O 3.33Å; G547-V556 PolarHBondContact O-N 3.33Å; N549-V556 HydrophobicContact CB-CG2 4.25Å; V556-C558 PolarHBondContact O-N 3.49Å
557	Q	94.8	Very high	89.2	Confident	126 Å²	126	65.5 Å²	65.5	59%	0.589	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-64.8	128.6	169.9	-169.7	-176.8	0.5	0	0	110.1	S538	S538-Q557 VanDerWaalsContact O-CD 3.27Å; S538-Q557 WeakPolarHBondContact O-CG 3.48Å; S538-Q557 PolarHBondContact O-NE2 3.42Å
558	C	96.1	Very high	89.5	Confident	6 Å²	6	65.5 Å²	65.5	4%	0.041	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-70.9	139.8	175.4	-66.4	0	0	0	0	111.3	N537 C546 V556 V563	N537-C558 HydrophobicContact CB-CB 4.18Å; N537-C558 WeakPolarHBondContact O-CB 3.4Å; N537-C558 PolarHBondContact O-N 2.02Å; N537-C558 PolarHBondContact O-SG 2.98Å; C546-C558 WeakPolarHBondContact CA-SG 3.19Å; C546-C558 HydrophobicContact CB-CB 4.06Å; C546-C558 WeakPolarHBondContact CB-SG 3.31Å; C546-C558 PolarHBondContact N-SG 2.86Å; C546-C558 WeakPolarHBondContact SG-CA 3.3Å; C546-C558 WeakPolarHBondContact SG-CB 2.98Å; C546-C558 CovalentContact SG-SG 2.02Å; C546-C558 PolarHBondContact SG-SG 2.99Å; V556-C558 PolarHBondContact O-N 3.49Å; C558-V563 HydrophobicContact CB-CG1 4.08Å
559	N	95.3	Very high	89.8	Confident	103 Å²	103	62 Å²	62	55%	0.551	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-64.6	156	164.3	-58.4	-49.9	0	0	0	109.9	Q561 D562 V563	N559-Q561 PolarHBondContact O-N 3.21Å; N559-D562 HydrophobicContact CB-CB 4.38Å; N559-D562 WeakPolarHBondContact CB-OD2 3.46Å; N559-D562 PolarHBondContact ND2-OD2 3.14Å; N559-D562 PolarHBondContact O-N 3.42Å; N559-V563 WeakPolarHBondContact O-CG1 3.23Å; N559-V563 PolarHBondContact O-N 3.01Å
560	K	92.3	Very high	90.3	Very high	195 Å²	195	58.4 Å²	58.4	85%	0.848	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	-30.8	179.1	-65.9	-173.1	179.8	-179.1	0	114	V563	K560-V563 WeakPolarHBondContact O-CG2 3.37Å
561	Q	93.9	Very high	91	Very high	148 Å²	148	54 Å²	54	69%	0.692	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-28	177.8	-64.6	177.1	-4	0	0	112.5	N559 C633	N559-Q561 PolarHBondContact O-N 3.21Å; Q561-C633 WeakPolarHBondContact O-CB 3.23Å
562	D	95.6	Very high	91.4	Very high	11 Å²	11	55.3 Å²	55.3	6%	0.059	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-7.4	-172.3	-60.2	-39.2	0	0	0	113	N559 L564 C565 G566 R632 C633	N559-D562 HydrophobicContact CB-CB 4.38Å; N559-D562 WeakPolarHBondContact CB-OD2 3.46Å; N559-D562 PolarHBondContact ND2-OD2 3.14Å; N559-D562 PolarHBondContact O-N 3.42Å; D562-L564 PolarHBondContact O-N 2.77Å; D562-C565 WeakPolarHBondContact O-CA 3.2Å; D562-C565 PolarHBondContact O-N 3.24Å; D562-G566 PolarHBondContact O-N 3.49Å; D562-R632 WeakPolarHBondContact OD1-CA 3.46Å; D562-C633 PolarHBondContact OD1-N 2.65Å
563	V	96.4	Very high	92.3	Very high	4 Å²	4	52.3 Å²	52.3	2%	0.024	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-53.7	-28.8	-176	-63.8	0	0	0	0	113.9	E534 N537 C558 N559 K560 C565	E534-V563 HydrophobicContact CG-CG2 3.91Å; N537-V563 HydrophobicContact CB-CB 4.29Å; N537-V563 PolarHBondContact ND2-O 2.94Å; C558-V563 HydrophobicContact CB-CG1 4.08Å; N559-V563 WeakPolarHBondContact O-CG1 3.23Å; N559-V563 PolarHBondContact O-N 3.01Å; K560-V563 WeakPolarHBondContact O-CG2 3.37Å; V563-C565 VanDerWaalsContact C-N 3.33Å
564	L	96.5	Very high	92.1	Very high	4 Å²	4	49 Å²	49	2%	0.021	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-85	-1.5	177.7	-70.6	178.6	0	0	0	114.8	R530 Y533 D562 V616 C622	R530-L564 HydrophobicContact CG-CD2 4.26Å; Y533-L564 HydrophobicContact CD1-CD2 4.25Å; Y533-L564 HydrophobicContact CD2-CD2 4Å; Y533-L564 HydrophobicContact CG-CD2 3.75Å; D562-L564 PolarHBondContact O-N 2.77Å; L564-V616 WeakPolarHBondContact O-CG2 3.14Å; L564-C622 HydrophobicContact CB-CB 3.99Å; L564-C622 WeakPolarHBondContact CD1-O 3.32Å
565	C	96.7	Very high	91.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-114.3	-0.2	175.7	-58.9	0	0	0	0	112.8	D562 V563 C622 C628 R631	D562-C565 WeakPolarHBondContact O-CA 3.2Å; D562-C565 PolarHBondContact O-N 3.24Å; V563-C565 VanDerWaalsContact C-N 3.33Å; C565-C622 VanDerWaalsContact SG-CB 3.53Å; C565-C628 WeakPolarHBondContact CA-SG 3.26Å; C565-C628 HydrophobicContact CB-CB 3.7Å; C565-C628 WeakPolarHBondContact CB-SG 3.42Å; C565-C628 WeakPolarHBondContact SG-CA 3.5Å; C565-C628 WeakPolarHBondContact SG-CB 3.04Å; C565-C628 CovalentContact SG-SG 2.04Å; C565-C628 PolarHBondContact SG-SG 3.48Å; C565-R631 WeakPolarHBondContact O-CA 3.34Å
566	G	95.2	Very high	90.9	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.279	C	S	.	.	S	Bend	trans	-78.6	-146.8	175.6	0	0	0	0	0	113	N545 D562 L568 V616	N545-G566 CarbonylContact O-C 3.56Å; N545-G566 VanDerWaalsContact O-CA 3.28Å; N545-G566 WeakPolarHBondContact O-CA 3.35Å; D562-G566 PolarHBondContact O-N 3.49Å; G566-L568 PolarHBondContact O-N 3.36Å; G566-V616 PolarHBondContact O-N 2.74Å
567	L	95.1	Very high	90.5	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-54.6	132.1	176.7	-167.6	74	0	0	0	110.6	Y533 N537 N545 L569 H604 G614 Y615	Y533-L567 VanDerWaalsContact CE1-O 3.31Å; Y533-L567 WeakPolarHBondContact CE1-O 3.37Å; N537-L567 PolarHBondContact ND2-N 3.45Å; N537-L567 PolarHBondContact ND2-O 3.39Å; N537-L567 WeakPolarHBondContact OD1-CB 3.37Å; N537-L567 PolarHBondContact OD1-N 3.49Å; N545-L567 PolarHBondContact O-N 2.7Å; L567-L569 HydrophobicContact CD2-CD2 4.28Å; L567-H604 WeakPolarHBondContact CD1-CE1 3.17Å; L567-G614 WeakPolarHBondContact CD1-O 3.41Å; L567-Y615 HydrophobicContact CD1-CE1 4.42Å
568	L	95.8	Very high	89.7	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	27%	0.268	C	S	.	.			trans	-71.5	126.5	175.4	-177.1	74	0	0	0	109.3	R515 Q518 L522 G566 G614 V616	R515-L568 HydrophobicContact CB-CD1 4.42Å; R515-L568 HydrophobicContact CG-CD1 4.5Å; Q518-L568 HydrophobicContact CB-CD1 4.49Å; Q518-L568 HydrophobicContact CB-CD2 4.29Å; Q518-L568 HydrophobicContact CG-CD2 3.74Å; L522-L568 HydrophobicContact CD2-CD2 4.43Å; G566-L568 PolarHBondContact O-N 3.36Å; L568-G614 WeakPolarHBondContact CB-O 3.48Å; L568-G614 PolarHBondContact N-O 2.73Å; L568-V616 HydrophobicContact CB-CG2 4.34Å; L568-V616 HydrophobicContact CD1-CG2 3.92Å
569	L	95.1	Very high	88.8	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	27%	0.271	C	S	.	.			trans	-115.5	130.1	178	-58	173.1	0	0	0	109.7	S527 A528 C532 Y533 L536 L567 R601	S527-L569 WeakPolarHBondContact CA-O 3.41Å; A528-L569 HydrophobicContact CB-CB 3.77Å; A528-L569 WeakPolarHBondContact CB-O 3.19Å; A528-L569 PolarHBondContact N-O 3.45Å; C532-L569 VanDerWaalsContact C-CD1 3.46Å; C532-L569 HydrophobicContact CB-CD1 3.79Å; C532-L569 WeakPolarHBondContact O-CD1 3.27Å; Y533-L569 HydrophobicContact CD1-CD1 4.15Å; Y533-L569 HydrophobicContact CD1-CG 4.34Å; Y533-L569 HydrophobicContact CD2-CB 4.46Å; Y533-L569 HydrophobicContact CD2-CD1 4.32Å; Y533-L569 HydrophobicContact CE1-CB 4.15Å; Y533-L569 HydrophobicContact CE1-CD1 4.5Å; Y533-L569 HydrophobicContact CE1-CG 4.22Å; Y533-L569 HydrophobicContact CE2-CB 4Å; Y533-L569 HydrophobicContact CG-CD1 4.06Å; Y533-L569 PolarHBondContact OH-N 2.89Å; Y533-L569 VanDerWaalsContact OH-N 3.16Å; Y533-L569 PolarHBondContact OH-O 3.42Å; L536-L569 HydrophobicContact CB-CD1 4.22Å; L536-L569 HydrophobicContact CD1-CD1 3.99Å; L536-L569 HydrophobicContact CD1-CD2 4.09Å; L567-L569 HydrophobicContact CD2-CD2 4.28Å; L569-R601 CarbonylContact C-O 3.6Å; L569-R601 WeakPolarHBondContact CA-O 3.28Å
570	C	94.2	Very high	88.1	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-125.3	169	179.9	-46.1	0	0	0	0	110.4	C519 N526 L573 R601	C519-C570 HydrophobicContact CB-CB 3.82Å; C519-C570 WeakPolarHBondContact CB-SG 3.47Å; C519-C570 WeakPolarHBondContact SG-CB 3.39Å; C519-C570 CovalentContact SG-SG 2.04Å; C519-C570 PolarHBondContact SG-SG 2.93Å; N526-C570 WeakPolarHBondContact O-CA 3.41Å; C570-L573 HydrophobicContact CB-CD1 4.19Å; C570-L573 HydrophobicContact CB-CD2 3.88Å; C570-L573 HydrophobicContact CB-CG 4.1Å; C570-R601 PolarHBondContact N-O 3.23Å; C570-R601 PolarHBondContact O-N 2.82Å; C570-R601 VanDerWaalsContact O-N 3.09Å
571	T	91.7	Very high	87.7	Confident	37 Å²	37	52.3 Å²	52.3	23%	0.227	25%	0.254	C	S	.	.	S	Bend	trans	-98.2	149.7	178.9	53.1	0	0	0	0	111.6	Y525 N526 A528 L573	Y525-T571 WeakPolarHBondContact CB-O 3.42Å; Y525-T571 VanDerWaalsContact CG-O 3.28Å; N526-T571 PolarHBondContact O-N 3.2Å; N526-T571 PolarHBondContact O-OG1 2.88Å; N526-T571 VanDerWaalsContact O-OG1 3.11Å; A528-T571 HydrophobicContact CB-CG2 4.42Å; T571-L573 VanDerWaalsContact C-N 3.27Å; T571-L573 PolarHBondContact O-N 3.24Å; T571-L573 VanDerWaalsContact O-N 3.14Å
572	N	84.8	Confident	87.3	Confident	96 Å²	96	47.6 Å²	47.6	51%	0.513	23%	0.233	S	C	.	.	S	Bend	trans	56.2	30.9	169.9	-65.3	-24	0	0	0	115.8	Y525 T574 D599	Y525-N572 HydrophobicContact CD1-CB 3.86Å; Y525-N572 HydrophobicContact CE1-CB 3.85Å; Y525-N572 WeakPolarHBondContact CE2-O 3.5Å; Y525-N572 HydrophobicContact CG-CB 4.44Å; N572-T574 PolarHBondContact O-N 3.09Å; N572-T574 VanDerWaalsContact O-N 3.15Å; N572-D599 PolarHBondContact N-OD2 2.89Å
573	L	84.4	Confident	86.8	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.021	26%	0.259	C	S	.	.			trans	-65.1	111.9	172.3	-57.6	-174.7	0	0	0	111.5	W523 Y525 C570 T571 L586 R601	W523-L573 HydrophobicContact CB-CD2 3.33Å; W523-L573 HydrophobicContact CD2-CD1 4.24Å; W523-L573 HydrophobicContact CD2-CD2 3.65Å; W523-L573 HydrophobicContact CE3-CD2 3.98Å; W523-L573 HydrophobicContact CG-CD1 4.47Å; W523-L573 HydrophobicContact CG-CD2 3.35Å; Y525-L573 HydrophobicContact CD2-CD2 4.13Å; C570-L573 HydrophobicContact CB-CD1 4.19Å; C570-L573 HydrophobicContact CB-CD2 3.88Å; C570-L573 HydrophobicContact CB-CG 4.1Å; T571-L573 VanDerWaalsContact C-N 3.27Å; T571-L573 PolarHBondContact O-N 3.24Å; T571-L573 VanDerWaalsContact O-N 3.14Å; L573-L586 HydrophobicContact CB-CD2 4.41Å; L573-L586 HydrophobicContact CD1-CD2 4.13Å; L573-R601 HydrophobicContact CB-CB 3.78Å; L573-R601 HydrophobicContact CB-CG 4.42Å; L573-R601 HydrophobicContact CD1-CB 3.65Å; L573-R601 HydrophobicContact CG-CB 3.71Å; L573-R601 WeakPolarHBondContact O-CD 3.26Å; L573-R601 PolarHBondContact O-NH1 2.74Å
574	T	70.9	Confident	86.1	Confident	103 Å²	103	55.4 Å²	55.4	63%	0.632	28%	0.282	S	S	*	.			trans	-133.4	-5.4	171.9	55.5	0	0	0	0	113.3	N572	N572-T574 PolarHBondContact O-N 3.09Å; N572-T574 VanDerWaalsContact O-N 3.15Å
575	E	69.3	Low	85.4	Confident	116 Å²	116	65 Å²	65	54%	0.542	32%	0.318	S	S	.	.	S	Bend	trans	-114	160.9	-175.7	-63.5	-176.9	174.8	0	0	110.9
576	R	80.7	Confident	84.9	Confident	208 Å²	208	67.9 Å²	67.9	79%	0.785	33%	0.333	S	S	*	.			trans	-64.7	153.1	170.8	-73.5	-175.6	175.6	-176.5	-2.2	110.1
577	P	85.1	Confident	84.4	Confident	15 Å²	15	68.3 Å²	68.3	10%	0.097	34%	0.336	C	S	.	.			trans	-60	144.8	177.2	26.2	-32.4	0	0	0	109.4	L522 W523 F579 L582 A605	L522-P577 HydrophobicContact CD1-CB 3.92Å; L522-P577 HydrophobicContact CG-CB 4.37Å; W523-P577 HydrophobicContact CD2-CB 4.47Å; W523-P577 HydrophobicContact CE3-CB 4.01Å; W523-P577 HydrophobicContact CH2-CB 3.56Å; W523-P577 HydrophobicContact CH2-CG 3.86Å; W523-P577 HydrophobicContact CZ2-CB 4.07Å; W523-P577 VanDerWaalsContact CZ3-CA 3.43Å; W523-P577 HydrophobicContact CZ3-CB 3.56Å; W523-P577 VanDerWaalsContact CZ3-CD 3.4Å; W523-P577 HydrophobicContact CZ3-CG 3.99Å; P577-F579 WeakPolarHBondContact CB-O 3.34Å; P577-F579 PolarHBondContact O-N 3.49Å; P577-L582 HydrophobicContact CG-CB 4.17Å; P577-A605 HydrophobicContact CB-CB 3.84Å; P577-A605 HydrophobicContact CG-CB 4.02Å
578	R	79.4	Confident	84.1	Confident	149 Å²	149	71 Å²	71	56%	0.562	36%	0.355	S	S	*	.	S	Bend	trans	-65.5	-26.2	175.9	-66.7	-179.6	174.6	-171	-1.9	111.7	L522	L522-R578 WeakPolarHBondContact O-CB 3.12Å; L522-R578 PolarHBondContact O-N 2.84Å
579	F	77.6	Confident	83.7	Confident	27 Å²	27	74 Å²	74	12%	0.118	37%	0.371	C	S	.	.	S	Bend	trans	-137.3	138.4	-175.1	-50.7	-55.7	0	0	0	110.2	L346 T521 L522 P577 L607 L613	L346-F579 HydrophobicContact CD1-CB 3.94Å; L346-F579 HydrophobicContact CD1-CD1 2.95Å; L346-F579 HydrophobicContact CD1-CD2 4.4Å; L346-F579 HydrophobicContact CD1-CE1 3.38Å; L346-F579 HydrophobicContact CD1-CG 3.52Å; L346-F579 HydrophobicContact CD1-CZ 4.27Å; L346-F579 HydrophobicContact CG-CD1 4.41Å; T521-F579 HydrophobicContact CG2-CD2 4.14Å; T521-F579 HydrophobicContact CG2-CE2 3.66Å; T521-F579 WeakPolarHBondContact O-CE2 3.04Å; L522-F579 HydrophobicContact CD1-CB 4.35Å; L522-F579 WeakPolarHBondContact CD1-O 3.4Å; P577-F579 WeakPolarHBondContact CB-O 3.34Å; P577-F579 PolarHBondContact O-N 3.49Å; F579-L607 HydrophobicContact CB-CD2 4.46Å; F579-L613 HydrophobicContact CB-CD1 4.44Å
580	G	79	Confident	83.3	Confident	37 Å²	37	77.7 Å²	77.7	38%	0.381	39%	0.393	S	S	.	.	S	Bend	trans	78.4	172.8	-176.8	0	0	0	0	0	113.8	V606	G580-V606 CarbonylContact C-O 3.57Å; G580-V606 VanDerWaalsContact CA-O 3.26Å; G580-V606 WeakPolarHBondContact CA-O 3.42Å
581	E	83.8	Confident	82.9	Confident	139 Å²	139	79 Å²	79	65%	0.65	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	135.5	176.3	-169.7	172.1	174.1	0	0	110.1	Q583 V606	E581-Q583 PolarHBondContact O-N 2.96Å; E581-V606 PolarHBondContact N-O 2.84Å; E581-V606 PolarHBondContact O-N 3.42Å
582	L	86.8	Confident	82.7	Confident	49 Å²	49	81.8 Å²	81.8	26%	0.257	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	111.5	175.3	177.4	70.7	0	0	0	109.4	W523 P577 L586 H604	W523-L582 HydrophobicContact CH2-CD1 4.03Å; P577-L582 HydrophobicContact CG-CB 4.17Å; L582-L586 HydrophobicContact CD1-CD2 4.34Å; L582-L586 HydrophobicContact CD1-CG 4.28Å; L582-L586 HydrophobicContact CD2-CD1 4.24Å; L582-L586 HydrophobicContact CD2-CG 4.01Å; L582-H604 WeakPolarHBondContact CA-O 3.33Å
583	Q	85.1	Confident	82.6	Confident	129 Å²	129	80.2 Å²	80.2	60%	0.603	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	129.5	173.5	-166.1	174.7	7.4	0	0	110.5	E581 H604 V606	E581-Q583 PolarHBondContact O-N 2.96Å; Q583-H604 HydrophobicContact CB-CB 4.3Å; Q583-H604 PolarHBondContact N-O 3.16Å; Q583-V606 HydrophobicContact CB-CG2 4.11Å
584	G	81.9	Confident	82.5	Confident	50 Å²	50	87.9 Å²	87.9	52%	0.515	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	76.3	-153.1	-179.7	0	0	0	0	0	113.4
585	R	81.6	Confident	83.2	Confident	206 Å²	206	90 Å²	90	78%	0.777	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	146.1	-179.3	-67.3	-179.5	68	174.6	1.4	110.9	T587	R585-T587 PolarHBondContact O-N 3.23Å
586	L	86.5	Confident	84.1	Confident	60 Å²	60	93.5 Å²	93.5	31%	0.314	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	126.5	166.9	-81.6	159	0	0	0	109.7	W523 L573 L582 G602	W523-L586 HydrophobicContact CH2-CD2 4.05Å; W523-L586 HydrophobicContact CZ3-CD2 4.15Å; L573-L586 HydrophobicContact CB-CD2 4.41Å; L573-L586 HydrophobicContact CD1-CD2 4.13Å; L582-L586 HydrophobicContact CD1-CD2 4.34Å; L582-L586 HydrophobicContact CD1-CG 4.28Å; L582-L586 HydrophobicContact CD2-CD1 4.24Å; L582-L586 HydrophobicContact CD2-CG 4.01Å; L586-G602 CarbonylContact C-O 3.57Å
587	T	84.8	Confident	84.3	Confident	8 Å²	8	92.1 Å²	92.1	5%	0.049	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	128.6	165.4	-63.9	0	0	0	0	108.5	L536 K543 R585 R601 G602	L536-T587 HydrophobicContact CD1-CG2 4.31Å; K543-T587 WeakPolarHBondContact CA-OG1 3.31Å; K543-T587 HydrophobicContact CB-CG2 3.65Å; K543-T587 HydrophobicContact CG-CG2 3.95Å; K543-T587 WeakPolarHBondContact O-CG2 3.06Å; R585-T587 PolarHBondContact O-N 3.23Å; T587-R601 CarbonylContact O-C 3.6Å; T587-R601 WeakPolarHBondContact O-CA 3.33Å; T587-R601 WeakPolarHBondContact O-CB 3.28Å; T587-G602 WeakPolarHBondContact CB-O 3.38Å; T587-G602 PolarHBondContact N-O 3.33Å; T587-G602 PolarHBondContact O-N 3.49Å
588	S	87.2	Confident	84.4	Confident	57 Å²	57	92.6 Å²	92.6	40%	0.399	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	120.1	172.8	-178.4	0	0	0	0	109.8	R601	S588-R601 PolarHBondContact OG-NE 3.09Å; S588-R601 PolarHBondContact OG-NH1 2.74Å; S588-R601 PolarHBondContact OG-NH2 3.45Å
589	L	87.5	Confident	84.9	Confident	65 Å²	65	86.7 Å²	86.7	34%	0.34	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	128.2	174.5	-177.6	66.7	0	0	0	109.3	L536 I591 C600	L536-L589 HydrophobicContact CD2-CD2 3.73Å; L589-I591 HydrophobicContact CD2-CD1 3.88Å; L589-I591 HydrophobicContact CD2-CG1 3.74Å; L589-I591 HydrophobicContact CG-CD1 4.46Å; L589-I591 HydrophobicContact CG-CG1 3.84Å; L589-C600 PolarHBondContact N-O 2.81Å; L589-C600 WeakPolarHBondContact O-CA 3.21Å; L589-C600 WeakPolarHBondContact O-CB 3.46Å; L589-C600 PolarHBondContact O-N 3.18Å
590	T	87.2	Confident	85.6	Confident	77 Å²	77	85.4 Å²	85.4	47%	0.472	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	122.6	169.9	-49	0	0	0	0	108.9	Y597 M598	T590-Y597 HydrophobicContact CG2-CD1 4.12Å; T590-M598 CarbonylContact C-O 3.59Å; T590-M598 VanDerWaalsContact CA-O 3.31Å; T590-M598 WeakPolarHBondContact CA-O 3.21Å
591	I	86.4	Confident	86.2	Confident	28 Å²	28	86.4 Å²	86.4	14%	0.144	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	132.6	-177.9	-49.9	174.5	0	0	0	109.3	F531 K535 L589 M598 C600	F531-I591 HydrophobicContact CD1-CD1 4.48Å; F531-I591 HydrophobicContact CE1-CD1 4.32Å; F531-I591 HydrophobicContact CE1-CG2 3.92Å; K535-I591 HydrophobicContact CB-CD1 4.2Å; K535-I591 HydrophobicContact CG-CD1 4.05Å; L589-I591 HydrophobicContact CD2-CD1 3.88Å; L589-I591 HydrophobicContact CD2-CG1 3.74Å; L589-I591 HydrophobicContact CG-CD1 4.46Å; L589-I591 HydrophobicContact CG-CG1 3.84Å; I591-M598 PolarHBondContact N-O 2.85Å; I591-M598 PolarHBondContact O-N 3.47Å; I591-C600 VanDerWaalsContact CD1-SG 3.6Å
592	H	86.6	Confident	86.6	Confident	94 Å²	94	79.8 Å²	79.8	44%	0.435	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	115.1	171.4	-173.4	-103.1	0	0	0	109.8	Y597	H592-Y597 HydrophobicContact CB-CD1 4.08Å; H592-Y597 HydrophobicContact CB-CE1 3.95Å; H592-Y597 AromaticContact CD2-CD1 3.93Å; H592-Y597 AromaticContact CD2-CD2 3.9Å; H592-Y597 AromaticContact CD2-CE1 3.72Å; H592-Y597 AromaticContact CD2-CE2 3.68Å; H592-Y597 AromaticContact CD2-CZ 3.58Å
593	H	83.2	Confident	86.7	Confident	64 Å²	64	77.5 Å²	77.5	30%	0.296	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	135.7	178.3	-167.9	66.4	0	0	0	109.8	F531 N595 R596 M598	F531-H593 AromaticContact CD2-CD2 3.92Å; F531-H593 AromaticContact CD2-NE2 3.9Å; F531-H593 HydrophobicContact CE1-CB 4.33Å; F531-H593 AromaticContact CE2-CE1 3.55Å; F531-H593 AromaticContact CE2-ND1 3.71Å; F531-H593 AromaticContact CE2-NE2 3.78Å; F531-H593 AromaticContact CZ-CE1 3.98Å; F531-H593 AromaticContact CZ-CG 3.99Å; F531-H593 AromaticContact CZ-ND1 3.67Å; H593-N595 VanDerWaalsContact C-N 3.28Å; H593-N595 PolarHBondContact O-N 3.15Å; H593-R596 PolarHBondContact N-O 3.2Å; H593-R596 PolarHBondContact O-N 3.43Å; H593-M598 HydrophobicContact CB-CE 3.39Å
594	Q	82.1	Confident	86.9	Confident	165 Å²	165	71.9 Å²	71.9	77%	0.771	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	45.1	178.5	-63.7	177.6	4.2	0	0	114.1	R596	Q594-R596 PolarHBondContact O-N 2.86Å
595	N	85.1	Confident	87.2	Confident	148 Å²	148	69.5 Å²	69.5	79%	0.791	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	21.5	179.7	-143.2	38.6	0	0	0	114.8	H593	H593-N595 VanDerWaalsContact C-N 3.28Å; H593-N595 PolarHBondContact O-N 3.15Å
596	R	88.1	Confident	87.6	Confident	188 Å²	188	61.1 Å²	61.1	71%	0.709	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	140.3	174.1	-67.2	178.2	65.2	-179.5	-2.7	110	H593 Q594	H593-R596 PolarHBondContact N-O 3.2Å; H593-R596 PolarHBondContact O-N 3.43Å; Q594-R596 PolarHBondContact O-N 2.86Å
597	Y	84.8	Confident	87.5	Confident	180 Å²	180	59.1 Å²	59.1	71%	0.706	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	126.5	168.5	-68.2	-86.7	0	0	0	109	T590 H592	T590-Y597 HydrophobicContact CG2-CD1 4.12Å; H592-Y597 HydrophobicContact CB-CD1 4.08Å; H592-Y597 HydrophobicContact CB-CE1 3.95Å; H592-Y597 AromaticContact CD2-CD1 3.93Å; H592-Y597 AromaticContact CD2-CD2 3.9Å; H592-Y597 AromaticContact CD2-CE1 3.72Å; H592-Y597 AromaticContact CD2-CE2 3.68Å; H592-Y597 AromaticContact CD2-CZ 3.58Å
598	M	88.2	Confident	87	Confident	25 Å²	25	60.2 Å²	60.2	12%	0.123	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129.3	176.6	-61.8	-177.8	-59	0	0	108.8	D529 F531 T590 I591 H593	D529-M598 HydrophobicContact CB-SD 3.75Å; F531-M598 HydrophobicContact CB-CE 3.74Å; F531-M598 HydrophobicContact CB-SD 4.24Å; F531-M598 HydrophobicContact CD1-CE 3.26Å; F531-M598 HydrophobicContact CE1-CE 4.06Å; F531-M598 HydrophobicContact CG-CE 3.68Å; T590-M598 CarbonylContact C-O 3.59Å; T590-M598 VanDerWaalsContact CA-O 3.31Å; T590-M598 WeakPolarHBondContact CA-O 3.21Å; I591-M598 PolarHBondContact N-O 2.85Å; I591-M598 PolarHBondContact O-N 3.47Å; H593-M598 HydrophobicContact CB-CE 3.39Å
599	D	89.4	Confident	86.6	Confident	24 Å²	24	58 Å²	58	13%	0.128	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	113.1	178.5	-171.1	42.6	0	0	0	109.3	N572 R601	N572-D599 PolarHBondContact N-OD2 2.89Å; D599-R601 IonicContact OD1-CZ 2.92Å; D599-R601 IonicContact OD1-NE 2.84Å; D599-R601 PolarHBondContact OD1-NE 2.74Å; D599-R601 IonicContact OD1-NH2 3.72Å; D599-R601 PolarHBondContact OD1-NH2 3.1Å; D599-R601 WeakPolarHBondContact OD2-CD 3.48Å; D599-R601 IonicContact OD2-CZ 3.27Å; D599-R601 IonicContact OD2-NE 2.57Å; D599-R601 PolarHBondContact OD2-NE 2.81Å; D599-R601 IonicContact OD2-NH2 2.85Å
600	C	92.1	Very high	86.3	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	101.9	-178	-49.1	0	0	0	0	108.1	C532 L536 L589 I591	C532-C600 VanDerWaalsContact CA-SG 3.56Å; C532-C600 HydrophobicContact CB-CB 3.56Å; C532-C600 WeakPolarHBondContact CB-SG 3.01Å; C532-C600 VanDerWaalsContact SG-CA 3.58Å; C532-C600 WeakPolarHBondContact SG-CB 3.18Å; C532-C600 CovalentContact SG-SG 2.03Å; C532-C600 PolarHBondContact SG-SG 3.46Å; L536-C600 HydrophobicContact CD1-CB 3.71Å; L589-C600 PolarHBondContact N-O 2.81Å; L589-C600 WeakPolarHBondContact O-CA 3.21Å; L589-C600 WeakPolarHBondContact O-CB 3.46Å; L589-C600 PolarHBondContact O-N 3.18Å; I591-C600 VanDerWaalsContact CD1-SG 3.6Å
601	R	92.1	Very high	86.2	Confident	58 Å²	58	56.3 Å²	56.3	22%	0.219	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	146.4	-179.5	-53.2	-168.4	179.3	-138.2	-7	111.5	L569 C570 L573 T587 S588 D599	L569-R601 CarbonylContact C-O 3.6Å; L569-R601 WeakPolarHBondContact CA-O 3.28Å; C570-R601 PolarHBondContact N-O 3.23Å; C570-R601 PolarHBondContact O-N 2.82Å; C570-R601 VanDerWaalsContact O-N 3.09Å; L573-R601 HydrophobicContact CB-CB 3.78Å; L573-R601 HydrophobicContact CB-CG 4.42Å; L573-R601 HydrophobicContact CD1-CB 3.65Å; L573-R601 HydrophobicContact CG-CB 3.71Å; L573-R601 WeakPolarHBondContact O-CD 3.26Å; L573-R601 PolarHBondContact O-NH1 2.74Å; T587-R601 CarbonylContact O-C 3.6Å; T587-R601 WeakPolarHBondContact O-CA 3.33Å; T587-R601 WeakPolarHBondContact O-CB 3.28Å; S588-R601 PolarHBondContact OG-NE 3.09Å; S588-R601 PolarHBondContact OG-NH1 2.74Å; S588-R601 PolarHBondContact OG-NH2 3.45Å; D599-R601 IonicContact OD1-CZ 2.92Å; D599-R601 IonicContact OD1-NE 2.84Å; D599-R601 PolarHBondContact OD1-NE 2.74Å; D599-R601 IonicContact OD1-NH2 3.72Å; D599-R601 PolarHBondContact OD1-NH2 3.1Å; D599-R601 WeakPolarHBondContact OD2-CD 3.48Å; D599-R601 IonicContact OD2-CZ 3.27Å; D599-R601 IonicContact OD2-NE 2.57Å; D599-R601 PolarHBondContact OD2-NE 2.81Å; D599-R601 IonicContact OD2-NH2 2.85Å
602	G	91.1	Very high	86.3	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	167.5	-179.9	0	0	0	0	0	111.2	L586 T587	L586-G602 CarbonylContact C-O 3.57Å; T587-G602 WeakPolarHBondContact CB-O 3.38Å; T587-G602 PolarHBondContact N-O 3.33Å; T587-G602 PolarHBondContact O-N 3.49Å
603	G	89.5	Confident	86.4	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.7	153.3	178.3	0	0	0	0	0	111.3	A605 G614	G603-A605 PolarHBondContact O-N 3.17Å; G603-G614 VanDerWaalsContact O-CA 3.23Å; G603-G614 WeakPolarHBondContact O-CA 3.31Å
604	H	89.9	Confident	86.8	Confident	11 Å²	11	50.2 Å²	50.2	5%	0.051	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	107.6	178.4	-62.8	-76.7	0	0	0	109.2	W555 L567 L582 Q583 D612 Y615	W555-H604 AromaticContact CH2-CE1 3.83Å; W555-H604 AromaticContact CH2-NE2 3.63Å; W555-H604 AromaticContact CZ3-CE1 3.93Å; L567-H604 WeakPolarHBondContact CD1-CE1 3.17Å; L582-H604 WeakPolarHBondContact CA-O 3.33Å; Q583-H604 HydrophobicContact CB-CB 4.3Å; Q583-H604 PolarHBondContact N-O 3.16Å; H604-D612 WeakPolarHBondContact CA-OD1 3.11Å; H604-D612 IonicContact CE1-OD2 2.77Å; H604-D612 IonicContact CG-OD2 3.29Å; H604-D612 IonicContact ND1-OD1 3.69Å; H604-D612 IonicContact ND1-OD2 3.48Å; H604-D612 PolarHBondContact ND1-OD2 2.83Å; H604-Y615 AromaticContact CE1-CZ 3.9Å; H604-Y615 PolarHBondContact CE1-OH 2.89Å; H604-Y615 AromaticContact ND1-CE2 4Å
605	A	88.8	Confident	87.4	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	95.3	178.3	0	0	0	0	0	108.1	L522 W523 P577 G603 D612 L613	L522-A605 HydrophobicContact CD1-CB 3.79Å; L522-A605 HydrophobicContact CD2-CB 3.91Å; L522-A605 HydrophobicContact CG-CB 4.28Å; W523-A605 HydrophobicContact CZ2-CB 4.19Å; P577-A605 HydrophobicContact CB-CB 3.84Å; P577-A605 HydrophobicContact CG-CB 4.02Å; G603-A605 PolarHBondContact O-N 3.17Å; A605-D612 PolarHBondContact N-OD1 2.96Å; A605-L613 HydrophobicContact CB-CB 4.38Å; A605-L613 WeakPolarHBondContact O-CB 3.06Å; A605-L613 PolarHBondContact O-N 3.49Å
606	V	88.4	Confident	88	Confident	31 Å²	31	36.1 Å²	36.1	19%	0.188	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	124.3	-171.1	-174.6	0	0	0	0	109.6	G580 E581 Q583 D612	G580-V606 CarbonylContact C-O 3.57Å; G580-V606 VanDerWaalsContact CA-O 3.26Å; G580-V606 WeakPolarHBondContact CA-O 3.42Å; E581-V606 PolarHBondContact N-O 2.84Å; E581-V606 PolarHBondContact O-N 3.42Å; Q583-V606 HydrophobicContact CB-CG2 4.11Å; V606-D612 HydrophobicContact CG2-CB 4.21Å
607	L	84.2	Confident	88.2	Confident	17 Å²	17	29 Å²	29	9%	0.089	15%	0.149	C	C	.	.			trans	-78.8	168.2	175.5	-71.2	174.5	0	0	0	111.6	I310 L346 F579 D609 G610 L611 L613	I310-L607 HydrophobicContact CD1-CB 4.09Å; I310-L607 HydrophobicContact CD1-CD1 4.1Å; I310-L607 HydrophobicContact CD1-CD2 4.13Å; I310-L607 HydrophobicContact CD1-CG 4.34Å; L346-L607 HydrophobicContact CD2-CD2 4.31Å; F579-L607 HydrophobicContact CB-CD2 4.46Å; L607-D609 VanDerWaalsContact CB-OD1 3.25Å; L607-D609 WeakPolarHBondContact CB-OD1 3.4Å; L607-D609 PolarHBondContact O-N 3.04Å; L607-G610 PolarHBondContact O-N 2.93Å; L607-L611 HydrophobicContact CB-CB 4.44Å; L607-L611 HydrophobicContact CD1-CB 4.27Å; L607-L611 HydrophobicContact CD1-CD2 4.2Å; L607-L611 PolarHBondContact N-O 3.24Å; L607-L613 HydrophobicContact CD1-CD1 3.71Å; L607-L613 HydrophobicContact CD1-CD2 3.77Å; L607-L613 HydrophobicContact CD1-CG 3.71Å; L607-L613 HydrophobicContact CD2-CD1 3.85Å; L607-L613 HydrophobicContact CG-CD1 3.73Å; L607-L613 HydrophobicContact CG-CD2 4.44Å; L607-L613 HydrophobicContact CG-CG 3.84Å
608	D	76.1	Confident	88.6	Confident	31 Å²	31	23.3 Å²	23.3	17%	0.166	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-28.7	177.9	-69.2	-31.9	0	0	0	113.3	R304 R347 G610	R304-D608 IonicContact CZ-OD1 2.73Å; R304-D608 PolarHBondContact NH1-O 3.41Å; R304-D608 IonicContact NH1-OD1 3.58Å; R304-D608 IonicContact NH2-OD1 3.77Å; R304-D608 PolarHBondContact NH2-OD1 3.46Å; R347-D608 WeakPolarHBondContact CB-OD2 3.42Å; R347-D608 IonicContact NE-OD2 3.66Å; D608-G610 PolarHBondContact O-N 3.28Å
609	D	77.4	Confident	88.7	Confident	10 Å²	10	22.1 Å²	22.1	5%	0.053	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	7.4	177.6	70.2	-11.4	0	0	0	113.5	A308 Y309 I310 R318 L607 L611	A308-D609 WeakPolarHBondContact O-CB 3.48Å; Y309-D609 HydrophobicContact CD1-CB 3.95Å; I310-D609 HydrophobicContact CG1-CB 4.49Å; I310-D609 PolarHBondContact N-OD2 3.34Å; R318-D609 IonicContact NH2-OD2 2.93Å; R318-D609 PolarHBondContact NH2-OD2 3.12Å; L607-D609 VanDerWaalsContact CB-OD1 3.25Å; L607-D609 WeakPolarHBondContact CB-OD1 3.4Å; L607-D609 PolarHBondContact O-N 3.04Å; D609-L611 PolarHBondContact O-N 2.66Å; D609-L611 WeakPolarHBondContact OD1-CB 3.35Å; D609-L611 PolarHBondContact OD1-N 3.47Å; D609-L611 VanDerWaalsContact OD1-N 3.08Å
610	G	81.1	Confident	89	Confident	45 Å²	45	21 Å²	21	46%	0.464	12%	0.118	S	C	.	.	S	Bend	trans	77.5	1.6	-177.2	0	0	0	0	0	114	L607 D608 D612	L607-G610 PolarHBondContact O-N 2.93Å; D608-G610 PolarHBondContact O-N 3.28Å; G610-D612 PolarHBondContact O-N 3.11Å
611	L	85.3	Confident	89.1	Confident	62 Å²	62	21.9 Å²	21.9	33%	0.325	12%	0.124	S	C	.	.			trans	-72.1	121.9	176.1	-178.7	63.8	0	0	0	110.4	L607 D609 L613	L607-L611 HydrophobicContact CB-CB 4.44Å; L607-L611 HydrophobicContact CD1-CB 4.27Å; L607-L611 HydrophobicContact CD1-CD2 4.2Å; L607-L611 PolarHBondContact N-O 3.24Å; D609-L611 PolarHBondContact O-N 2.66Å; D609-L611 WeakPolarHBondContact OD1-CB 3.35Å; D609-L611 PolarHBondContact OD1-N 3.47Å; D609-L611 VanDerWaalsContact OD1-N 3.08Å; L611-L613 HydrophobicContact CD2-CD2 3.85Å; L611-L613 HydrophobicContact CG-CD2 4.17Å; L611-L613 PolarHBondContact O-N 3.02Å
612	D	89.1	Confident	89.3	Confident	29 Å²	29	19.5 Å²	19.5	16%	0.155	12%	0.116	C	C	.	.	B	Isolated β-bridge	trans	-87	103.4	172.4	-174.6	3.8	0	0	0	110.7	H604 A605 V606 G610 G614 Y615	H604-D612 WeakPolarHBondContact CA-OD1 3.11Å; H604-D612 IonicContact CE1-OD2 2.77Å; H604-D612 IonicContact CG-OD2 3.29Å; H604-D612 IonicContact ND1-OD1 3.69Å; H604-D612 IonicContact ND1-OD2 3.48Å; H604-D612 PolarHBondContact ND1-OD2 2.83Å; A605-D612 PolarHBondContact N-OD1 2.96Å; V606-D612 HydrophobicContact CG2-CB 4.21Å; G610-D612 PolarHBondContact O-N 3.11Å; D612-G614 PolarHBondContact O-N 2.83Å; D612-G614 VanDerWaalsContact OD1-CA 3.3Å; D612-G614 WeakPolarHBondContact OD1-CA 3.37Å; D612-G614 PolarHBondContact OD1-N 2.81Å; D612-Y615 HydrophobicContact CB-CD2 4.07Å; D612-Y615 HydrophobicContact CB-CE2 4.33Å; D612-Y615 PolarHBondContact O-N 3.18Å; D612-Y615 WeakPolarHBondContact OD2-CD2 3.23Å; D612-Y615 WeakPolarHBondContact OD2-CE2 3.3Å
613	L	89.3	Confident	89.3	Confident	29 Å²	29	20.5 Å²	20.5	15%	0.152	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-3.8	174.4	-59.6	-179.2	0	0	0	113	Q518 L522 F579 A605 L607 L611 Y615	Q518-L613 PolarHBondContact NE2-O 3.42Å; Q518-L613 VanDerWaalsContact NE2-O 3.17Å; L522-L613 HydrophobicContact CD1-CB 4.19Å; L522-L613 HydrophobicContact CD1-CD1 3.92Å; L522-L613 HydrophobicContact CD2-CB 3.9Å; L522-L613 WeakPolarHBondContact CD2-O 3.13Å; F579-L613 HydrophobicContact CB-CD1 4.44Å; A605-L613 HydrophobicContact CB-CB 4.38Å; A605-L613 WeakPolarHBondContact O-CB 3.06Å; A605-L613 PolarHBondContact O-N 3.49Å; L607-L613 HydrophobicContact CD1-CD1 3.71Å; L607-L613 HydrophobicContact CD1-CD2 3.77Å; L607-L613 HydrophobicContact CD1-CG 3.71Å; L607-L613 HydrophobicContact CD2-CD1 3.85Å; L607-L613 HydrophobicContact CG-CD1 3.73Å; L607-L613 HydrophobicContact CG-CD2 4.44Å; L607-L613 HydrophobicContact CG-CG 3.84Å; L611-L613 HydrophobicContact CD2-CD2 3.85Å; L611-L613 HydrophobicContact CG-CD2 4.17Å; L611-L613 PolarHBondContact O-N 3.02Å; L613-Y615 PolarHBondContact O-N 3.38Å
614	G	91.2	Very high	89.3	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-10.3	173.7	0	0	0	0	0	114	L567 L568 G603 D612	L567-G614 WeakPolarHBondContact CD1-O 3.41Å; L568-G614 WeakPolarHBondContact CB-O 3.48Å; L568-G614 PolarHBondContact N-O 2.73Å; G603-G614 VanDerWaalsContact O-CA 3.23Å; G603-G614 WeakPolarHBondContact O-CA 3.31Å; D612-G614 PolarHBondContact O-N 2.83Å; D612-G614 VanDerWaalsContact OD1-CA 3.3Å; D612-G614 WeakPolarHBondContact OD1-CA 3.37Å; D612-G614 PolarHBondContact OD1-N 2.81Å
615	Y	95	Very high	89.2	Confident	12 Å²	12	30.4 Å²	30.4	5%	0.047	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-98.7	154.8	170.7	-69.4	-82	0	0	0	111.7	Q518 N545 G547 W555 L567 H604 D612 L613 D617 R631	Q518-Y615 PolarHBondContact NE2-O 3.39Å; N545-Y615 WeakPolarHBondContact OD1-CE1 3.5Å; N545-Y615 PolarHBondContact OD1-OH 3.46Å; G547-Y615 WeakPolarHBondContact CA-OH 3.33Å; W555-Y615 WeakPolarHBondContact CZ3-OH 3.49Å; L567-Y615 HydrophobicContact CD1-CE1 4.42Å; H604-Y615 AromaticContact CE1-CZ 3.9Å; H604-Y615 PolarHBondContact CE1-OH 2.89Å; H604-Y615 AromaticContact ND1-CE2 4Å; D612-Y615 HydrophobicContact CB-CD2 4.07Å; D612-Y615 HydrophobicContact CB-CE2 4.33Å; D612-Y615 PolarHBondContact O-N 3.18Å; D612-Y615 WeakPolarHBondContact OD2-CD2 3.23Å; D612-Y615 WeakPolarHBondContact OD2-CE2 3.3Å; L613-Y615 PolarHBondContact O-N 3.38Å; Y615-D617 PolarHBondContact O-N 3.48Å; Y615-R631 HydrophobicContact CD1-CG 4.35Å
616	V	96	Very high	89.4	Confident	5 Å²	5	32.6 Å²	32.6	3%	0.03	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-61.1	128.2	174.5	175.5	0	0	0	0	110.4	R515 Y533 L564 G566 L568 T620	R515-V616 HydrophobicContact CG-CG1 4.22Å; R515-V616 HydrophobicContact CG-CG2 4.34Å; Y533-V616 HydrophobicContact CE1-CG2 4.05Å; L564-V616 WeakPolarHBondContact O-CG2 3.14Å; G566-V616 PolarHBondContact O-N 2.74Å; L568-V616 HydrophobicContact CB-CG2 4.34Å; L568-V616 HydrophobicContact CD1-CG2 3.92Å; V616-T620 HydrophobicContact CG1-CG2 3.71Å
617	D	93.6	Very high	89.6	Confident	40 Å²	40	31.1 Å²	31.1	21%	0.214	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-59.1	143.3	-179.4	-89.2	1.4	0	0	0	112.7	K513 Q518 Y615 T620	K513-D617 HydrophobicContact CD-CB 4.36Å; K513-D617 IonicContact NZ-OD2 3.02Å; K513-D617 PolarHBondContact NZ-OD2 2.8Å; Q518-D617 PolarHBondContact NE2-OD1 3.47Å; Y615-D617 PolarHBondContact O-N 3.48Å; D617-T620 WeakPolarHBondContact O-CB 3.26Å; D617-T620 PolarHBondContact O-N 3.49Å; D617-T620 PolarHBondContact O-OG1 3.47Å
618	D	91.9	Very high	90.1	Very high	59 Å²	59	30.3 Å²	30.3	32%	0.316	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	142.9	168	-68.4	-22.3	0	0	0	111.1	Y508 T620 C628 L629 E630	Y508-D618 HydrophobicContact CE1-CB 4.1Å; D618-T620 VanDerWaalsContact C-N 3.29Å; D618-C628 CarbonylContact C-O 3.43Å; D618-C628 WeakPolarHBondContact CA-O 3.3Å; D618-L629 HydrophobicContact CB-CD1 4.45Å; D618-L629 VanDerWaalsContact OD1-CA 3.31Å; D618-L629 WeakPolarHBondContact OD1-CA 3.29Å; D618-E630 PolarHBondContact OD1-N 3.07Å
619	G	91.6	Very high	90.9	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	-12.2	-173.3	0	0	0	0	0	114.9	C628	G619-C628 PolarHBondContact N-O 3.28Å
620	T	95.3	Very high	91.5	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.006	22%	0.219	C	C	.	.			trans	-68.3	135.2	179.2	-56.5	0	0	0	0	111.3	R515 V616 D617 D618 C622 M627 C628	R515-T620 HydrophobicContact CG-CG2 3.72Å; V616-T620 HydrophobicContact CG1-CG2 3.71Å; D617-T620 WeakPolarHBondContact O-CB 3.26Å; D617-T620 PolarHBondContact O-N 3.49Å; D617-T620 PolarHBondContact O-OG1 3.47Å; D618-T620 VanDerWaalsContact C-N 3.29Å; T620-C622 PolarHBondContact O-N 3.44Å; T620-M627 CarbonylContact O-C 3.34Å; T620-M627 VanDerWaalsContact O-CA 3.29Å; T620-M627 WeakPolarHBondContact O-CA 3.36Å; T620-C628 PolarHBondContact O-N 2.76Å; T620-C628 PolarHBondContact O-SG 3.17Å
621	P	95.1	Very high	92	Very high	18 Å²	18	39.8 Å²	39.8	12%	0.117	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	126.5	-179.3	25.2	-33.1	0	0	0	112.5	Q504 R506 K513 R515 M626	Q504-P621 WeakPolarHBondContact O-CG 3.29Å; R506-P621 HydrophobicContact CG-CB 4.27Å; K513-P621 WeakPolarHBondContact O-CD 3.42Å; R515-P621 PolarHBondContact NH1-O 2.83Å; P621-M626 WeakPolarHBondContact CA-O 3.02Å
622	C	94.6	Very high	92.4	Very high	9 Å²	9	43.5 Å²	43.5	6%	0.061	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-6.8	177.4	57.3	0	0	0	0	113.3	L564 C565 T620 M626 M627 C633	L564-C622 HydrophobicContact CB-CB 3.99Å; L564-C622 WeakPolarHBondContact CD1-O 3.32Å; C565-C622 VanDerWaalsContact SG-CB 3.53Å; T620-C622 PolarHBondContact O-N 3.44Å; C622-M626 PolarHBondContact N-O 2.85Å; C622-M627 VanDerWaalsContact SG-C 3.57Å; C622-C633 HydrophobicContact CB-CB 3.79Å; C622-C633 WeakPolarHBondContact CB-SG 3.47Å; C622-C633 WeakPolarHBondContact SG-CA 3.47Å; C622-C633 WeakPolarHBondContact SG-CB 3.48Å; C622-C633 CovalentContact SG-SG 2.03Å; C622-C633 PolarHBondContact SG-SG 3.08Å
623	G	91.4	Very high	92.8	Very high	20 Å²	20	42.5 Å²	42.5	21%	0.206	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.7	179.2	177	0	0	0	0	0	112.6	N625 M626	G623-N625 PolarHBondContact O-N 3.28Å; G623-M626 PolarHBondContact O-N 2.95Å; G623-M626 VanDerWaalsContact O-N 3.12Å
624	P	90	Very high	93	Very high	127 Å²	127	42.8 Å²	42.8	83%	0.825	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	119.3	174.5	-20.4	32.5	0	0	0	110.4	M626	P624-M626 WeakPolarHBondContact O-CG 3.47Å; P624-M626 PolarHBondContact O-N 2.71Å
625	N	88.3	Confident	93	Very high	94 Å²	94	45.6 Å²	45.6	50%	0.503	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	31.2	-175	-151.7	34.9	0	0	0	115.4	G623 V636	G623-N625 PolarHBondContact O-N 3.28Å; N625-V636 WeakPolarHBondContact O-CG2 3.45Å; N625-V636 PolarHBondContact O-N 2.94Å
626	M	92.1	Very high	92.5	Very high	45 Å²	45	45.9 Å²	45.9	22%	0.222	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	151.4	176.9	-56.9	-177.4	78.8	0	0	111.4	P621 C622 G623 P624 C633 L634 P635	P621-M626 WeakPolarHBondContact CA-O 3.02Å; C622-M626 PolarHBondContact N-O 2.85Å; G623-M626 PolarHBondContact O-N 2.95Å; G623-M626 VanDerWaalsContact O-N 3.12Å; P624-M626 WeakPolarHBondContact O-CG 3.47Å; P624-M626 PolarHBondContact O-N 2.71Å; M626-C633 HydrophobicContact CE-CB 4.43Å; M626-C633 VanDerWaalsContact CE-O 3.25Å; M626-C633 WeakPolarHBondContact CE-O 3.04Å; M626-L634 CarbonylContact C-O 3.43Å; M626-L634 VanDerWaalsContact CA-O 3.24Å; M626-L634 WeakPolarHBondContact CA-O 3.47Å; M626-L634 WeakPolarHBondContact CB-O 3.24Å; M626-P635 HydrophobicContact CE-CG 4.31Å
627	M	93.8	Very high	91.8	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	158.4	179.4	59.6	-172.9	-93.8	0	0	111.3	Y508 T620 C622 L634 V636 F639	Y508-M627 HydrophobicContact CD2-CE 3.62Å; Y508-M627 HydrophobicContact CE2-CE 3.79Å; T620-M627 CarbonylContact O-C 3.34Å; T620-M627 VanDerWaalsContact O-CA 3.29Å; T620-M627 WeakPolarHBondContact O-CA 3.36Å; C622-M627 VanDerWaalsContact SG-C 3.57Å; M627-L634 PolarHBondContact N-O 3.11Å; M627-L634 PolarHBondContact O-N 3.08Å; M627-V636 HydrophobicContact CG-CG2 4.13Å; M627-V636 HydrophobicContact SD-CG2 3.98Å; M627-F639 HydrophobicContact CB-CZ 4.36Å; M627-F639 HydrophobicContact CE-CD1 3.4Å; M627-F639 HydrophobicContact CE-CD2 4.21Å; M627-F639 HydrophobicContact CE-CE1 3.17Å; M627-F639 HydrophobicContact CE-CE2 4.09Å; M627-F639 HydrophobicContact CE-CG 3.92Å; M627-F639 HydrophobicContact CE-CZ 3.6Å; M627-F639 HydrophobicContact CG-CD2 3.89Å; M627-F639 HydrophobicContact CG-CE1 3.97Å; M627-F639 HydrophobicContact CG-CE2 3.21Å; M627-F639 HydrophobicContact CG-CZ 3.27Å; M627-F639 HydrophobicContact SD-CD1 4.26Å; M627-F639 HydrophobicContact SD-CD2 4.01Å; M627-F639 HydrophobicContact SD-CE1 4.12Å; M627-F639 HydrophobicContact SD-CE2 3.91Å; M627-F639 HydrophobicContact SD-CG 4.21Å; M627-F639 HydrophobicContact SD-CZ 3.98Å
628	C	95	Very high	91.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	136.7	-178	-61.1	0	0	0	0	111.8	C565 D618 G619 T620 R632	C565-C628 WeakPolarHBondContact CA-SG 3.26Å; C565-C628 HydrophobicContact CB-CB 3.7Å; C565-C628 WeakPolarHBondContact CB-SG 3.42Å; C565-C628 WeakPolarHBondContact SG-CA 3.5Å; C565-C628 WeakPolarHBondContact SG-CB 3.04Å; C565-C628 CovalentContact SG-SG 2.04Å; C565-C628 PolarHBondContact SG-SG 3.48Å; D618-C628 CarbonylContact C-O 3.43Å; D618-C628 WeakPolarHBondContact CA-O 3.3Å; G619-C628 PolarHBondContact N-O 3.28Å; T620-C628 PolarHBondContact O-N 2.76Å; T620-C628 PolarHBondContact O-SG 3.17Å; C628-R632 CarbonylContact C-O 3.52Å; C628-R632 VanDerWaalsContact CA-O 3.3Å; C628-R632 WeakPolarHBondContact CA-O 3.38Å
629	L	91.6	Very high	90.5	Very high	42 Å²	42	50.2 Å²	50.2	22%	0.22	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	127	166.1	-174	61.7	0	0	0	109.2	D618 R631 R632 L634 F639	D618-L629 HydrophobicContact CB-CD1 4.45Å; D618-L629 VanDerWaalsContact OD1-CA 3.31Å; D618-L629 WeakPolarHBondContact OD1-CA 3.29Å; L629-R631 PolarHBondContact O-N 2.85Å; L629-R631 VanDerWaalsContact O-N 3.15Å; L629-R632 PolarHBondContact N-O 3.28Å; L629-R632 PolarHBondContact O-N 2.83Å; L629-L634 HydrophobicContact CB-CD1 4.14Å; L629-L634 HydrophobicContact CD2-CD1 4.28Å; L629-F639 HydrophobicContact CB-CE1 3.48Å; L629-F639 VanDerWaalsContact CB-CE1 3.48Å; L629-F639 HydrophobicContact CB-CZ 3.43Å; L629-F639 VanDerWaalsContact CB-CZ 3.43Å; L629-F639 HydrophobicContact CD1-CE1 3.91Å; L629-F639 HydrophobicContact CD2-CD1 4.02Å; L629-F639 HydrophobicContact CD2-CE1 3.75Å; L629-F639 HydrophobicContact CD2-CZ 4.17Å; L629-F639 HydrophobicContact CG-CE1 3.91Å; L629-F639 HydrophobicContact CG-CZ 4.3Å
630	E	89.5	Confident	89.4	Confident	158 Å²	158	57.2 Å²	57.2	74%	0.738	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	43	178.1	-63.1	-179.8	170.5	0	0	111.3	D618 R632	D618-E630 PolarHBondContact OD1-N 3.07Å; E630-R632 PolarHBondContact O-N 2.92Å
631	R	92.9	Very high	88.4	Confident	85 Å²	85	59.7 Å²	59.7	32%	0.321	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	16.6	-179.6	-49.3	172.3	-176	137.3	-0.8	115.4	C546 C565 Y615 L629	C546-R631 WeakPolarHBondContact O-CD 3.41Å; C565-R631 WeakPolarHBondContact O-CA 3.34Å; Y615-R631 HydrophobicContact CD1-CG 4.35Å; L629-R631 PolarHBondContact O-N 2.85Å; L629-R631 VanDerWaalsContact O-N 3.15Å
632	R	94.3	Very high	87.5	Confident	141 Å²	141	62.2 Å²	62.2	53%	0.532	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	143.5	176	-59.8	-177.2	67.2	-175.8	-0.6	111.2	D562 C628 L629 E630 L634	D562-R632 WeakPolarHBondContact OD1-CA 3.46Å; C628-R632 CarbonylContact C-O 3.52Å; C628-R632 VanDerWaalsContact CA-O 3.3Å; C628-R632 WeakPolarHBondContact CA-O 3.38Å; L629-R632 PolarHBondContact N-O 3.28Å; L629-R632 PolarHBondContact O-N 2.83Å; E630-R632 PolarHBondContact O-N 2.92Å; R632-L634 HydrophobicContact CB-CD2 4.16Å; R632-L634 HydrophobicContact CB-CG 4.17Å; R632-L634 PolarHBondContact O-N 2.97Å
633	C	95.6	Very high	86.9	Confident	8 Å²	8	65.5 Å²	65.5	5%	0.054	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	104.3	175	-174.8	0	0	0	0	109.5	Q561 D562 C622 M626	Q561-C633 WeakPolarHBondContact O-CB 3.23Å; D562-C633 PolarHBondContact OD1-N 2.65Å; C622-C633 HydrophobicContact CB-CB 3.79Å; C622-C633 WeakPolarHBondContact CB-SG 3.47Å; C622-C633 WeakPolarHBondContact SG-CA 3.47Å; C622-C633 WeakPolarHBondContact SG-CB 3.48Å; C622-C633 CovalentContact SG-SG 2.03Å; C622-C633 PolarHBondContact SG-SG 3.08Å; M626-C633 HydrophobicContact CE-CB 4.43Å; M626-C633 VanDerWaalsContact CE-O 3.25Å; M626-C633 WeakPolarHBondContact CE-O 3.04Å
634	L	93.7	Very high	86.6	Confident	35 Å²	35	64.9 Å²	64.9	18%	0.183	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	147.8	-175.4	-58.3	-179.6	0	0	0	111	M626 M627 L629 R632 T638 F639	M626-L634 CarbonylContact C-O 3.43Å; M626-L634 VanDerWaalsContact CA-O 3.24Å; M626-L634 WeakPolarHBondContact CA-O 3.47Å; M626-L634 WeakPolarHBondContact CB-O 3.24Å; M627-L634 PolarHBondContact N-O 3.11Å; M627-L634 PolarHBondContact O-N 3.08Å; L629-L634 HydrophobicContact CB-CD1 4.14Å; L629-L634 HydrophobicContact CD2-CD1 4.28Å; R632-L634 HydrophobicContact CB-CD2 4.16Å; R632-L634 HydrophobicContact CB-CG 4.17Å; R632-L634 PolarHBondContact O-N 2.97Å; L634-T638 HydrophobicContact CB-CG2 4.42Å; L634-T638 HydrophobicContact CD1-CG2 4.12Å; L634-F639 HydrophobicContact CB-CE2 3.88Å; L634-F639 HydrophobicContact CB-CZ 4.45Å
635	P	91.3	Very high	86.6	Confident	58 Å²	58	61.8 Å²	61.8	38%	0.377	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	141.7	168.4	-22.1	33.6	0	0	0	111.2	M626 P637 T638	M626-P635 HydrophobicContact CE-CG 4.31Å; P635-P637 VanDerWaalsContact C-N 3.29Å; P635-T638 VanDerWaalsContact O-CB 3.23Å; P635-T638 WeakPolarHBondContact O-CB 3.4Å; P635-T638 PolarHBondContact O-N 3.26Å; P635-T638 PolarHBondContact O-OG1 3.48Å
636	V	85.9	Confident	86.4	Confident	18 Å²	18	58.5 Å²	58.5	11%	0.109	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-52.2	-39.1	178.1	174.3	0	0	0	0	113.2	N625 M627 T638 F639 L641	N625-V636 WeakPolarHBondContact O-CG2 3.45Å; N625-V636 PolarHBondContact O-N 2.94Å; M627-V636 HydrophobicContact CG-CG2 4.13Å; M627-V636 HydrophobicContact SD-CG2 3.98Å; V636-T638 PolarHBondContact O-N 2.76Å; V636-T638 VanDerWaalsContact O-N 3.13Å; V636-F639 WeakPolarHBondContact O-CB 3.03Å; V636-F639 WeakPolarHBondContact O-CD2 3.37Å; V636-F639 PolarHBondContact O-N 2.87Å; V636-L641 HydrophobicContact CG1-CD1 3.76Å
637	P	81.6	Confident	85.8	Confident	95 Å²	95	59.7 Å²	59.7	62%	0.617	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-59.8	-23	175.9	-26.1	35.9	0	0	0	115.1	P635 F639	P635-P637 VanDerWaalsContact C-N 3.29Å; P637-F639 PolarHBondContact O-N 3.18Å
638	T	79.6	Confident	85.1	Confident	73 Å²	73	61.9 Å²	61.9	45%	0.448	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-70.2	-16	-179.7	-53.2	0	0	0	0	112.9	L634 P635 V636 N640	L634-T638 HydrophobicContact CB-CG2 4.42Å; L634-T638 HydrophobicContact CD1-CG2 4.12Å; P635-T638 VanDerWaalsContact O-CB 3.23Å; P635-T638 WeakPolarHBondContact O-CB 3.4Å; P635-T638 PolarHBondContact O-N 3.26Å; P635-T638 PolarHBondContact O-OG1 3.48Å; V636-T638 PolarHBondContact O-N 2.76Å; V636-T638 VanDerWaalsContact O-N 3.13Å; T638-N640 PolarHBondContact O-N 3.33Å; T638-N640 VanDerWaalsContact O-N 3.14Å
639	F	76.8	Confident	84	Confident	28 Å²	28	69 Å²	69	12%	0.123	39%	0.394	C	S	.	.	G	3₁₀ helix	trans	-76.5	6.4	-179.5	-73.4	-104.1	0	0	0	113.5	M627 L629 L634 V636 P637 L641	M627-F639 HydrophobicContact CB-CZ 4.36Å; M627-F639 HydrophobicContact CE-CD1 3.4Å; M627-F639 HydrophobicContact CE-CD2 4.21Å; M627-F639 HydrophobicContact CE-CE1 3.17Å; M627-F639 HydrophobicContact CE-CE2 4.09Å; M627-F639 HydrophobicContact CE-CG 3.92Å; M627-F639 HydrophobicContact CE-CZ 3.6Å; M627-F639 HydrophobicContact CG-CD2 3.89Å; M627-F639 HydrophobicContact CG-CE1 3.97Å; M627-F639 HydrophobicContact CG-CE2 3.21Å; M627-F639 HydrophobicContact CG-CZ 3.27Å; M627-F639 HydrophobicContact SD-CD1 4.26Å; M627-F639 HydrophobicContact SD-CD2 4.01Å; M627-F639 HydrophobicContact SD-CE1 4.12Å; M627-F639 HydrophobicContact SD-CE2 3.91Å; M627-F639 HydrophobicContact SD-CG 4.21Å; M627-F639 HydrophobicContact SD-CZ 3.98Å; L629-F639 HydrophobicContact CB-CE1 3.48Å; L629-F639 VanDerWaalsContact CB-CE1 3.48Å; L629-F639 HydrophobicContact CB-CZ 3.43Å; L629-F639 VanDerWaalsContact CB-CZ 3.43Å; L629-F639 HydrophobicContact CD1-CE1 3.91Å; L629-F639 HydrophobicContact CD2-CD1 4.02Å; L629-F639 HydrophobicContact CD2-CE1 3.75Å; L629-F639 HydrophobicContact CD2-CZ 4.17Å; L629-F639 HydrophobicContact CG-CE1 3.91Å; L629-F639 HydrophobicContact CG-CZ 4.3Å; L634-F639 HydrophobicContact CB-CE2 3.88Å; L634-F639 HydrophobicContact CB-CZ 4.45Å; V636-F639 WeakPolarHBondContact O-CB 3.03Å; V636-F639 WeakPolarHBondContact O-CD2 3.37Å; V636-F639 PolarHBondContact O-N 2.87Å; P637-F639 PolarHBondContact O-N 3.18Å; F639-L641 HydrophobicContact CB-CD1 3.86Å; F639-L641 HydrophobicContact CB-CD2 4.13Å; F639-L641 HydrophobicContact CB-CG 3.61Å; F639-L641 PolarHBondContact O-N 3.38Å
640	N	70.6	Confident	83.2	Confident	147 Å²	147	71.2 Å²	71.2	79%	0.786	41%	0.412	S	S	*	.			trans	47.3	36	-176	-67	-32.7	0	0	0	112.3	T638 S642	T638-N640 PolarHBondContact O-N 3.33Å; T638-N640 VanDerWaalsContact O-N 3.14Å; N640-S642 PolarHBondContact O-N 2.75Å
641	L	72.5	Confident	82.9	Confident	53 Å²	53	69.9 Å²	69.9	28%	0.277	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-66	119.5	-180	-63.5	166.8	0	0	0	107.5	D496 V636 F639 S643	D496-L641 HydrophobicContact CB-CD2 3.73Å; D496-L641 WeakPolarHBondContact O-CD1 3.39Å; V636-L641 HydrophobicContact CG1-CD1 3.76Å; F639-L641 HydrophobicContact CB-CD1 3.86Å; F639-L641 HydrophobicContact CB-CD2 4.13Å; F639-L641 HydrophobicContact CB-CG 3.61Å; F639-L641 PolarHBondContact O-N 3.38Å; L641-S643 PolarHBondContact O-N 2.84Å
642	S	77.8	Confident	82.6	Confident	71 Å²	71	69.2 Å²	69.2	50%	0.497	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-61.5	132.5	176.1	-65.3	0	0	0	0	109	L495 N640 V663	L495-S642 WeakPolarHBondContact CD2-O 3.49Å; N640-S642 PolarHBondContact O-N 2.75Å; S642-V663 VanDerWaalsContact CB-CG2 3.45Å
643	S	81.1	Confident	82.4	Confident	78 Å²	78	62.5 Å²	62.5	55%	0.545	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-91.5	137.9	177.1	-174.4	0	0	0	0	110.4	L641 V663	L641-S643 PolarHBondContact O-N 2.84Å; S643-V663 WeakPolarHBondContact O-CG1 3.41Å
644	C	85.9	Confident	82.2	Confident	7 Å²	7	62.4 Å²	62.4	5%	0.047	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-65.6	156.1	166.6	-76.9	0	0	0	0	111.6	I652 C659 K664 C665	C644-I652 HydrophobicContact CB-CG2 4.03Å; C644-C659 HydrophobicContact CB-CB 3.69Å; C644-C659 WeakPolarHBondContact CB-SG 3.08Å; C644-C659 WeakPolarHBondContact SG-CA 3.39Å; C644-C659 WeakPolarHBondContact SG-CB 3.43Å; C644-C659 CovalentContact SG-SG 2.02Å; C644-C659 PolarHBondContact SG-SG 2.86Å; C644-K664 VanDerWaalsContact SG-C 3.52Å; C644-K664 PolarHBondContact SG-N 3.45Å; C644-K664 PolarHBondContact SG-O 2.94Å; C644-C665 VanDerWaalsContact CB-SG 3.59Å
645	P	88.2	Confident	82.1	Confident	62 Å²	62	66.7 Å²	66.7	40%	0.403	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-65.9	164	174.5	30.8	-37.7	0	0	0	111.8	C653 C665 K674 D675	P645-C653 WeakPolarHBondContact O-CA 3.49Å; P645-C653 PolarHBondContact O-N 3.18Å; P645-C665 PolarHBondContact O-SG 3.09Å; P645-K674 VanDerWaalsContact CG-O 3.3Å; P645-K674 WeakPolarHBondContact CG-O 3.41Å; P645-D675 HydrophobicContact CB-CB 4.14Å; P645-D675 HydrophobicContact CG-CB 4.34Å
646	G	84.8	Confident	82.1	Confident	25 Å²	25	66.8 Å²	66.8	26%	0.258	39%	0.391	S	S	.	.			trans	-168.6	160.6	-178.3	0	0	0	0	0	111.5	S648 R651	G646-S648 PolarHBondContact O-N 2.84Å; G646-R651 VanDerWaalsContact CA-O 3.24Å; G646-R651 WeakPolarHBondContact CA-O 3Å
647	S	80.4	Confident	82.3	Confident	69 Å²	69	66.7 Å²	66.7	48%	0.483	39%	0.393	S	S	.	.	S	Bend	trans	-55.8	-24.4	175.5	67.6	0	0	0	0	113.5	S654	S647-S654 PolarHBondContact N-OG 2.89Å; S647-S654 VanDerWaalsContact N-OG 3.08Å
648	S	77.8	Confident	82.8	Confident	46 Å²	46	63.8 Å²	63.8	32%	0.322	37%	0.374	S	S	.	.	S	Bend	trans	-148.4	162	171.8	62.5	0	0	0	0	110.4	G646 S650 R651	G646-S648 PolarHBondContact O-N 2.84Å; S648-S650 PolarHBondContact O-N 3.34Å; S648-R651 PolarHBondContact O-N 3.23Å; S648-R651 WeakPolarHBondContact OG-CG 3.31Å
649	T	71.4	Confident	83.4	Confident	151 Å²	151	60.4 Å²	60.4	93%	0.926	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-22.2	-177.1	49.9	0	0	0	0	114.7
650	S	75.9	Confident	84.1	Confident	88 Å²	88	59.1 Å²	59.1	62%	0.615	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-13.4	177.1	56.1	0	0	0	0	114.7	S648	S648-S650 PolarHBondContact O-N 3.34Å
651	R	83.3	Confident	85	Confident	130 Å²	130	54.9 Å²	54.9	49%	0.491	33%	0.325	S	S	.	.	S	Bend	trans	-107	78.5	-174.2	-65	-172.2	174	-172.8	1	109.8	G646 S648 C653 S654 H655	G646-R651 VanDerWaalsContact CA-O 3.24Å; G646-R651 WeakPolarHBondContact CA-O 3Å; S648-R651 PolarHBondContact O-N 3.23Å; S648-R651 WeakPolarHBondContact OG-CG 3.31Å; R651-C653 PolarHBondContact O-N 3.14Å; R651-S654 PolarHBondContact O-N 3.15Å; R651-H655 VanDerWaalsContact CG-CD2 3.47Å; R651-H655 WeakPolarHBondContact CG-CD2 3.32Å; R651-H655 WeakPolarHBondContact CG-NE2 3.32Å
652	I	86.4	Confident	85.6	Confident	71 Å²	71	56 Å²	56	36%	0.364	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-57	126.1	177	-59.1	172.9	0	0	0	108.6	C644 S654 H655 C659	C644-I652 HydrophobicContact CB-CG2 4.03Å; I652-S654 PolarHBondContact O-N 3.23Å; I652-S654 VanDerWaalsContact O-N 3.11Å; I652-H655 PolarHBondContact O-N 3.07Å; I652-H655 VanDerWaalsContact O-N 3.08Å; I652-C659 HydrophobicContact CG2-CB 3.94Å
653	C	91.1	Very high	86.2	Confident	0 Å²	0	55 Å²	55	0%	0	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	50.9	33.5	-175.5	-55.1	0	0	0	0	113.5	P645 R651 H655 H656 C665 D675 C676	P645-C653 WeakPolarHBondContact O-CA 3.49Å; P645-C653 PolarHBondContact O-N 3.18Å; R651-C653 PolarHBondContact O-N 3.14Å; C653-H655 PolarHBondContact O-N 3.4Å; C653-H656 PolarHBondContact O-N 3.3Å; C653-C665 WeakPolarHBondContact CA-SG 3.44Å; C653-C665 HydrophobicContact CB-CB 3.71Å; C653-C665 WeakPolarHBondContact CB-SG 3.35Å; C653-C665 WeakPolarHBondContact SG-CA 3.37Å; C653-C665 WeakPolarHBondContact SG-CB 3.4Å; C653-C665 CovalentContact SG-SG 2.04Å; C653-C665 PolarHBondContact SG-SG 3.23Å; C653-D675 CarbonylContact C-O 3.54Å; C653-D675 WeakPolarHBondContact CA-O 3.39Å; C653-C676 WeakPolarHBondContact O-CB 3.01Å
654	S	90.7	Very high	86.6	Confident	6 Å²	6	57 Å²	57	4%	0.042	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	53.9	19.1	-178	-51.8	0	0	0	0	114.7	S647 R651 I652 H656 D675	S647-S654 PolarHBondContact N-OG 2.89Å; S647-S654 VanDerWaalsContact N-OG 3.08Å; R651-S654 PolarHBondContact O-N 3.15Å; I652-S654 PolarHBondContact O-N 3.23Å; I652-S654 VanDerWaalsContact O-N 3.11Å; S654-H656 PolarHBondContact O-CD2 3.16Å; S654-H656 PolarHBondContact O-N 3.13Å; S654-D675 VanDerWaalsContact CB-O 3.28Å; S654-D675 WeakPolarHBondContact CB-O 3.43Å; S654-D675 PolarHBondContact N-O 3.37Å; S654-D675 PolarHBondContact OG-O 2.88Å
655	H	90.4	Very high	86.9	Confident	124 Å²	124	57.4 Å²	57.4	57%	0.574	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	60.1	18.4	-169	-61.8	-71.9	0	0	0	115.9	R651 I652 C653	R651-H655 VanDerWaalsContact CG-CD2 3.47Å; R651-H655 WeakPolarHBondContact CG-CD2 3.32Å; R651-H655 WeakPolarHBondContact CG-NE2 3.32Å; I652-H655 PolarHBondContact O-N 3.07Å; I652-H655 VanDerWaalsContact O-N 3.08Å; C653-H655 PolarHBondContact O-N 3.4Å
656	H	91.5	Very high	87	Confident	61 Å²	61	57.3 Å²	57.3	28%	0.282	32%	0.317	S	S	.	.	S	Bend	trans	-120.5	32	179.5	-62.6	-51.7	0	0	0	111.3	C653 S654 C667 D668 Y671 C676	C653-H656 PolarHBondContact O-N 3.3Å; S654-H656 PolarHBondContact O-CD2 3.16Å; S654-H656 PolarHBondContact O-N 3.13Å; H656-C667 WeakPolarHBondContact O-CA 3.43Å; H656-D668 WeakPolarHBondContact CA-OD2 3.01Å; H656-D668 PolarHBondContact O-N 3.03Å; H656-Y671 HydrophobicContact CB-CD1 3.62Å; H656-Y671 HydrophobicContact CB-CD2 3.78Å; H656-Y671 HydrophobicContact CB-CE1 3.95Å; H656-Y671 HydrophobicContact CB-CE2 4.1Å; H656-Y671 HydrophobicContact CB-CG 3.52Å; H656-Y671 AromaticContact CD2-CD1 3.68Å; H656-Y671 AromaticContact CD2-CE1 3.26Å; H656-Y671 WeakPolarHBondContact CD2-CE1 3.41Å; H656-Y671 AromaticContact CD2-CZ 3.72Å; H656-Y671 AromaticContact CE1-CE1 3.74Å; H656-Y671 AromaticContact CE1-CZ 3.37Å; H656-Y671 PolarHBondContact CE1-OH 2.83Å; H656-Y671 AromaticContact CG-CD1 3.58Å; H656-Y671 AromaticContact CG-CD2 4Å; H656-Y671 AromaticContact CG-CE1 3.36Å; H656-Y671 AromaticContact CG-CE2 3.8Å; H656-Y671 AromaticContact CG-CG 3.89Å; H656-Y671 AromaticContact CG-CZ 3.48Å; H656-Y671 VanDerWaalsContact CG-CZ 3.48Å; H656-Y671 AromaticContact ND1-CE1 3.66Å; H656-Y671 AromaticContact ND1-CE2 3.52Å; H656-Y671 AromaticContact ND1-CZ 3.25Å; H656-Y671 VanDerWaalsContact ND1-CZ 3.25Å; H656-Y671 PolarHBondContact ND1-OH 3.06Å; H656-Y671 AromaticContact NE2-CE1 3.52Å; H656-Y671 AromaticContact NE2-CZ 3.66Å; H656-C676 HydrophobicContact CB-CB 4.07Å; H656-C676 WeakPolarHBondContact CB-O 3.46Å; H656-C676 WeakPolarHBondContact O-CB 3.21Å
657	G	90.9	Very high	87.3	Confident	15 Å²	15	57.7 Å²	57.7	16%	0.155	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.6	173.8	-178.6	0	0	0	0	0	112.7	I666	G657-I666 CarbonylContact C-O 3.58Å; G657-I666 WeakPolarHBondContact CA-O 3.47Å
658	T	92.3	Very high	87.7	Confident	35 Å²	35	57.6 Å²	57.6	22%	0.215	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	135	179.8	-59.3	0	0	0	0	110.1	I477 K494 Y498 I666	I477-T658 HydrophobicContact CD1-CG2 4.03Å; I477-T658 HydrophobicContact CG1-CG2 4.33Å; K494-T658 HydrophobicContact CD-CG2 4.08Å; K494-T658 HydrophobicContact CG-CG2 3.76Å; Y498-T658 HydrophobicContact CE1-CG2 4Å; T658-I666 PolarHBondContact N-O 2.91Å; T658-I666 PolarHBondContact O-N 3.47Å
659	C	91.9	Very high	88	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.007	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	122.9	176.7	-174.5	0	0	0	0	110.5	L495 Y498 C644 I652	L495-C659 HydrophobicContact CB-CB 4.48Å; L495-C659 PolarHBondContact N-O 2.04Å; Y498-C659 HydrophobicContact CE2-CB 4.27Å; Y498-C659 WeakPolarHBondContact OH-CB 3.48Å; Y498-C659 PolarHBondContact OH-N 2.9Å; Y498-C659 VanDerWaalsContact OH-N 3.08Å; C644-C659 HydrophobicContact CB-CB 3.69Å; C644-C659 WeakPolarHBondContact CB-SG 3.08Å; C644-C659 WeakPolarHBondContact SG-CA 3.39Å; C644-C659 WeakPolarHBondContact SG-CB 3.43Å; C644-C659 CovalentContact SG-SG 2.02Å; C644-C659 PolarHBondContact SG-SG 2.86Å; I652-C659 HydrophobicContact CG2-CB 3.94Å
660	S	91.8	Very high	88.7	Confident	1 Å²	1	55 Å²	55	1%	0.007	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-83.4	168	177.3	74.2	0	0	0	0	112.8	H493 E662 V663 K664	H493-S660 CarbonylContact O-C 3.6Å; H493-S660 VanDerWaalsContact O-CA 3.31Å; H493-S660 WeakPolarHBondContact O-CA 3.49Å; S660-E662 PolarHBondContact O-N 2.89Å; S660-E662 PolarHBondContact OG-N 3.37Å; S660-V663 PolarHBondContact O-N 3.09Å; S660-K664 PolarHBondContact N-O 2.99Å; S660-K664 PolarHBondContact OG-N 3.49Å; S660-K664 PolarHBondContact OG-O 2.03Å
661	N	87.9	Confident	89.4	Confident	59 Å²	59	53.3 Å²	53.3	32%	0.316	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.8	173.7	67.3	-64	0	0	0	114.2	H493 V663	H493-N661 WeakPolarHBondContact CE1-CB 2.99Å; H493-N661 PolarHBondContact N-OD1 3.01Å; H493-N661 PolarHBondContact O-N 3.43Å; H493-N661 PolarHBondContact O-OD1 2.91Å; N661-V663 PolarHBondContact O-N 3.35Å
662	E	86.9	Confident	89.6	Confident	76 Å²	76	49.9 Å²	49.9	36%	0.355	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	6.9	172.8	-61	-168.4	169.8	0	0	113.4	H490 S660 K664	H490-E662 IonicContact CD2-OE1 3.15Å; H490-E662 IonicContact CE1-OE1 3.92Å; H490-E662 IonicContact NE2-OE1 3.72Å; H490-E662 PolarHBondContact NE2-OE1 3.06Å; H490-E662 IonicContact NE2-OE2 3.81Å; S660-E662 PolarHBondContact O-N 2.89Å; S660-E662 PolarHBondContact OG-N 3.37Å; E662-K664 VanDerWaalsContact C-N 3.27Å; E662-K664 HydrophobicContact CB-CD 4.31Å; E662-K664 HydrophobicContact CB-CG 4.38Å; E662-K664 PolarHBondContact O-N 3.19Å; E662-K664 IonicContact OE2-NZ 3.95Å; E662-K664 PolarHBondContact OE2-NZ 3.46Å
663	V	88.8	Confident	89.6	Confident	51 Å²	51	48.1 Å²	48.1	31%	0.309	26%	0.264	S	S	.	.	S	Bend	trans	60.5	39.7	-176.6	-158.5	0	0	0	0	111.4	S642 S643 S660 N661	S642-V663 VanDerWaalsContact CB-CG2 3.45Å; S643-V663 WeakPolarHBondContact O-CG1 3.41Å; S660-V663 PolarHBondContact O-N 3.09Å; N661-V663 PolarHBondContact O-N 3.35Å
664	K	90.6	Very high	89.4	Confident	118 Å²	118	57.4 Å²	57.4	51%	0.513	30%	0.304	S	S	.	.			trans	-120.8	144.2	174.5	-66	174.8	-173.1	158.7	0	110	C644 S660 E662	C644-K664 VanDerWaalsContact SG-C 3.52Å; C644-K664 PolarHBondContact SG-N 3.45Å; C644-K664 PolarHBondContact SG-O 2.94Å; S660-K664 PolarHBondContact N-O 2.99Å; S660-K664 PolarHBondContact OG-N 3.49Å; S660-K664 PolarHBondContact OG-O 2.03Å; E662-K664 VanDerWaalsContact C-N 3.27Å; E662-K664 HydrophobicContact CB-CD 4.31Å; E662-K664 HydrophobicContact CB-CG 4.38Å; E662-K664 PolarHBondContact O-N 3.19Å; E662-K664 IonicContact OE2-NZ 3.95Å; E662-K664 PolarHBondContact OE2-NZ 3.46Å
665	C	91.8	Very high	89.4	Confident	17 Å²	17	58.9 Å²	58.9	12%	0.115	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	125.8	173.8	-69.6	0	0	0	0	110.8	C644 P645 C653 C676	C644-C665 VanDerWaalsContact CB-SG 3.59Å; P645-C665 PolarHBondContact O-SG 3.09Å; C653-C665 WeakPolarHBondContact CA-SG 3.44Å; C653-C665 HydrophobicContact CB-CB 3.71Å; C653-C665 WeakPolarHBondContact CB-SG 3.35Å; C653-C665 WeakPolarHBondContact SG-CA 3.37Å; C653-C665 WeakPolarHBondContact SG-CB 3.4Å; C653-C665 CovalentContact SG-SG 2.04Å; C653-C665 PolarHBondContact SG-SG 3.23Å; C665-C676 VanDerWaalsContact CB-SG 3.51Å
666	I	91.4	Very high	89.5	Confident	59 Å²	59	53 Å²	53	30%	0.303	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	105.8	167.3	-51.4	-56.4	0	0	0	106.7	I477 V492 G657 T658	I477-I666 HydrophobicContact CD1-CG1 4.15Å; I477-I666 HydrophobicContact CG2-CB 4.44Å; I477-I666 HydrophobicContact CG2-CG1 4.43Å; I477-I666 HydrophobicContact CG2-CG2 4.09Å; V492-I666 HydrophobicContact CG2-CD1 4.41Å; V492-I666 HydrophobicContact CG2-CG1 4.47Å; G657-I666 CarbonylContact C-O 3.58Å; G657-I666 WeakPolarHBondContact CA-O 3.47Å; T658-I666 PolarHBondContact N-O 2.91Å; T658-I666 PolarHBondContact O-N 3.47Å
667	C	90.1	Very high	89.4	Confident	34 Å²	34	52.9 Å²	52.9	23%	0.23	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	151.8	-172.4	-54.3	0	0	0	0	112.7	H656 Y671 G673 C676	H656-C667 WeakPolarHBondContact O-CA 3.43Å; C667-Y671 VanDerWaalsContact CB-O 3.24Å; C667-Y671 WeakPolarHBondContact CB-O 3.37Å; C667-G673 PolarHBondContact SG-O 3.44Å; C667-C676 WeakPolarHBondContact CA-SG 3.24Å; C667-C676 HydrophobicContact CB-CB 3.76Å; C667-C676 WeakPolarHBondContact CB-SG 3.23Å; C667-C676 WeakPolarHBondContact SG-CA 3.37Å; C667-C676 WeakPolarHBondContact SG-CB 3.01Å; C667-C676 CovalentContact SG-SG 2.04Å; C667-C676 PolarHBondContact SG-SG 3.37Å
668	D	88.8	Confident	89.4	Confident	67 Å²	67	55.8 Å²	55.8	36%	0.358	31%	0.305	S	S	.	.			trans	-62.2	158	168.5	-66.6	-30.3	0	0	0	110.4	H656 D670 Y671	H656-D668 WeakPolarHBondContact CA-OD2 3.01Å; H656-D668 PolarHBondContact O-N 3.03Å; D668-D670 PolarHBondContact O-N 3.49Å; D668-Y671 HydrophobicContact CB-CD2 4.14Å; D668-Y671 PolarHBondContact O-N 2.92Å
669	P	83.6	Confident	89.3	Confident	71 Å²	71	60.1 Å²	60.1	46%	0.461	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-33.4	-169.4	-28.9	35.5	0	0	0	115.4	R464 I682	R464-P669 PolarHBondContact NH1-O 3.37Å; P669-I682 HydrophobicContact CB-CD1 3.75Å; P669-I682 VanDerWaalsContact O-CD1 3.29Å; P669-I682 WeakPolarHBondContact O-CD1 3.46Å; P669-I682 WeakPolarHBondContact O-CG1 3.28Å
670	D	87.5	Confident	88.9	Confident	70 Å²	70	63.6 Å²	63.6	37%	0.374	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	9.6	-177.9	-59.2	-42.2	0	0	0	113.9	D668 F679 D680 P681	D668-D670 PolarHBondContact O-N 3.49Å; D670-F679 HydrophobicContact CB-CD2 4.12Å; D670-F679 HydrophobicContact CB-CE2 3.59Å; D670-F679 HydrophobicContact CB-CZ 4.37Å; D670-F679 CarbonylContact O-C 3.59Å; D670-F679 WeakPolarHBondContact O-CA 3.26Å; D670-F679 VanDerWaalsContact O-CD2 3.32Å; D670-F679 WeakPolarHBondContact O-CD2 3.28Å; D670-D680 CarbonylContact C-O 3.5Å; D670-D680 CarbonylContact O-C 3.56Å; D670-D680 PolarHBondContact O-N 3.06Å; D670-P681 HydrophobicContact CB-CB 4.44Å
671	Y	89.4	Confident	88.5	Confident	54 Å²	54	66.5 Å²	66.5	21%	0.212	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	150.2	-176.5	-67.8	-93.7	0	0	0	112.2	H656 C667 D668 V678 F679	H656-Y671 HydrophobicContact CB-CD1 3.62Å; H656-Y671 HydrophobicContact CB-CD2 3.78Å; H656-Y671 HydrophobicContact CB-CE1 3.95Å; H656-Y671 HydrophobicContact CB-CE2 4.1Å; H656-Y671 HydrophobicContact CB-CG 3.52Å; H656-Y671 AromaticContact CD2-CD1 3.68Å; H656-Y671 AromaticContact CD2-CE1 3.26Å; H656-Y671 WeakPolarHBondContact CD2-CE1 3.41Å; H656-Y671 AromaticContact CD2-CZ 3.72Å; H656-Y671 AromaticContact CE1-CE1 3.74Å; H656-Y671 AromaticContact CE1-CZ 3.37Å; H656-Y671 PolarHBondContact CE1-OH 2.83Å; H656-Y671 AromaticContact CG-CD1 3.58Å; H656-Y671 AromaticContact CG-CD2 4Å; H656-Y671 AromaticContact CG-CE1 3.36Å; H656-Y671 AromaticContact CG-CE2 3.8Å; H656-Y671 AromaticContact CG-CG 3.89Å; H656-Y671 AromaticContact CG-CZ 3.48Å; H656-Y671 VanDerWaalsContact CG-CZ 3.48Å; H656-Y671 AromaticContact ND1-CE1 3.66Å; H656-Y671 AromaticContact ND1-CE2 3.52Å; H656-Y671 AromaticContact ND1-CZ 3.25Å; H656-Y671 VanDerWaalsContact ND1-CZ 3.25Å; H656-Y671 PolarHBondContact ND1-OH 3.06Å; H656-Y671 AromaticContact NE2-CE1 3.52Å; H656-Y671 AromaticContact NE2-CZ 3.66Å; C667-Y671 VanDerWaalsContact CB-O 3.24Å; C667-Y671 WeakPolarHBondContact CB-O 3.37Å; D668-Y671 HydrophobicContact CB-CD2 4.14Å; D668-Y671 PolarHBondContact O-N 2.92Å; Y671-V678 CarbonylContact C-O 3.55Å; Y671-V678 VanDerWaalsContact CA-O 3.3Å; Y671-V678 WeakPolarHBondContact CA-O 3.08Å; Y671-F679 HydrophobicContact CD1-CB 4.47Å; Y671-F679 HydrophobicContact CD1-CD2 4.39Å; Y671-F679 HydrophobicContact CE1-CB 4.23Å; Y671-F679 AromaticContact CE1-CD2 3.94Å; Y671-F679 HydrophobicContact CE1-CD2 3.94Å; Y671-F679 HydrophobicContact CE2-CD2 4.08Å; Y671-F679 HydrophobicContact CE2-CE2 4.44Å; Y671-F679 AromaticContact CZ-CD2 3.77Å
672	T	87.1	Confident	87.9	Confident	57 Å²	57	65.7 Å²	65.7	35%	0.35	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	178.1	-179.8	-166.7	0	0	0	0	111.6	C676 V678 D680	T672-C676 CarbonylContact O-C 3.53Å; T672-C676 WeakPolarHBondContact O-CA 3.31Å; T672-V678 HydrophobicContact CG2-CB 3.84Å; T672-V678 HydrophobicContact CG2-CG1 3.88Å; T672-V678 PolarHBondContact N-O 2.99Å; T672-V678 PolarHBondContact O-N 3.22Å; T672-D680 HydrophobicContact CG2-CB 3.67Å
673	G	86.5	Confident	87.2	Confident	35 Å²	35	67.1 Å²	67.1	36%	0.361	37%	0.369	S	S	.	.	S	Bend	trans	92.9	167.3	-175.3	0	0	0	0	0	113	C667 D675 C676	C667-G673 PolarHBondContact SG-O 3.44Å; G673-D675 PolarHBondContact O-N 3.06Å; G673-C676 PolarHBondContact O-N 3.18Å
674	K	88.1	Confident	86	Confident	194 Å²	194	70.6 Å²	70.6	84%	0.843	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-24.9	-175.3	-68	-174.9	178.5	-179.5	0	113.4	P645	P645-K674 VanDerWaalsContact CG-O 3.3Å; P645-K674 WeakPolarHBondContact CG-O 3.41Å
675	D	90.1	Very high	84.5	Confident	37 Å²	37	69.9 Å²	69.9	20%	0.198	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118	9.9	-177.2	69	-18.8	0	0	0	113	P645 C653 S654 G673 S677	P645-D675 HydrophobicContact CB-CB 4.14Å; P645-D675 HydrophobicContact CG-CB 4.34Å; C653-D675 CarbonylContact C-O 3.54Å; C653-D675 WeakPolarHBondContact CA-O 3.39Å; S654-D675 VanDerWaalsContact CB-O 3.28Å; S654-D675 WeakPolarHBondContact CB-O 3.43Å; S654-D675 PolarHBondContact N-O 3.37Å; S654-D675 PolarHBondContact OG-O 2.88Å; G673-D675 PolarHBondContact O-N 3.06Å; D675-S677 VanDerWaalsContact CG-OG 3.3Å; D675-S677 PolarHBondContact O-N 3.48Å; D675-S677 VanDerWaalsContact OD1-CB 3.32Å; D675-S677 WeakPolarHBondContact OD1-CB 3.44Å; D675-S677 PolarHBondContact OD1-N 2.76Å; D675-S677 PolarHBondContact OD1-OG 3.4Å; D675-S677 PolarHBondContact OD2-OG 3.06Å
676	C	91.9	Very high	82.4	Confident	0 Å²	0	75 Å²	75	0%	0	43%	0.429	C	S	.	.	S	Bend	trans	54.5	30.4	-177.2	-48.7	0	0	0	0	114.8	C653 H656 C665 C667 T672 G673	C653-C676 WeakPolarHBondContact O-CB 3.01Å; H656-C676 HydrophobicContact CB-CB 4.07Å; H656-C676 WeakPolarHBondContact CB-O 3.46Å; H656-C676 WeakPolarHBondContact O-CB 3.21Å; C665-C676 VanDerWaalsContact CB-SG 3.51Å; C667-C676 WeakPolarHBondContact CA-SG 3.24Å; C667-C676 HydrophobicContact CB-CB 3.76Å; C667-C676 WeakPolarHBondContact CB-SG 3.23Å; C667-C676 WeakPolarHBondContact SG-CA 3.37Å; C667-C676 WeakPolarHBondContact SG-CB 3.01Å; C667-C676 CovalentContact SG-SG 2.04Å; C667-C676 PolarHBondContact SG-SG 3.37Å; T672-C676 CarbonylContact O-C 3.53Å; T672-C676 WeakPolarHBondContact O-CA 3.31Å; G673-C676 PolarHBondContact O-N 3.18Å
677	S	90.8	Very high	80.1	Confident	59 Å²	59	77.6 Å²	77.6	41%	0.413	45%	0.45	S	S	.	.			trans	-84	-17.5	180	59.8	0	0	0	0	114.1	D675	D675-S677 VanDerWaalsContact CG-OG 3.3Å; D675-S677 PolarHBondContact O-N 3.48Å; D675-S677 VanDerWaalsContact OD1-CB 3.32Å; D675-S677 WeakPolarHBondContact OD1-CB 3.44Å; D675-S677 PolarHBondContact OD1-N 2.76Å; D675-S677 PolarHBondContact OD1-OG 3.4Å; D675-S677 PolarHBondContact OD2-OG 3.06Å
678	V	90.1	Very high	77.9	Confident	76 Å²	76	84.2 Å²	84.2	46%	0.461	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	118.3	-173.7	-177.2	0	0	0	0	109.6	Y671 T672 D680	Y671-V678 CarbonylContact C-O 3.55Å; Y671-V678 VanDerWaalsContact CA-O 3.3Å; Y671-V678 WeakPolarHBondContact CA-O 3.08Å; T672-V678 HydrophobicContact CG2-CB 3.84Å; T672-V678 HydrophobicContact CG2-CG1 3.88Å; T672-V678 PolarHBondContact N-O 2.99Å; T672-V678 PolarHBondContact O-N 3.22Å; V678-D680 PolarHBondContact O-N 3.05Å
679	F	89.5	Confident	75.5	Confident	127 Å²	127	89.6 Å²	89.6	56%	0.557	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.3	116.2	172.1	-174.8	-108.9	0	0	0	109.9	D670 Y671 P681	D670-F679 HydrophobicContact CB-CD2 4.12Å; D670-F679 HydrophobicContact CB-CE2 3.59Å; D670-F679 HydrophobicContact CB-CZ 4.37Å; D670-F679 CarbonylContact O-C 3.59Å; D670-F679 WeakPolarHBondContact O-CA 3.26Å; D670-F679 VanDerWaalsContact O-CD2 3.32Å; D670-F679 WeakPolarHBondContact O-CD2 3.28Å; Y671-F679 HydrophobicContact CD1-CB 4.47Å; Y671-F679 HydrophobicContact CD1-CD2 4.39Å; Y671-F679 HydrophobicContact CE1-CB 4.23Å; Y671-F679 AromaticContact CE1-CD2 3.94Å; Y671-F679 HydrophobicContact CE1-CD2 3.94Å; Y671-F679 HydrophobicContact CE2-CD2 4.08Å; Y671-F679 HydrophobicContact CE2-CE2 4.44Å; Y671-F679 AromaticContact CZ-CD2 3.77Å; F679-P681 HydrophobicContact CD1-CG 4.35Å; F679-P681 HydrophobicContact CE1-CB 4.14Å; F679-P681 HydrophobicContact CE1-CG 3.72Å; F679-P681 HydrophobicContact CZ-CB 3.94Å; F679-P681 HydrophobicContact CZ-CG 4.06Å
680	D	84.7	Confident	73.6	Confident	73 Å²	73	89 Å²	89	39%	0.39	51%	0.512	S	S	.	.			trans	-138.3	84.5	179	178	45.1	0	0	0	107.9	R464 D670 T672 V678	R464-D680 IonicContact CZ-OD2 2.76Å; R464-D680 PolarHBondContact NH2-O 3.4Å; R464-D680 IonicContact NH2-OD2 2.74Å; R464-D680 PolarHBondContact NH2-OD2 3.18Å; D670-D680 CarbonylContact C-O 3.5Å; D670-D680 CarbonylContact O-C 3.56Å; D670-D680 PolarHBondContact O-N 3.06Å; T672-D680 HydrophobicContact CG2-CB 3.67Å; V678-D680 PolarHBondContact O-N 3.05Å
681	P	82.6	Confident	71.4	Confident	62 Å²	62	91.8 Å²	91.8	40%	0.403	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-68.7	137.1	-175.9	27.7	-33.4	0	0	0	110.6	D670 F679 P683	D670-P681 HydrophobicContact CB-CB 4.44Å; F679-P681 HydrophobicContact CD1-CG 4.35Å; F679-P681 HydrophobicContact CE1-CB 4.14Å; F679-P681 HydrophobicContact CE1-CG 3.72Å; F679-P681 HydrophobicContact CZ-CB 3.94Å; F679-P681 HydrophobicContact CZ-CG 4.06Å; P681-P683 WeakPolarHBondContact O-CD 3.01Å
682	I	75.7	Confident	69	Low	43 Å²	43	97.5 Å²	97.5	22%	0.221	56%	0.562	C	S	.	*	P	Polyproline II helix	trans	-64.9	124.2	177.8	-62	152.2	0	0	0	108	R464 P669 T684	R464-I682 WeakPolarHBondContact O-CD1 3.02Å; P669-I682 HydrophobicContact CB-CD1 3.75Å; P669-I682 VanDerWaalsContact O-CD1 3.29Å; P669-I682 WeakPolarHBondContact O-CD1 3.46Å; P669-I682 WeakPolarHBondContact O-CG1 3.28Å; I682-T684 PolarHBondContact O-N 3.13Å; I682-T684 VanDerWaalsContact O-N 3.1Å
683	P	71.8	Confident	66.7	Low	106 Å²	106	104.3 Å²	104.3	69%	0.688	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-55.7	122.2	179.5	-24.4	32.6	0	0	0	110	P681	P681-P683 WeakPolarHBondContact O-CD 3.01Å
684	T	64.4	Low	64.4	Low	124 Å²	124	109.9 Å²	109.9	76%	0.761	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-62.7	129.2	172	29.2	0	0	0	0	107.7	I682 T686	I682-T684 PolarHBondContact O-N 3.13Å; I682-T684 VanDerWaalsContact O-N 3.1Å; T684-T686 PolarHBondContact O-N 3.19Å
685	P	57.8	Low	62	Low	102 Å²	102	110.6 Å²	110.6	66%	0.662	61%	0.612	S	S	*	*			trans	-62.2	105.7	173.6	22.4	-28.9	0	0	0	107.1
686	T	48.8	Very low	59.7	Low	125 Å²	125	110.9 Å²	110.9	77%	0.767	62%	0.623	S	S	*	*			trans	-52	124.9	166.9	24	0	0	0	0	106.5	T684 L688	T684-T686 PolarHBondContact O-N 3.19Å; T686-L688 PolarHBondContact O-N 3.04Å; T686-L688 VanDerWaalsContact O-N 3.07Å
687	P	43.6	Very low	57.2	Low	113 Å²	113	116.3 Å²	116.3	73%	0.734	66%	0.659	S	S	*	*			trans	-50.7	125.9	167.1	-17.2	27.9	0	0	0	105.8	E689	P687-E689 VanDerWaalsContact C-N 3.32Å; P687-E689 PolarHBondContact O-N 3.23Å
688	L	43.5	Very low	55	Low	173 Å²	173	116.8 Å²	116.8	91%	0.906	66%	0.662	S	S	*	*			trans	-47.6	107.2	168.3	-84.6	151.6	0	0	0	106	T686 G690	T686-L688 PolarHBondContact O-N 3.04Å; T686-L688 VanDerWaalsContact O-N 3.07Å; L688-G690 PolarHBondContact O-N 3.12Å
689	E	39	Very low	52.9	Low	181 Å²	181	115.4 Å²	115.4	85%	0.846	66%	0.663	S	S	*	*			trans	-50.6	135.8	161.6	-77.8	-170.6	147.3	0	0	105.6	P687	P687-E689 VanDerWaalsContact C-N 3.32Å; P687-E689 PolarHBondContact O-N 3.23Å
690	G	43.7	Very low	51.2	Low	59 Å²	59	113.1 Å²	113.1	61%	0.608	66%	0.659	S	S	*	*	S	Bend	trans	-47.1	161.2	-172.6	0	0	0	0	0	112.2	L688 E692	L688-G690 PolarHBondContact O-N 3.12Å; G690-E692 PolarHBondContact O-N 3.28Å
691	P	40.8	Very low	49.4	Very low	127 Å²	127	115 Å²	115	83%	0.825	67%	0.669	S	S	*	*			trans	-42	111.6	-156	24.6	-34.9	0	0	0	110.1	K693	P691-K693 VanDerWaalsContact C-N 3.31Å; P691-K693 PolarHBondContact O-N 3.01Å
692	E	38.6	Very low	48.1	Very low	175 Å²	175	117.6 Å²	117.6	82%	0.818	68%	0.679	S	S	*	*			trans	-49	111.9	160.7	-81.6	-162	149.3	0	0	104.5	G690 N694	G690-E692 PolarHBondContact O-N 3.28Å; E692-N694 PolarHBondContact O-N 2.93Å
693	K	37.9	Very low	47.3	Very low	199 Å²	199	120.7 Å²	120.7	87%	0.865	70%	0.695	S	S	*	*			trans	-52.6	103.4	164.3	-94.5	177	172.9	174.3	0	103.5	P691 K695	P691-K693 VanDerWaalsContact C-N 3.31Å; P691-K693 PolarHBondContact O-N 3.01Å; K693-K695 PolarHBondContact O-N 2.91Å
694	N	38.5	Very low	46.8	Very low	153 Å²	153	120.8 Å²	120.8	82%	0.818	69%	0.688	S	S	*	*			trans	-45	98.6	160.1	-74.5	-36.2	0	0	0	105.3	E692 G696	E692-N694 PolarHBondContact O-N 2.93Å; N694-G696 PolarHBondContact O-N 3.14Å
695	K	38.6	Very low	46.7	Very low	209 Å²	209	117.1 Å²	117.1	91%	0.909	68%	0.675	S	S	*	*			trans	-65.9	82.7	149.9	-87.4	-177.2	176.1	176.2	0	102.9	K693	K693-K695 PolarHBondContact O-N 2.91Å
696	G	40.8	Very low	47.1	Very low	43 Å²	43	115.8 Å²	115.8	44%	0.443	67%	0.669	S	S	.	*			trans	-50.7	152.8	165	0	0	0	0	0	107.9	N694 S698	N694-G696 PolarHBondContact O-N 3.14Å; G696-S698 PolarHBondContact O-N 2.77Å
697	P	40.3	Very low	48.3	Very low	114 Å²	114	113.6 Å²	113.6	74%	0.74	66%	0.655	S	S	*	*	S	Bend	trans	-51.1	118.4	174.5	22.6	-30.9	0	0	0	107.2	G699	P697-G699 PolarHBondContact O-N 2.03Å; P697-G699 VanDerWaalsContact O-N 3.12Å
698	S	44.9	Very low	49.7	Very low	69 Å²	69	110.8 Å²	110.8	48%	0.483	64%	0.641	S	S	.	*			trans	-45	121.7	-175.3	-169.7	0	0	0	0	109.2	G696 T700 N701	G696-S698 PolarHBondContact O-N 2.77Å; S698-T700 WeakPolarHBondContact CB-OG1 3.14Å; S698-T700 PolarHBondContact O-N 3.45Å; S698-T700 PolarHBondContact OG-OG1 2.79Å; S698-N701 PolarHBondContact O-N 3.29Å
699	G	45.4	Very low	51.1	Low	47 Å²	47	104.4 Å²	104.4	49%	0.485	62%	0.617	S	S	.	*	H	α-helix	trans	-54.4	-11.3	-179.9	0	0	0	0	0	113.9	P697 I703	P697-G699 PolarHBondContact O-N 2.03Å; P697-G699 VanDerWaalsContact O-N 3.12Å; G699-I703 WeakPolarHBondContact O-CD1 3.4Å; G699-I703 VanDerWaalsContact O-CG1 3.28Å; G699-I703 WeakPolarHBondContact O-CG1 3.35Å; G699-I703 PolarHBondContact O-N 2.92Å
700	T	52.9	Low	53.1	Low	78 Å²	78	98.8 Å²	98.8	48%	0.479	60%	0.601	S	S	.	*	H	α-helix	trans	-62.1	-34.9	168	18	0	0	0	0	114	S698 I703 I704	S698-T700 WeakPolarHBondContact CB-OG1 3.14Å; S698-T700 PolarHBondContact O-N 3.45Å; S698-T700 PolarHBondContact OG-OG1 2.79Å; T700-I703 PolarHBondContact O-N 2.98Å; T700-I704 WeakPolarHBondContact O-CB 3.48Å; T700-I704 VanDerWaalsContact O-CD1 3.31Å; T700-I704 WeakPolarHBondContact O-CD1 3.35Å; T700-I704 WeakPolarHBondContact O-CG1 3.19Å; T700-I704 PolarHBondContact O-N 3.18Å
701	N	48.2	Very low	54.8	Low	112 Å²	112	101.2 Å²	101.2	60%	0.599	60%	0.6	S	S	*	*	H	α-helix	trans	-75.3	-29.9	-176.5	-71.7	-8	0	0	0	113.1	S698 G705	S698-N701 PolarHBondContact O-N 3.29Å; N701-G705 PolarHBondContact O-N 2.92Å; N701-G705 VanDerWaalsContact O-N 3.09Å
702	I	55.9	Low	56.7	Low	117 Å²	117	100.8 Å²	100.8	60%	0.6	59%	0.59	S	S	*	*	H	α-helix	trans	-74.7	-38.1	175.2	-61.4	175.6	0	0	0	110.3	S706	I702-S706 WeakPolarHBondContact O-CB 3.37Å; I702-S706 PolarHBondContact O-N 3.15Å; I702-S706 PolarHBondContact O-OG 3.26Å
703	I	58.6	Low	58.6	Low	109 Å²	109	97.9 Å²	97.9	56%	0.559	58%	0.579	S	S	*	*	H	α-helix	trans	-67	-42.8	175.8	-62.3	166.8	0	0	0	110.5	G699 T700 G705 S706 V707	G699-I703 WeakPolarHBondContact O-CD1 3.4Å; G699-I703 VanDerWaalsContact O-CG1 3.28Å; G699-I703 WeakPolarHBondContact O-CG1 3.35Å; G699-I703 PolarHBondContact O-N 2.92Å; T700-I703 PolarHBondContact O-N 2.98Å; I703-G705 PolarHBondContact O-N 2.82Å; I703-S706 PolarHBondContact O-N 2.99Å; I703-V707 HydrophobicContact CG2-CG2 4.27Å; I703-V707 WeakPolarHBondContact O-CB 3.42Å; I703-V707 VanDerWaalsContact O-CG2 3.25Å; I703-V707 WeakPolarHBondContact O-CG2 3.42Å; I703-V707 PolarHBondContact O-N 2.93Å
704	I	60.3	Low	60.4	Low	107 Å²	107	90.7 Å²	90.7	55%	0.549	56%	0.557	S	S	.	*	H	α-helix	trans	-64.3	-42.2	177.9	-66.7	162.3	0	0	0	111.1	T700 S706 V707 A708	T700-I704 WeakPolarHBondContact O-CB 3.48Å; T700-I704 VanDerWaalsContact O-CD1 3.31Å; T700-I704 WeakPolarHBondContact O-CD1 3.35Å; T700-I704 WeakPolarHBondContact O-CG1 3.19Å; T700-I704 PolarHBondContact O-N 3.18Å; I704-S706 PolarHBondContact O-N 3.34Å; I704-V707 PolarHBondContact O-N 3.4Å; I704-A708 VanDerWaalsContact O-CB 3.24Å; I704-A708 WeakPolarHBondContact O-CB 3.49Å; I704-A708 PolarHBondContact O-N 3.29Å
705	G	61.6	Low	62.2	Low	47 Å²	47	86.2 Å²	86.2	49%	0.485	54%	0.541	S	S	.	.	H	α-helix	trans	-64.2	-38.4	175.8	0	0	0	0	0	113.3	N701 I703 G709	N701-G705 PolarHBondContact O-N 2.92Å; N701-G705 VanDerWaalsContact O-N 3.09Å; I703-G705 PolarHBondContact O-N 2.82Å; G705-G709 PolarHBondContact O-N 2.99Å
706	S	67.4	Low	64.1	Low	75 Å²	75	81.6 Å²	81.6	52%	0.524	53%	0.525	S	S	.	.	H	α-helix	trans	-69.6	-40.8	178.3	-52.5	0	0	0	0	112	I702 I703 I704 A710	I702-S706 WeakPolarHBondContact O-CB 3.37Å; I702-S706 PolarHBondContact O-N 3.15Å; I702-S706 PolarHBondContact O-OG 3.26Å; I703-S706 PolarHBondContact O-N 2.99Å; I704-S706 PolarHBondContact O-N 3.34Å; S706-A710 WeakPolarHBondContact O-CB 3.44Å; S706-A710 PolarHBondContact O-N 2.95Å
707	V	72.8	Confident	65.7	Low	78 Å²	78	84.4 Å²	84.4	47%	0.473	53%	0.529	S	S	.	.	H	α-helix	trans	-70.4	-42.5	177.3	173.6	0	0	0	0	110.9	I703 I704 G709 A710 I711	I703-V707 HydrophobicContact CG2-CG2 4.27Å; I703-V707 WeakPolarHBondContact O-CB 3.42Å; I703-V707 VanDerWaalsContact O-CG2 3.25Å; I703-V707 WeakPolarHBondContact O-CG2 3.42Å; I703-V707 PolarHBondContact O-N 2.93Å; I704-V707 PolarHBondContact O-N 3.4Å; V707-G709 VanDerWaalsContact C-N 3.34Å; V707-G709 PolarHBondContact O-N 2.02Å; V707-A710 PolarHBondContact O-N 3.49Å; V707-I711 HydrophobicContact CG1-CD1 3.78Å; V707-I711 HydrophobicContact CG1-CG1 4.45Å; V707-I711 VanDerWaalsContact O-CG1 3.24Å; V707-I711 WeakPolarHBondContact O-CG1 3.5Å; V707-I711 PolarHBondContact O-N 3.21Å
708	A	73.6	Confident	67	Low	54 Å²	54	85 Å²	85	45%	0.446	53%	0.525	S	S	.	.	H	α-helix	trans	-62.6	-41.2	174.9	0	0	0	0	0	111.8	I704 I711 L712	I704-A708 VanDerWaalsContact O-CB 3.24Å; I704-A708 WeakPolarHBondContact O-CB 3.49Å; I704-A708 PolarHBondContact O-N 3.29Å; A708-I711 PolarHBondContact O-N 3.5Å; A708-L712 WeakPolarHBondContact O-CB 3.43Å; A708-L712 PolarHBondContact O-N 3.22Å
709	G	74.1	Confident	68	Low	39 Å²	39	83.9 Å²	83.9	40%	0.402	53%	0.525	S	S	.	.	H	α-helix	trans	-63.1	-42.9	174.9	0	0	0	0	0	113.1	G705 V707 L712 L713	G705-G709 PolarHBondContact O-N 2.99Å; V707-G709 VanDerWaalsContact C-N 3.34Å; V707-G709 PolarHBondContact O-N 2.02Å; G709-L712 PolarHBondContact O-N 2.82Å; G709-L713 PolarHBondContact O-N 3.11Å
710	A	79.1	Confident	68.8	Low	63 Å²	63	84 Å²	84	52%	0.521	53%	0.526	S	S	.	.	H	α-helix	trans	-66.5	-39.3	177.4	0	0	0	0	0	112.6	S706 V707 L713 A714	S706-A710 WeakPolarHBondContact O-CB 3.44Å; S706-A710 PolarHBondContact O-N 2.95Å; V707-A710 PolarHBondContact O-N 3.49Å; A710-L713 PolarHBondContact O-N 3.26Å; A710-A714 WeakPolarHBondContact O-CB 3.36Å; A710-A714 PolarHBondContact O-N 2.93Å
711	I	80.9	Confident	69.1	Low	111 Å²	111	84.6 Å²	84.6	57%	0.569	53%	0.53	S	S	*	.	H	α-helix	trans	-65.5	-41.8	175.7	-67.4	166.7	0	0	0	110.7	V707 A708 L713 A714 A715	V707-I711 HydrophobicContact CG1-CD1 3.78Å; V707-I711 HydrophobicContact CG1-CG1 4.45Å; V707-I711 VanDerWaalsContact O-CG1 3.24Å; V707-I711 WeakPolarHBondContact O-CG1 3.5Å; V707-I711 PolarHBondContact O-N 3.21Å; A708-I711 PolarHBondContact O-N 3.5Å; I711-L713 VanDerWaalsContact C-N 3.35Å; I711-L713 PolarHBondContact O-N 2.99Å; I711-A714 PolarHBondContact O-N 2.94Å; I711-A715 WeakPolarHBondContact O-CB 3.36Å; I711-A715 PolarHBondContact O-N 3.46Å
712	L	79.6	Confident	69.5	Low	118 Å²	118	81.9 Å²	81.9	62%	0.618	53%	0.529	S	S	*	.	H	α-helix	trans	-64.5	-40.8	178.6	-144.8	107.3	0	0	0	111.6	A708 G709 A715 I716	A708-L712 WeakPolarHBondContact O-CB 3.43Å; A708-L712 PolarHBondContact O-N 3.22Å; G709-L712 PolarHBondContact O-N 2.82Å; L712-A715 PolarHBondContact O-N 2.85Å; L712-I716 HydrophobicContact CD2-CD1 4.23Å; L712-I716 VanDerWaalsContact O-CG1 3.31Å; L712-I716 WeakPolarHBondContact O-CG1 3.25Å; L712-I716 PolarHBondContact O-N 2.84Å
713	L	78.4	Confident	69.3	Low	114 Å²	114	87.3 Å²	87.3	60%	0.597	54%	0.541	S	S	*	.	H	α-helix	trans	-66.2	-42.4	177.5	-139.3	111.5	0	0	0	111.5	G709 A710 I711 A715 I716 I717	G709-L713 PolarHBondContact O-N 3.11Å; A710-L713 PolarHBondContact O-N 3.26Å; I711-L713 VanDerWaalsContact C-N 3.35Å; I711-L713 PolarHBondContact O-N 2.99Å; L713-A715 VanDerWaalsContact C-N 3.35Å; L713-A715 PolarHBondContact O-N 2.85Å; L713-I716 PolarHBondContact O-N 3.29Å; L713-I717 HydrophobicContact CD2-CD1 4.09Å; L713-I717 VanDerWaalsContact O-CG1 3.29Å; L713-I717 WeakPolarHBondContact O-CG1 3.22Å; L713-I717 PolarHBondContact O-N 2.87Å
714	A	76.9	Confident	68.9	Low	48 Å²	48	84.8 Å²	84.8	40%	0.397	54%	0.543	S	S	.	.	H	α-helix	trans	-63.5	-39.5	174.9	0	0	0	0	0	112.1	A710 I711 I717 L718	A710-A714 WeakPolarHBondContact O-CB 3.36Å; A710-A714 PolarHBondContact O-N 2.93Å; I711-A714 PolarHBondContact O-N 2.94Å; A714-I717 PolarHBondContact O-N 3.01Å; A714-L718 WeakPolarHBondContact O-CB 3.11Å; A714-L718 WeakPolarHBondContact O-CG 3.44Å; A714-L718 PolarHBondContact O-N 3.04Å
715	A	76.3	Confident	68.4	Low	58 Å²	58	89 Å²	89	48%	0.479	56%	0.558	S	S	.	*	H	α-helix	trans	-65.1	-37.8	176.3	0	0	0	0	0	112.5	I711 L712 L713 G719	I711-A715 WeakPolarHBondContact O-CB 3.36Å; I711-A715 PolarHBondContact O-N 3.46Å; L712-A715 PolarHBondContact O-N 2.85Å; L713-A715 VanDerWaalsContact C-N 3.35Å; L713-A715 PolarHBondContact O-N 2.85Å; A715-G719 PolarHBondContact O-N 2.9Å
716	I	77.3	Confident	67.8	Low	112 Å²	112	95.5 Å²	95.5	57%	0.574	57%	0.572	S	S	*	*	H	α-helix	trans	-68.2	-41.5	175.5	-67.9	166.1	0	0	0	110.9	L712 L713 G719 G720	L712-I716 HydrophobicContact CD2-CD1 4.23Å; L712-I716 VanDerWaalsContact O-CG1 3.31Å; L712-I716 WeakPolarHBondContact O-CG1 3.25Å; L712-I716 PolarHBondContact O-N 2.84Å; L713-I716 PolarHBondContact O-N 3.29Å; I716-G719 PolarHBondContact O-N 2.82Å; I716-G720 PolarHBondContact O-N 3.45Å
717	I	74.3	Confident	67	Low	102 Å²	102	99.4 Å²	99.4	52%	0.523	59%	0.587	S	S	.	*	H	α-helix	trans	-66.8	-42	178.6	-67.1	168.4	0	0	0	111	L713 A714 T721	L713-I717 HydrophobicContact CD2-CD1 4.09Å; L713-I717 VanDerWaalsContact O-CG1 3.29Å; L713-I717 WeakPolarHBondContact O-CG1 3.22Å; L713-I717 PolarHBondContact O-N 2.87Å; A714-I717 PolarHBondContact O-N 3.01Å; I717-T721 WeakPolarHBondContact O-CG2 3.44Å; I717-T721 PolarHBondContact O-N 3.04Å; I717-T721 VanDerWaalsContact O-N 3.11Å; I717-T721 PolarHBondContact O-OG1 2.72Å
718	L	69.5	Low	65.8	Low	126 Å²	126	103.3 Å²	103.3	66%	0.66	60%	0.604	S	S	*	*	H	α-helix	trans	-70.8	-37.8	176.1	-70.6	168.6	0	0	0	112.2	A714 T721 G722	A714-L718 WeakPolarHBondContact O-CB 3.11Å; A714-L718 WeakPolarHBondContact O-CG 3.44Å; A714-L718 PolarHBondContact O-N 3.04Å; L718-T721 PolarHBondContact O-OG1 3.02Å; L718-G722 PolarHBondContact O-N 3.23Å; L718-G722 VanDerWaalsContact O-N 3.09Å
719	G	64.6	Low	64.4	Low	47 Å²	47	112.2 Å²	112.2	49%	0.485	63%	0.626	S	S	.	*	H	α-helix	trans	-66.8	-39.7	174.8	0	0	0	0	0	113.1	A715 I716 G722 W723	A715-G719 PolarHBondContact O-N 2.9Å; I716-G719 PolarHBondContact O-N 2.82Å; G719-G722 PolarHBondContact O-N 2.99Å; G719-W723 PolarHBondContact O-N 3.43Å
720	G	62.4	Low	62.8	Low	50 Å²	50	120.2 Å²	120.2	52%	0.515	65%	0.649	S	S	.	*	H	α-helix	trans	-69.3	-37	177.5	0	0	0	0	0	113.4	I716 G724	I716-G720 PolarHBondContact O-N 3.45Å; G720-G724 PolarHBondContact O-N 3.05Å
721	T	59.5	Low	60.8	Low	89 Å²	89	120.7 Å²	120.7	55%	0.546	66%	0.661	S	S	.	*	H	α-helix	trans	-76.7	-24.6	176.5	50.6	0	0	0	0	113.1	I717 L718	I717-T721 WeakPolarHBondContact O-CG2 3.44Å; I717-T721 PolarHBondContact O-N 3.04Å; I717-T721 VanDerWaalsContact O-N 3.11Å; I717-T721 PolarHBondContact O-OG1 2.72Å; L718-T721 PolarHBondContact O-OG1 3.02Å
722	G	56.4	Low	58.9	Low	56 Å²	56	127.3 Å²	127.3	58%	0.577	68%	0.679	S	S	*	*	H	α-helix	trans	-74.5	-27.6	172.3	0	0	0	0	0	114.8	L718 G719	L718-G722 PolarHBondContact O-N 3.23Å; L718-G722 VanDerWaalsContact O-N 3.09Å; G719-G722 PolarHBondContact O-N 2.99Å
723	W	51.8	Low	56.9	Low	230 Å²	230	126.7 Å²	126.7	87%	0.871	69%	0.685	S	S	*	*	H	α-helix	trans	-87.2	-20.9	-179.2	-144.9	30	0	0	0	113.5	G719 F725	G719-W723 PolarHBondContact O-N 3.43Å; W723-F725 VanDerWaalsContact C-N 3.31Å; W723-F725 PolarHBondContact O-N 3.46Å
724	G	50.1	Low	55	Low	57 Å²	57	126.4 Å²	126.4	59%	0.588	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	-11.8	177.6	0	0	0	0	0	115.9	G720	G720-G724 PolarHBondContact O-N 3.05Å
725	F	49.5	Very low	53.2	Low	196 Å²	196	127.5 Å²	127.5	86%	0.86	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	0.1	-176.5	-106.6	-83	0	0	0	115.5	W723	W723-F725 VanDerWaalsContact C-N 3.31Å; W723-F725 PolarHBondContact O-N 3.46Å
726	K	49.6	Very low	51.3	Low	183 Å²	183	135.4 Å²	135.4	80%	0.796	75%	0.75	S	S	*	*	S	Bend	trans	-110.7	-2	-175.1	-149.8	172.7	-179.9	179.5	0	116.4
727	N	49.8	Very low	50	Low	157 Å²	157	136.6 Å²	136.6	84%	0.84	76%	0.758	S	S	*	*			trans	-126.2	51.4	-176.5	-94.2	-3	0	0	0	114.7
728	I	48.6	Very low	48.7	Very low	159 Å²	159	138.4 Å²	138.4	82%	0.815	77%	0.771	S	S	*	*			trans	-125.7	85.8	159.1	-60.2	176.1	0	0	0	108.5
729	R	42.8	Very low	47.6	Very low	242 Å²	242	139.1 Å²	139.1	91%	0.913	78%	0.777	S	S	*	*			trans	-170.9	104.1	148.6	-110.5	175.4	-177.2	-179.8	2.2	111.6
730	K	40.6	Very low	46.6	Very low	206 Å²	206	144.5 Å²	144.5	90%	0.896	79%	0.794	S	S	*	*			trans	141.7	97.8	134.3	-84.1	179.6	170.7	178.4	0	110.9
731	G	38.4	Very low	45.6	Very low	74 Å²	74	150.4 Å²	150.4	76%	0.763	81%	0.812	S	S	*	*			trans	-88.2	143.8	147.9	0	0	0	0	0	109.6
732	R	40.4	Very low	44.7	Very low	249 Å²	249	154.5 Å²	154.5	94%	0.94	83%	0.829	S	S	*	*				174.9	142.7	128.5	-112.8	-180	164.9	157.3	-4.1	111.9
733	S	37.7	Very low	43.8	Very low	106 Å²	106	161.6 Å²	161.6	74%	0.741	85%	0.847	S	S	*	*			trans	77.5	141	144.3	172.6	0	0	0	0	116.9
734	S	37.7	Very low	43.2	Very low	108 Å²	108	156.3 Å²	156.3	76%	0.755	85%	0.845	S	S	*	*			cis	-178.6	154.3	-10.1	-72.4	0	0	0	0	104.9
735	G	39.9	Very low	42.6	Very low	70 Å²	70	164.6 Å²	164.6	72%	0.722	87%	0.867	S	S	*	*			trans	100.9	113.8	133.7	0	0	0	0	0	119.3
736	V	36.7	Very low	42	Very low	225 Å²	225	161.7 Å²	161.7	100%	1.364	87%	0.868	S	S	*	*			trans	75.2	0	156.8	-165.5	0	0	0	0	117.4

Retrieved 736 of 736 residues in 859.9 ms (Link to these results)

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