A0A5K4FGS0_SCHMA Loading...

RRM domain-containing protein

AlphaFold DB (A0A5K4FE91), UniProt , Accession A0A5K4FGS0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 621 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	M	34.2	Very low	33.5	Very low	243 Å²	243	147.3 Å²	147.3	100%	1.197	84%	0.836	S	S	*	*				0	113.5	0	-106.4	176.9	151.1	0	0	106.1
2	C	32.1	Very low	33.3	Very low	130 Å²	130	148.8 Å²	148.8	88%	0.878	84%	0.839	S	S	*	*			trans	60.7	100	178.9	-55.5	0	0	0	0	117
3	D	32.4	Very low	33	Very low	166 Å²	166	146.9 Å²	146.9	89%	0.888	83%	0.832	S	S	*	*			trans	-113.7	153	147.1	-92.5	-38.7	0	0	0	109
4	P	38.5	Very low	32.5	Very low	115 Å²	115	147.3 Å²	147.3	75%	0.747	83%	0.831	S	S	*	*			trans	-111.2	121	-159.7	34	-18.5	0	0	0	112.2
5	E	37.3	Very low	32.7	Very low	194 Å²	194	144.3 Å²	144.3	91%	0.907	82%	0.817	S	S	*	*			trans	-133.2	118.7	166.6	-76.5	-171.2	162	0	0	111.6
6	N	32.7	Very low	32.5	Very low	138 Å²	138	139.8 Å²	139.8	74%	0.738	81%	0.812	S	S	*	*			trans	79.3	97.6	148.4	-114.8	-4.4	0	0	0	120.8	S8	N6-S8 PolarHBondContact O-N 3.37Å
7	P	34.5	Very low	32.2	Very low	132 Å²	132	138.1 Å²	138.1	86%	0.857	81%	0.809	S	S	*	*			trans	-87.1	83.7	160.2	34.4	-25.7	0	0	0	109.1
8	S	30.9	Very low	32.2	Very low	84 Å²	84	137.3 Å²	137.3	59%	0.587	80%	0.8	S	S	*	*			trans	-131	67.3	166.9	68.4	0	0	0	0	109.9	N6	N6-S8 PolarHBondContact O-N 3.37Å
9	D	32.2	Very low	32.1	Very low	152 Å²	152	138 Å²	138	81%	0.813	80%	0.8	S	S	*	*			trans	-153.1	68.7	160.1	-97.1	-25.2	0	0	0	108	S11	D9-S11 PolarHBondContact O-N 3.39Å
10	N	32.5	Very low	32.5	Very low	169 Å²	169	139 Å²	139	90%	0.904	80%	0.802	S	S	*	*			trans	-70	76.1	156.6	-81.5	-18.3	0	0	0	107	L12	N10-L12 PolarHBondContact O-N 3.13Å
11	S	31.4	Very low	33	Very low	97 Å²	97	135.4 Å²	135.4	68%	0.678	78%	0.783	S	S	*	*			trans	-44.2	125.1	161.3	50.9	0	0	0	0	108.2	D9 V13	D9-S11 PolarHBondContact O-N 3.39Å; S11-V13 PolarHBondContact O-N 3.22Å
12	L	30.5	Very low	33.5	Very low	166 Å²	166	128.2 Å²	128.2	87%	0.869	75%	0.754	S	S	*	*			trans	-44.6	118.1	168.7	-92.1	97.9	0	0	0	107.4	N10 N14	N10-L12 PolarHBondContact O-N 3.13Å; L12-N14 VanDerWaalsContact C-N 3.28Å; L12-N14 PolarHBondContact O-N 3.45Å
13	V	30.1	Very low	34.2	Very low	124 Å²	124	127 Å²	127	75%	0.752	74%	0.742	S	S	*	*			trans	-58.6	100.7	171.3	174.4	0	0	0	0	106	S11 T15	S11-V13 PolarHBondContact O-N 3.22Å; V13-T15 VanDerWaalsContact C-N 3.32Å; V13-T15 PolarHBondContact O-N 3.44Å
14	N	25.4	Very low	35.3	Very low	152 Å²	152	122.5 Å²	122.5	81%	0.813	74%	0.735	S	S	*	*			trans	-66.1	94.6	177.7	-149.7	-8.2	0	0	0	106	L12 G16	L12-N14 VanDerWaalsContact C-N 3.28Å; L12-N14 PolarHBondContact O-N 3.45Å; N14-G16 PolarHBondContact O-N 3.03Å
15	T	35	Very low	36.7	Very low	103 Å²	103	122.7 Å²	122.7	63%	0.632	73%	0.73	S	S	*	*			trans	-63.9	90.9	170.6	27.4	0	0	0	0	107.2	V13 C17	V13-T15 VanDerWaalsContact C-N 3.32Å; V13-T15 PolarHBondContact O-N 3.44Å; T15-C17 VanDerWaalsContact C-N 3.32Å; T15-C17 PolarHBondContact O-N 3.41Å
16	G	29.6	Very low	38.8	Very low	71 Å²	71	114.2 Å²	114.2	73%	0.732	69%	0.691	S	S	*	*	S	Bend	trans	-65.2	87.7	179.6	0	0	0	0	0	111.1	N14	N14-G16 PolarHBondContact O-N 3.03Å
17	C	28.8	Very low	41.4	Very low	112 Å²	112	110 Å²	110	76%	0.757	67%	0.67	S	S	*	*			trans	-177.9	63.1	152.4	-95.6	0	0	0	0	109	T15	T15-C17 VanDerWaalsContact C-N 3.32Å; T15-C17 PolarHBondContact O-N 3.41Å
18	L	31.7	Very low	44	Very low	124 Å²	124	104.2 Å²	104.2	65%	0.649	63%	0.632	S	S	*	*			trans	-119.6	61.9	167.2	-73.3	173.4	0	0	0	109.2
19	N	30.5	Very low	46.9	Very low	150 Å²	150	104.3 Å²	104.3	80%	0.802	63%	0.626	S	S	*	*			trans	-115.2	107.2	175	-72.2	-9	0	0	0	109.8
20	N	38.9	Very low	49.7	Very low	158 Å²	158	100.9 Å²	100.9	85%	0.845	60%	0.602	S	S	*	*	S	Bend	trans	111.4	8.6	151.1	-57.4	-10.4	0	0	0	121.1
21	T	42.7	Very low	52.6	Low	64 Å²	64	92.9 Å²	92.9	39%	0.393	56%	0.559	S	S	.	*	S	Bend	trans	-95.8	119.4	161.8	-37.9	0	0	0	0	109	V23	T21-V23 PolarHBondContact O-N 3.45Å; T21-V23 VanDerWaalsContact O-N 3.13Å
22	P	44.6	Very low	55.6	Low	92 Å²	92	88.2 Å²	88.2	60%	0.597	53%	0.527	S	S	*	.			trans	-57.9	123.1	177.6	20.8	-29.2	0	0	0	109.7	G24 N25	P22-G24 PolarHBondContact O-N 3.43Å; P22-N25 PolarHBondContact O-N 3.09Å
23	V	48.3	Very low	58.6	Low	104 Å²	104	84.8 Å²	84.8	63%	0.63	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-8.7	-166.9	-176.3	0	0	0	0	113.8	T21 A75	T21-V23 PolarHBondContact O-N 3.45Å; T21-V23 VanDerWaalsContact O-N 3.13Å; V23-A75 HydrophobicContact CG1-CB 3.72Å
24	G	54.2	Low	61.7	Low	72 Å²	72	79.8 Å²	79.8	74%	0.742	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-3.4	-175.7	0	0	0	0	0	117.5	P22	P22-G24 PolarHBondContact O-N 3.43Å
25	N	68.8	Low	65.1	Low	119 Å²	119	72.5 Å²	72.5	64%	0.636	44%	0.438	S	S	*	.			trans	-121.4	12.1	-168.2	-78.9	-3.1	0	0	0	116	P22 T27	P22-N25 PolarHBondContact O-N 3.09Å; N25-T27 PolarHBondContact O-N 3.42Å
26	I	80.5	Confident	68	Low	16 Å²	16	69.1 Å²	69.1	8%	0.082	42%	0.415	C	S	.	.			trans	-78.2	97	177.3	-56.5	165.4	0	0	0	107.8	Y30 I31 Q69 L76	I26-Y30 HydrophobicContact CG2-CD1 4.43Å; I26-I31 HydrophobicContact CG2-CD1 4.26Å; I26-I31 HydrophobicContact CG2-CG1 4.27Å; I26-Q69 HydrophobicContact CD1-CB 4Å; I26-Q69 HydrophobicContact CD1-CG 4.39Å; I26-L76 HydrophobicContact CB-CD1 3.85Å; I26-L76 HydrophobicContact CD1-CD1 4.32Å; I26-L76 HydrophobicContact CG2-CD1 4.07Å; I26-L76 HydrophobicContact CG2-CD2 3.99Å
27	T	87.3	Confident	71	Confident	48 Å²	48	74.1 Å²	74.1	29%	0.294	41%	0.412	S	S	.	.			trans	-109.2	161.5	175.5	56.7	0	0	0	0	109.8	N25 N29 Y30 I31	N25-T27 PolarHBondContact O-N 3.42Å; T27-N29 PolarHBondContact O-N 3.01Å; T27-Y30 WeakPolarHBondContact O-CB 3.43Å; T27-Y30 PolarHBondContact O-N 2.82Å; T27-Y30 PolarHBondContact OG1-N 3.44Å; T27-I31 WeakPolarHBondContact O-CG1 3.09Å; T27-I31 PolarHBondContact O-N 3.12Å
28	L	90.5	Very high	74.1	Confident	11 Å²	11	69.8 Å²	69.8	6%	0.058	38%	0.381	C	S	.	.	H	α-helix	trans	-51.8	-41.6	171	175.1	58.9	0	0	0	111.7	Y30 I31 M32 L131 Y135 F136 D216	L28-Y30 PolarHBondContact O-N 2.84Å; L28-I31 WeakPolarHBondContact O-CB 3.07Å; L28-I31 PolarHBondContact O-N 3.25Å; L28-M32 HydrophobicContact CD1-CG 3.96Å; L28-M32 HydrophobicContact CD1-SD 4Å; L28-M32 HydrophobicContact CD2-SD 4.38Å; L28-M32 HydrophobicContact CG-CG 4.31Å; L28-M32 HydrophobicContact CG-SD 3.87Å; L28-M32 WeakPolarHBondContact O-CG 3.42Å; L28-M32 PolarHBondContact O-N 2.95Å; L28-L131 HydrophobicContact CD1-CD1 3.68Å; L28-Y135 HydrophobicContact CB-CD1 4.08Å; L28-Y135 HydrophobicContact CB-CE1 4.47Å; L28-Y135 HydrophobicContact CD1-CD1 3.74Å; L28-Y135 HydrophobicContact CD1-CG 4.03Å; L28-Y135 HydrophobicContact CG-CD1 4.33Å; L28-F136 HydrophobicContact CD1-CE2 4.37Å; L28-F136 HydrophobicContact CD1-CZ 4.29Å; L28-F136 HydrophobicContact CD2-CE1 4.32Å; L28-F136 HydrophobicContact CD2-CZ 4.12Å; L28-D216 HydrophobicContact CD2-CB 3.41Å; L28-D216 VanDerWaalsContact CD2-CB 3.41Å
29	N	90.8	Very high	77	Confident	86 Å²	86	65.8 Å²	65.8	46%	0.46	36%	0.357	S	S	.	.	H	α-helix	trans	-61.2	-43.4	178.3	-169.8	54.4	0	0	0	112	T27 I31 M32 E33	T27-N29 PolarHBondContact O-N 3.01Å; N29-I31 VanDerWaalsContact C-N 3.33Å; N29-I31 PolarHBondContact O-N 3.34Å; N29-M32 PolarHBondContact O-N 2.97Å; N29-E33 WeakPolarHBondContact O-CB 3.3Å; N29-E33 VanDerWaalsContact O-CG 3.31Å; N29-E33 WeakPolarHBondContact O-CG 3.27Å; N29-E33 PolarHBondContact O-N 3.43Å
30	Y	91.7	Very high	79.8	Confident	81 Å²	81	63.8 Å²	63.8	32%	0.318	34%	0.343	S	S	.	.	H	α-helix	trans	-60.7	-41.8	174.7	170.6	-95.5	0	0	0	112.3	I26 T27 L28 S34	I26-Y30 HydrophobicContact CG2-CD1 4.43Å; T27-Y30 WeakPolarHBondContact O-CB 3.43Å; T27-Y30 PolarHBondContact O-N 2.82Å; T27-Y30 PolarHBondContact OG1-N 3.44Å; L28-Y30 PolarHBondContact O-N 2.84Å; Y30-S34 WeakPolarHBondContact O-CB 3.37Å; Y30-S34 PolarHBondContact O-N 2.92Å; Y30-S34 PolarHBondContact O-OG 2.81Å
31	I	93.5	Very high	82.2	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-62.4	-49	177.6	-63.3	163.7	0	0	0	109.9	I26 T27 L28 N29 S34 I35 L66 A70 L131 Y135	I26-I31 HydrophobicContact CG2-CD1 4.26Å; I26-I31 HydrophobicContact CG2-CG1 4.27Å; T27-I31 WeakPolarHBondContact O-CG1 3.09Å; T27-I31 PolarHBondContact O-N 3.12Å; L28-I31 WeakPolarHBondContact O-CB 3.07Å; L28-I31 PolarHBondContact O-N 3.25Å; N29-I31 VanDerWaalsContact C-N 3.33Å; N29-I31 PolarHBondContact O-N 3.34Å; I31-S34 WeakPolarHBondContact O-CB 3.47Å; I31-S34 PolarHBondContact O-N 3.49Å; I31-I35 HydrophobicContact CG2-CD1 4.11Å; I31-I35 WeakPolarHBondContact O-CG1 3.38Å; I31-I35 PolarHBondContact O-N 3.01Å; I31-L66 HydrophobicContact CG2-CD1 4.32Å; I31-A70 HydrophobicContact CD1-CB 3.61Å; I31-A70 HydrophobicContact CG1-CB 4.07Å; I31-L131 HydrophobicContact CG2-CD1 4.14Å; I31-Y135 HydrophobicContact CD1-CE1 3.89Å; I31-Y135 HydrophobicContact CD1-CE2 4.49Å
32	M	94.4	Very high	84.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-61.6	-46.4	179.4	-68.9	177.4	75.5	0	0	112.3	L28 N29 S34 I35 I36 F136 V221 L607 L608	L28-M32 HydrophobicContact CD1-CG 3.96Å; L28-M32 HydrophobicContact CD1-SD 4Å; L28-M32 HydrophobicContact CD2-SD 4.38Å; L28-M32 HydrophobicContact CG-CG 4.31Å; L28-M32 HydrophobicContact CG-SD 3.87Å; L28-M32 WeakPolarHBondContact O-CG 3.42Å; L28-M32 PolarHBondContact O-N 2.95Å; N29-M32 PolarHBondContact O-N 2.97Å; M32-S34 VanDerWaalsContact C-N 3.31Å; M32-S34 PolarHBondContact O-N 3.38Å; M32-I35 WeakPolarHBondContact O-CB 3.25Å; M32-I35 PolarHBondContact O-N 3.25Å; M32-I36 WeakPolarHBondContact O-CG1 3.36Å; M32-I36 PolarHBondContact O-N 2.86Å; M32-F136 HydrophobicContact SD-CZ 4.29Å; M32-V221 HydrophobicContact CE-CG1 3.9Å; M32-V221 HydrophobicContact SD-CG1 4.13Å; M32-L607 HydrophobicContact CE-CB 4.45Å; M32-L607 WeakPolarHBondContact CE-O 3.46Å; M32-L608 HydrophobicContact CB-CD2 3.83Å; M32-L608 HydrophobicContact CE-CD2 3.76Å; M32-L608 HydrophobicContact CG-CD2 3.87Å
33	E	93.6	Very high	86.1	Confident	94 Å²	94	58 Å²	58	44%	0.439	31%	0.31	S	S	.	.	H	α-helix	trans	-63.3	-37.4	177.1	-71.9	-59.6	140.4	0	0	112.1	N29 I35 I36 R37	N29-E33 WeakPolarHBondContact O-CB 3.3Å; N29-E33 VanDerWaalsContact O-CG 3.31Å; N29-E33 WeakPolarHBondContact O-CG 3.27Å; N29-E33 PolarHBondContact O-N 3.43Å; E33-I35 VanDerWaalsContact C-N 3.33Å; E33-I35 PolarHBondContact O-N 3.4Å; E33-I36 PolarHBondContact O-N 3.15Å; E33-R37 VanDerWaalsContact O-CB 3.3Å; E33-R37 WeakPolarHBondContact O-CB 3.25Å; E33-R37 PolarHBondContact O-N 3.11Å
34	S	95.4	Very high	87.5	Confident	18 Å²	18	60.2 Å²	60.2	13%	0.126	31%	0.313	C	S	.	.	H	α-helix	trans	-62	-41.9	174.8	-61.4	0	0	0	0	111.5	Y30 I31 M32 Q38 F62	Y30-S34 WeakPolarHBondContact O-CB 3.37Å; Y30-S34 PolarHBondContact O-N 2.92Å; Y30-S34 PolarHBondContact O-OG 2.81Å; I31-S34 WeakPolarHBondContact O-CB 3.47Å; I31-S34 PolarHBondContact O-N 3.49Å; M32-S34 VanDerWaalsContact C-N 3.31Å; M32-S34 PolarHBondContact O-N 3.38Å; S34-Q38 WeakPolarHBondContact O-CB 3.38Å; S34-Q38 PolarHBondContact O-N 2.6Å; S34-F62 WeakPolarHBondContact O-CZ 3.18Å
35	I	96.2	Very high	88.3	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63.9	-49.7	176	-68.3	170.5	0	0	0	111	I31 M32 E33 R37 Q38 R39 W63 L66 V127 Y128 L131 L608	I31-I35 HydrophobicContact CG2-CD1 4.11Å; I31-I35 WeakPolarHBondContact O-CG1 3.38Å; I31-I35 PolarHBondContact O-N 3.01Å; M32-I35 WeakPolarHBondContact O-CB 3.25Å; M32-I35 PolarHBondContact O-N 3.25Å; E33-I35 VanDerWaalsContact C-N 3.33Å; E33-I35 PolarHBondContact O-N 3.4Å; I35-R37 VanDerWaalsContact C-N 3.31Å; I35-R37 PolarHBondContact O-N 2.79Å; I35-Q38 PolarHBondContact O-N 3.4Å; I35-R39 WeakPolarHBondContact O-CG 3.33Å; I35-R39 PolarHBondContact O-N 2.91Å; I35-W63 HydrophobicContact CG1-CH2 4.34Å; I35-W63 HydrophobicContact CG1-CZ3 3.96Å; I35-W63 HydrophobicContact CG2-CH2 4.19Å; I35-L66 HydrophobicContact CD1-CD2 4.45Å; I35-L66 HydrophobicContact CG1-CD2 3.76Å; I35-V127 HydrophobicContact CD1-CG1 4.21Å; I35-Y128 HydrophobicContact CG2-CE1 3.85Å; I35-L131 HydrophobicContact CD1-CD2 3.69Å; I35-L608 HydrophobicContact CG2-CD1 3.72Å; I35-L608 HydrophobicContact CG2-CD2 4.5Å
36	I	95	Very high	87.9	Confident	32 Å²	32	61 Å²	61	16%	0.164	30%	0.299	C	S	.	.	H	α-helix	trans	-58.3	-47.3	-179.6	-68.7	165.1	0	0	0	109.9	M32 E33 Q38 R39 Q40 L608	M32-I36 WeakPolarHBondContact O-CG1 3.36Å; M32-I36 PolarHBondContact O-N 2.86Å; E33-I36 PolarHBondContact O-N 3.15Å; I36-Q38 PolarHBondContact O-N 3.14Å; I36-R39 PolarHBondContact O-N 3.28Å; I36-Q40 WeakPolarHBondContact O-CG 3.25Å; I36-Q40 PolarHBondContact O-N 2.93Å; I36-L608 HydrophobicContact CD1-CB 4.44Å; I36-L608 HydrophobicContact CD1-CD2 4.46Å; I36-L608 HydrophobicContact CG1-CB 4.26Å; I36-L608 HydrophobicContact CG1-CD2 4.31Å
37	R	94.3	Very high	86.8	Confident	175 Å²	175	63 Å²	63	66%	0.66	31%	0.314	S	S	*	.	H	α-helix	trans	-60.4	-44.2	177.9	-174.7	179.4	178.7	-170.9	-0.7	112	E33 I35 Q40 L41	E33-R37 VanDerWaalsContact O-CB 3.3Å; E33-R37 WeakPolarHBondContact O-CB 3.25Å; E33-R37 PolarHBondContact O-N 3.11Å; I35-R37 VanDerWaalsContact C-N 3.31Å; I35-R37 PolarHBondContact O-N 2.79Å; R37-Q40 PolarHBondContact O-N 2.97Å; R37-L41 HydrophobicContact CG-CD1 4.4Å; R37-L41 WeakPolarHBondContact O-CG 3.35Å; R37-L41 PolarHBondContact O-N 3.47Å
38	Q	93.6	Very high	85.3	Confident	22 Å²	22	71.1 Å²	71.1	10%	0.103	34%	0.344	C	S	.	.	H	α-helix	trans	-63.9	-42.8	177.9	-175.9	65.7	9.9	0	0	111.7	S34 I35 I36 Q40 L41 C42 F62 W63	S34-Q38 WeakPolarHBondContact O-CB 3.38Å; S34-Q38 PolarHBondContact O-N 2.6Å; I35-Q38 PolarHBondContact O-N 3.4Å; I36-Q38 PolarHBondContact O-N 3.14Å; Q38-Q40 VanDerWaalsContact C-N 3.32Å; Q38-Q40 PolarHBondContact O-N 2.71Å; Q38-L41 PolarHBondContact O-N 2.88Å; Q38-C42 PolarHBondContact O-N 3.11Å; Q38-C42 PolarHBondContact O-SG 2.82Å; Q38-C42 VanDerWaalsContact O-SG 3.36Å; Q38-F62 HydrophobicContact CB-CD1 4.04Å; Q38-F62 HydrophobicContact CB-CE1 3.44Å; Q38-F62 VanDerWaalsContact CB-CE1 3.44Å; Q38-F62 HydrophobicContact CB-CE2 4.28Å; Q38-F62 HydrophobicContact CB-CZ 3.58Å; Q38-F62 HydrophobicContact CG-CD1 3.51Å; Q38-F62 HydrophobicContact CG-CE1 3.44Å; Q38-F62 VanDerWaalsContact CG-CE1 3.44Å; Q38-F62 HydrophobicContact CG-CG 4.18Å; Q38-F62 HydrophobicContact CG-CZ 4.04Å; Q38-W63 HydrophobicContact CB-CZ2 4.48Å; Q38-W63 HydrophobicContact CG-CZ2 3.95Å
39	R	91.8	Very high	83.2	Confident	40 Å²	40	79.2 Å²	79.2	15%	0.151	38%	0.379	C	S	.	.	H	α-helix	trans	-60.7	-40.6	176.4	-74.6	-179.3	170.8	-169.2	-2.6	112.3	I35 I36 C42 T43 Y128 E609	I35-R39 WeakPolarHBondContact O-CG 3.33Å; I35-R39 PolarHBondContact O-N 2.91Å; I36-R39 PolarHBondContact O-N 3.28Å; R39-C42 PolarHBondContact O-N 3.44Å; R39-T43 WeakPolarHBondContact O-CB 3.43Å; R39-T43 PolarHBondContact O-N 3.47Å; R39-T43 PolarHBondContact O-OG1 3.09Å; R39-Y128 PolarHBondContact NE-OH 2.84Å; R39-Y128 PolarHBondContact NH2-OH 2.82Å; R39-E609 IonicContact NH1-OE1 2.62Å
40	Q	90.2	Very high	81.6	Confident	108 Å²	108	80.3 Å²	80.3	51%	0.505	39%	0.394	S	S	.	.	H	α-helix	trans	-63.1	-48.1	174.8	-72.2	170.5	-8.5	0	0	111.4	I36 R37 Q38 C42 T43 E44	I36-Q40 WeakPolarHBondContact O-CG 3.25Å; I36-Q40 PolarHBondContact O-N 2.93Å; R37-Q40 PolarHBondContact O-N 2.97Å; Q38-Q40 VanDerWaalsContact C-N 3.32Å; Q38-Q40 PolarHBondContact O-N 2.71Å; Q40-C42 VanDerWaalsContact C-N 3.32Å; Q40-C42 PolarHBondContact O-N 3.46Å; Q40-T43 PolarHBondContact O-N 3.43Å; Q40-E44 WeakPolarHBondContact O-CG 3.36Å; Q40-E44 PolarHBondContact O-N 3.21Å
41	L	88.4	Confident	80.1	Confident	66 Å²	66	83.3 Å²	83.3	35%	0.346	41%	0.409	S	S	.	.	H	α-helix	trans	-58.5	-42	176.5	-70.9	173	0	0	0	112	R37 Q38 T43 E44 N45	R37-L41 HydrophobicContact CG-CD1 4.4Å; R37-L41 WeakPolarHBondContact O-CG 3.35Å; R37-L41 PolarHBondContact O-N 3.47Å; Q38-L41 PolarHBondContact O-N 2.88Å; L41-T43 VanDerWaalsContact C-N 3.32Å; L41-T43 PolarHBondContact O-N 3.21Å; L41-E44 PolarHBondContact O-N 3.2Å; L41-N45 WeakPolarHBondContact O-CB 3.48Å; L41-N45 VanDerWaalsContact O-CG 3.25Å; L41-N45 PolarHBondContact O-N 2.71Å; L41-N45 PolarHBondContact O-ND2 3.05Å
42	C	85.6	Confident	79.2	Confident	32 Å²	32	87.6 Å²	87.6	22%	0.216	43%	0.431	C	S	.	.	H	α-helix	trans	-66.2	-34.5	176.2	-68.7	0	0	0	0	112.7	Q38 R39 Q40 I46	Q38-C42 PolarHBondContact O-N 3.11Å; Q38-C42 PolarHBondContact O-SG 2.82Å; Q38-C42 VanDerWaalsContact O-SG 3.36Å; R39-C42 PolarHBondContact O-N 3.44Å; Q40-C42 VanDerWaalsContact C-N 3.32Å; Q40-C42 PolarHBondContact O-N 3.46Å; C42-I46 PolarHBondContact O-N 3.3Å
43	T	83.4	Confident	78.5	Confident	93 Å²	93	92.2 Å²	92.2	57%	0.571	46%	0.459	S	S	*	.	H	α-helix	trans	-72.2	-39.4	177.8	-55.6	0	0	0	0	111.8	R39 Q40 L41 I46	R39-T43 WeakPolarHBondContact O-CB 3.43Å; R39-T43 PolarHBondContact O-N 3.47Å; R39-T43 PolarHBondContact O-OG1 3.09Å; Q40-T43 PolarHBondContact O-N 3.43Å; L41-T43 VanDerWaalsContact C-N 3.32Å; L41-T43 PolarHBondContact O-N 3.21Å; T43-I46 HydrophobicContact CG2-CD1 4.27Å; T43-I46 WeakPolarHBondContact O-CD1 3.4Å; T43-I46 WeakPolarHBondContact O-CG1 3.42Å
44	E	78.7	Confident	77.9	Confident	152 Å²	152	92 Å²	92	71%	0.71	47%	0.465	S	S	*	.	H	α-helix	trans	-70.7	-35.6	174.9	-70	177.3	-179	0	0	112	Q40 L41 I46	Q40-E44 WeakPolarHBondContact O-CG 3.36Å; Q40-E44 PolarHBondContact O-N 3.21Å; L41-E44 PolarHBondContact O-N 3.2Å; E44-I46 VanDerWaalsContact C-N 3.31Å; E44-I46 PolarHBondContact O-N 2.92Å
45	N	69.9	Low	77.2	Confident	87 Å²	87	93.8 Å²	93.8	47%	0.465	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	12.4	-180	-68.9	-52.7	0	0	0	114.1	L41 P47 F55	L41-N45 WeakPolarHBondContact O-CB 3.48Å; L41-N45 VanDerWaalsContact O-CG 3.25Å; L41-N45 PolarHBondContact O-N 2.71Å; L41-N45 PolarHBondContact O-ND2 3.05Å; N45-P47 WeakPolarHBondContact O-CA 3.49Å; N45-P47 WeakPolarHBondContact O-CD 3.02Å; N45-P47 WeakPolarHBondContact O-CG 3.06Å; N45-F55 HydrophobicContact CB-CE2 4.33Å
46	I	61.1	Low	76.5	Confident	120 Å²	120	97.2 Å²	97.2	62%	0.615	49%	0.488	S	S	*	.			trans	-48	106.6	174.3	-69.1	166.2	0	0	0	107.9	C42 T43 E44 K48	C42-I46 PolarHBondContact O-N 3.3Å; T43-I46 HydrophobicContact CG2-CD1 4.27Å; T43-I46 WeakPolarHBondContact O-CD1 3.4Å; T43-I46 WeakPolarHBondContact O-CG1 3.42Å; E44-I46 VanDerWaalsContact C-N 3.31Å; E44-I46 PolarHBondContact O-N 2.92Å; I46-K48 PolarHBondContact O-N 2.89Å
47	P	56.8	Low	76	Confident	59 Å²	59	100.5 Å²	100.5	38%	0.383	51%	0.506	S	S	.	.			trans	-70.8	119.2	-163.8	-19.2	30.7	0	0	0	109	N45 K49	N45-P47 WeakPolarHBondContact O-CA 3.49Å; N45-P47 WeakPolarHBondContact O-CD 3.02Å; N45-P47 WeakPolarHBondContact O-CG 3.06Å; P47-K49 WeakPolarHBondContact CB-O 3.46Å; P47-K49 PolarHBondContact O-N 3.37Å
48	K	56	Low	75.6	Confident	217 Å²	217	96 Å²	96	94%	0.943	50%	0.501	S	S	*	.	S	Bend	trans	-60.3	-1.4	161.6	-75.4	-177.5	177.6	174.3	0	112.6	I46	I46-K48 PolarHBondContact O-N 2.89Å
49	K	47.3	Very low	75.4	Confident	182 Å²	182	96.4 Å²	96.4	79%	0.791	50%	0.503	S	S	*	.	S	Bend	trans	-154.4	128.1	172.3	-90	171.1	-178.9	177.4	0	109.9	P47	P47-K49 WeakPolarHBondContact CB-O 3.46Å; P47-K49 PolarHBondContact O-N 3.37Å
50	S	56.9	Low	75.3	Confident	109 Å²	109	97 Å²	97	76%	0.762	51%	0.509	S	S	*	.			trans	19.1	121.9	163.5	58.3	0	0	0	0	118.8	D52	S50-D52 PolarHBondContact O-N 3.02Å
51	F	59.3	Low	75.4	Confident	143 Å²	143	95.2 Å²	95.2	63%	0.627	50%	0.503	S	S	*	.			trans	-41.3	111.2	168.9	-85.7	-96.4	0	0	0	112	F55 I56	F51-F55 HydrophobicContact CD1-CD1 4.18Å; F51-F55 HydrophobicContact CE1-CD1 4.29Å; F51-F55 HydrophobicContact CE1-CE1 4.21Å; F51-I56 HydrophobicContact CB-CD1 4.35Å; F51-I56 HydrophobicContact CD1-CD1 4.38Å; F51-I56 HydrophobicContact CD1-CG1 4.06Å
52	D	75.9	Confident	75.8	Confident	90 Å²	90	94.5 Å²	94.5	48%	0.481	50%	0.497	S	S	.	.			trans	-76.7	139.4	170.5	-172.7	-1	0	0	0	109.2	S50 T54 F55 I56	S50-D52 PolarHBondContact O-N 3.02Å; D52-T54 PolarHBondContact O-N 3.32Å; D52-T54 PolarHBondContact OD1-N 3.23Å; D52-T54 PolarHBondContact OD2-OG1 3.36Å; D52-F55 WeakPolarHBondContact O-CB 3.41Å; D52-F55 PolarHBondContact O-N 3.18Å; D52-I56 PolarHBondContact O-N 3.41Å
53	V	78.9	Confident	76.3	Confident	97 Å²	97	93 Å²	93	59%	0.588	49%	0.487	S	S	*	.	H	α-helix	trans	-56.2	-32.6	175.7	177.7	0	0	0	0	110.7	F55 I56 N57	V53-F55 VanDerWaalsContact C-N 3.34Å; V53-F55 PolarHBondContact O-N 2.87Å; V53-I56 PolarHBondContact O-N 3.18Å; V53-N57 PolarHBondContact O-N 3.33Å; V53-N57 PolarHBondContact O-ND2 2.69Å
54	T	81.4	Confident	76.9	Confident	91 Å²	91	90.5 Å²	90.5	56%	0.558	47%	0.468	S	S	*	.	H	α-helix	trans	-60.9	-41.4	176	65.4	0	0	0	0	112.4	D52 S58	D52-T54 PolarHBondContact O-N 3.32Å; D52-T54 PolarHBondContact OD1-N 3.23Å; D52-T54 PolarHBondContact OD2-OG1 3.36Å; T54-S58 WeakPolarHBondContact O-CB 3.43Å; T54-S58 PolarHBondContact O-N 2.82Å
55	F	81.1	Confident	77.7	Confident	55 Å²	55	85.8 Å²	85.8	24%	0.241	45%	0.448	C	S	.	.	H	α-helix	trans	-66.7	-45.7	178.2	179.4	-93.6	0	0	0	111.2	N45 F51 D52 V53 N57 S58 H59	N45-F55 HydrophobicContact CB-CE2 4.33Å; F51-F55 HydrophobicContact CD1-CD1 4.18Å; F51-F55 HydrophobicContact CE1-CD1 4.29Å; F51-F55 HydrophobicContact CE1-CE1 4.21Å; D52-F55 WeakPolarHBondContact O-CB 3.41Å; D52-F55 PolarHBondContact O-N 3.18Å; V53-F55 VanDerWaalsContact C-N 3.34Å; V53-F55 PolarHBondContact O-N 2.87Å; F55-N57 VanDerWaalsContact C-N 3.33Å; F55-N57 PolarHBondContact O-N 3.45Å; F55-S58 PolarHBondContact O-N 2.87Å; F55-H59 WeakPolarHBondContact O-CB 3.49Å; F55-H59 PolarHBondContact O-N 2.81Å
56	I	81	Confident	78.9	Confident	72 Å²	72	81.9 Å²	81.9	37%	0.369	43%	0.427	S	S	.	.	H	α-helix	trans	-59.5	-46.1	178.5	-62	172.6	0	0	0	110.5	F51 D52 V53 H59 N60	F51-I56 HydrophobicContact CB-CD1 4.35Å; F51-I56 HydrophobicContact CD1-CD1 4.38Å; F51-I56 HydrophobicContact CD1-CG1 4.06Å; D52-I56 PolarHBondContact O-N 3.41Å; V53-I56 PolarHBondContact O-N 3.18Å; I56-H59 PolarHBondContact O-N 3.29Å; I56-N60 PolarHBondContact O-N 3.13Å
57	N	84.3	Confident	80.6	Confident	101 Å²	101	76.2 Å²	76.2	54%	0.54	40%	0.398	S	S	.	.	H	α-helix	trans	-63.8	-42.4	177.9	-73	-17.7	0	0	0	111.9	V53 F55 N61	V53-N57 PolarHBondContact O-N 3.33Å; V53-N57 PolarHBondContact O-ND2 2.69Å; F55-N57 VanDerWaalsContact C-N 3.33Å; F55-N57 PolarHBondContact O-N 3.45Å; N57-N61 WeakPolarHBondContact O-CB 3.48Å; N57-N61 PolarHBondContact O-N 3.49Å
58	S	87	Confident	82.4	Confident	79 Å²	79	74.9 Å²	74.9	55%	0.552	39%	0.389	S	S	*	.	H	α-helix	trans	-64	-39.8	176.6	-173.4	0	0	0	0	112.2	T54 F55 F62	T54-S58 WeakPolarHBondContact O-CB 3.43Å; T54-S58 PolarHBondContact O-N 2.82Å; F55-S58 PolarHBondContact O-N 2.87Å; S58-F62 PolarHBondContact O-N 3.45Å
59	H	88	Confident	84.1	Confident	31 Å²	31	66.5 Å²	66.5	14%	0.144	35%	0.353	C	S	.	.	H	α-helix	trans	-64.1	-52	178.5	-173.4	82.3	0	0	0	111	F55 I56 N61 F62 W63 E124	F55-H59 WeakPolarHBondContact O-CB 3.49Å; F55-H59 PolarHBondContact O-N 2.81Å; I56-H59 PolarHBondContact O-N 3.29Å; H59-N61 VanDerWaalsContact C-N 3.31Å; H59-N61 PolarHBondContact O-N 3.43Å; H59-F62 WeakPolarHBondContact O-CB 3.49Å; H59-F62 PolarHBondContact O-N 2.9Å; H59-W63 AromaticContact CD2-CD1 3.58Å; H59-W63 AromaticContact CD2-NE1 3.55Å; H59-W63 AromaticContact CE1-CD1 3.88Å; H59-W63 AromaticContact CE1-NE1 3.04Å; H59-W63 PolarHBondContact CE1-NE1 3.4Å; H59-W63 AromaticContact CG-CD1 3.98Å; H59-W63 AromaticContact CG-NE1 3.84Å; H59-W63 AromaticContact ND1-NE1 3.54Å; H59-W63 AromaticContact NE2-CD1 3.52Å; H59-W63 AromaticContact NE2-NE1 3.02Å; H59-W63 PolarHBondContact NE2-NE1 2.9Å; H59-W63 PolarHBondContact O-N 3.38Å; H59-E124 IonicContact CE1-OE2 2.74Å; H59-E124 PolarHBondContact CE1-OE2 3.03Å; H59-E124 VanDerWaalsContact CE1-OE2 3.27Å; H59-E124 IonicContact NE2-OE2 2.78Å; H59-E124 PolarHBondContact NE2-OE2 2.94Å
60	N	89.9	Confident	86.3	Confident	54 Å²	54	57.8 Å²	57.8	29%	0.289	32%	0.315	S	S	.	.	H	α-helix	trans	-62.2	-38.7	178	-74.2	-16	0	0	0	112.2	I56 W63 F64	I56-N60 PolarHBondContact O-N 3.13Å; N60-W63 PolarHBondContact O-N 3.16Å; N60-F64 VanDerWaalsContact O-CB 3.3Å; N60-F64 WeakPolarHBondContact O-CB 3.33Å; N60-F64 PolarHBondContact O-N 2.71Å
61	N	93.5	Very high	88	Confident	69 Å²	69	52.7 Å²	52.7	37%	0.369	28%	0.279	S	S	.	.	H	α-helix	trans	-63.1	-42.1	177.2	-167.5	-78.7	0	0	0	111.8	N57 H59 N65	N57-N61 WeakPolarHBondContact O-CB 3.48Å; N57-N61 PolarHBondContact O-N 3.49Å; H59-N61 VanDerWaalsContact C-N 3.31Å; H59-N61 PolarHBondContact O-N 3.43Å; N61-N65 WeakPolarHBondContact O-CB 3.05Å; N61-N65 PolarHBondContact O-N 2.87Å; N61-N65 PolarHBondContact O-ND2 3.46Å; N61-N65 VanDerWaalsContact O-ND2 3.13Å; N61-N65 PolarHBondContact OD1-ND2 3.3Å
62	F	95.5	Very high	89.6	Confident	51 Å²	51	48.1 Å²	48.1	22%	0.224	26%	0.261	C	S	.	.	H	α-helix	trans	-57.6	-53.4	175.2	168.8	-92.7	0	0	0	111.7	S34 Q38 S58 H59 F64 N65 L66	S34-F62 WeakPolarHBondContact O-CZ 3.18Å; Q38-F62 HydrophobicContact CB-CD1 4.04Å; Q38-F62 HydrophobicContact CB-CE1 3.44Å; Q38-F62 VanDerWaalsContact CB-CE1 3.44Å; Q38-F62 HydrophobicContact CB-CE2 4.28Å; Q38-F62 HydrophobicContact CB-CZ 3.58Å; Q38-F62 HydrophobicContact CG-CD1 3.51Å; Q38-F62 HydrophobicContact CG-CE1 3.44Å; Q38-F62 VanDerWaalsContact CG-CE1 3.44Å; Q38-F62 HydrophobicContact CG-CG 4.18Å; Q38-F62 HydrophobicContact CG-CZ 4.04Å; S58-F62 PolarHBondContact O-N 3.45Å; H59-F62 WeakPolarHBondContact O-CB 3.49Å; H59-F62 PolarHBondContact O-N 2.9Å; F62-F64 PolarHBondContact O-N 3.39Å; F62-N65 PolarHBondContact O-N 3.06Å; F62-L66 HydrophobicContact CE1-CD2 4.04Å; F62-L66 HydrophobicContact CZ-CD2 3.99Å; F62-L66 WeakPolarHBondContact O-CB 3.28Å; F62-L66 PolarHBondContact O-N 3.39Å
63	W	96.7	Very high	90.2	Very high	1 Å²	1	44.9 Å²	44.9	0%	0.004	25%	0.245	C	C	.	.	H	α-helix	trans	-65.8	-40.3	-176.5	-67.5	112.9	0	0	0	112.6	I35 Q38 H59 N60 L66 F67 W123 E124 V127 Y128	I35-W63 HydrophobicContact CG1-CH2 4.34Å; I35-W63 HydrophobicContact CG1-CZ3 3.96Å; I35-W63 HydrophobicContact CG2-CH2 4.19Å; Q38-W63 HydrophobicContact CB-CZ2 4.48Å; Q38-W63 HydrophobicContact CG-CZ2 3.95Å; H59-W63 AromaticContact CD2-CD1 3.58Å; H59-W63 AromaticContact CD2-NE1 3.55Å; H59-W63 AromaticContact CE1-CD1 3.88Å; H59-W63 AromaticContact CE1-NE1 3.04Å; H59-W63 PolarHBondContact CE1-NE1 3.4Å; H59-W63 AromaticContact CG-CD1 3.98Å; H59-W63 AromaticContact CG-NE1 3.84Å; H59-W63 AromaticContact ND1-NE1 3.54Å; H59-W63 AromaticContact NE2-CD1 3.52Å; H59-W63 AromaticContact NE2-NE1 3.02Å; H59-W63 PolarHBondContact NE2-NE1 2.9Å; H59-W63 PolarHBondContact O-N 3.38Å; N60-W63 PolarHBondContact O-N 3.16Å; W63-L66 HydrophobicContact CE3-CD2 4.2Å; W63-L66 HydrophobicContact CZ3-CD2 4.17Å; W63-L66 PolarHBondContact O-N 3.35Å; W63-F67 WeakPolarHBondContact O-CB 3.34Å; W63-F67 PolarHBondContact O-N 3.4Å; W63-W123 HydrophobicContact CB-CB 3.58Å; W63-E124 HydrophobicContact CD2-CB 3.91Å; W63-E124 HydrophobicContact CD2-CG 4.14Å; W63-E124 HydrophobicContact CG-CB 4Å; W63-E124 HydrophobicContact CH2-CG 4.12Å; W63-E124 HydrophobicContact CZ2-CB 4.3Å; W63-E124 HydrophobicContact CZ2-CG 3.67Å; W63-V127 HydrophobicContact CE3-CB 3.94Å; W63-V127 HydrophobicContact CE3-CG1 4.07Å; W63-V127 HydrophobicContact CE3-CG2 4.1Å; W63-V127 HydrophobicContact CZ3-CB 4.29Å; W63-V127 HydrophobicContact CZ3-CG1 4.04Å; W63-Y128 AromaticContact CH2-CE1 3.67Å; W63-Y128 HydrophobicContact CH2-CE1 3.67Å; W63-Y128 AromaticContact CH2-CZ 3.68Å; W63-Y128 VanDerWaalsContact CH2-OH 3.29Å; W63-Y128 WeakPolarHBondContact CH2-OH 3.31Å; W63-Y128 AromaticContact CZ3-CE1 3.86Å; W63-Y128 HydrophobicContact CZ3-CE1 3.86Å
64	F	96.3	Very high	90.5	Very high	40 Å²	40	44.9 Å²	44.9	18%	0.175	25%	0.247	C	C	.	.	H	α-helix	trans	-61.5	-43.4	174	176.5	-96.9	0	0	0	112.4	N60 F62 F67 T68 L116 W123	N60-F64 VanDerWaalsContact O-CB 3.3Å; N60-F64 WeakPolarHBondContact O-CB 3.33Å; N60-F64 PolarHBondContact O-N 2.71Å; F62-F64 PolarHBondContact O-N 3.39Å; F64-F67 WeakPolarHBondContact O-CB 3.39Å; F64-F67 PolarHBondContact O-N 3.14Å; F64-T68 PolarHBondContact O-N 3.47Å; F64-T68 PolarHBondContact O-OG1 3.33Å; F64-L116 HydrophobicContact CB-CD1 3.76Å; F64-L116 HydrophobicContact CD1-CB 3.86Å; F64-L116 HydrophobicContact CD1-CD1 4.28Å; F64-L116 HydrophobicContact CD1-CD2 4.15Å; F64-L116 HydrophobicContact CD1-CG 4.32Å; F64-L116 HydrophobicContact CD2-CB 3.98Å; F64-L116 HydrophobicContact CD2-CD1 4.41Å; F64-L116 HydrophobicContact CE1-CB 3.9Å; F64-L116 HydrophobicContact CE2-CB 4.03Å; F64-L116 HydrophobicContact CG-CB 3.9Å; F64-L116 HydrophobicContact CG-CD1 3.88Å; F64-L116 HydrophobicContact CG-CG 4.32Å; F64-L116 HydrophobicContact CZ-CB 3.99Å; F64-W123 HydrophobicContact CB-CD2 4.15Å; F64-W123 HydrophobicContact CB-CE3 4.48Å; F64-W123 HydrophobicContact CB-CG 4.29Å; F64-W123 AromaticContact CD2-CD2 3.92Å; F64-W123 HydrophobicContact CD2-CD2 3.92Å; F64-W123 AromaticContact CD2-CE2 3.69Å; F64-W123 AromaticContact CD2-CE3 3.93Å; F64-W123 HydrophobicContact CD2-CE3 3.93Å; F64-W123 AromaticContact CD2-CH2 3.53Å; F64-W123 HydrophobicContact CD2-CH2 3.53Å; F64-W123 AromaticContact CD2-CZ2 3.51Å; F64-W123 HydrophobicContact CD2-CZ2 3.51Å; F64-W123 AromaticContact CD2-CZ3 3.74Å; F64-W123 HydrophobicContact CD2-CZ3 3.74Å; F64-W123 AromaticContact CE2-CH2 3.72Å; F64-W123 HydrophobicContact CE2-CH2 3.72Å; F64-W123 AromaticContact CE2-CZ2 3.9Å; F64-W123 HydrophobicContact CE2-CZ2 3.9Å; F64-W123 HydrophobicContact CE2-CZ3 4.22Å
65	N	95.3	Very high	90.4	Very high	53 Å²	53	43 Å²	43	28%	0.283	24%	0.241	S	C	.	.	H	α-helix	trans	-65.7	-42.4	177.3	-69.1	-20.9	0	0	0	111.3	N61 F62 F67 T68 Q69	N61-N65 WeakPolarHBondContact O-CB 3.05Å; N61-N65 PolarHBondContact O-N 2.87Å; N61-N65 PolarHBondContact O-ND2 3.46Å; N61-N65 VanDerWaalsContact O-ND2 3.13Å; N61-N65 PolarHBondContact OD1-ND2 3.3Å; F62-N65 PolarHBondContact O-N 3.06Å; N65-F67 VanDerWaalsContact C-N 3.34Å; N65-T68 PolarHBondContact O-N 3.49Å; N65-Q69 WeakPolarHBondContact O-CB 3.35Å; N65-Q69 VanDerWaalsContact O-CG 3.29Å; N65-Q69 WeakPolarHBondContact O-CG 3.39Å; N65-Q69 PolarHBondContact O-N 3.06Å
66	L	95.8	Very high	90.5	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.026	23%	0.231	C	C	.	.	H	α-helix	trans	-62.4	-43.2	175.9	-177.1	60.5	0	0	0	110.8	I31 I35 F62 W63 T68 Q69 A70 V127	I31-L66 HydrophobicContact CG2-CD1 4.32Å; I35-L66 HydrophobicContact CD1-CD2 4.45Å; I35-L66 HydrophobicContact CG1-CD2 3.76Å; F62-L66 HydrophobicContact CE1-CD2 4.04Å; F62-L66 HydrophobicContact CZ-CD2 3.99Å; F62-L66 WeakPolarHBondContact O-CB 3.28Å; F62-L66 PolarHBondContact O-N 3.39Å; W63-L66 HydrophobicContact CE3-CD2 4.2Å; W63-L66 HydrophobicContact CZ3-CD2 4.17Å; W63-L66 PolarHBondContact O-N 3.35Å; L66-T68 PolarHBondContact O-N 2.91Å; L66-Q69 PolarHBondContact O-N 3.16Å; L66-A70 VanDerWaalsContact O-CB 3.23Å; L66-A70 WeakPolarHBondContact O-CB 3.29Å; L66-A70 PolarHBondContact O-N 3.26Å; L66-V127 HydrophobicContact CD2-CG1 4.07Å; L66-V127 HydrophobicContact CG-CG1 4.48Å
67	F	96	Very high	90.3	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.009	23%	0.234	C	C	.	.	H	α-helix	trans	-57.7	-49.1	174.5	179.6	-93.7	0	0	0	111.6	W63 F64 N65 Q69 A70 F71 L72 L88 F90 W123 T126 V127	W63-F67 WeakPolarHBondContact O-CB 3.34Å; W63-F67 PolarHBondContact O-N 3.4Å; F64-F67 WeakPolarHBondContact O-CB 3.39Å; F64-F67 PolarHBondContact O-N 3.14Å; N65-F67 VanDerWaalsContact C-N 3.34Å; F67-Q69 VanDerWaalsContact C-N 3.32Å; F67-Q69 PolarHBondContact O-N 2.99Å; F67-A70 PolarHBondContact O-N 2.95Å; F67-F71 HydrophobicContact CB-CD2 4.38Å; F67-F71 AromaticContact CD2-CD2 3.35Å; F67-F71 HydrophobicContact CD2-CD2 3.35Å; F67-F71 AromaticContact CD2-CE2 3.87Å; F67-F71 HydrophobicContact CD2-CE2 3.87Å; F67-F71 HydrophobicContact CD2-CG 4.26Å; F67-F71 HydrophobicContact CE2-CB 4.29Å; F67-F71 AromaticContact CE2-CD2 3.7Å; F67-F71 HydrophobicContact CE2-CD2 3.7Å; F67-F71 HydrophobicContact CE2-CE2 4.38Å; F67-F71 HydrophobicContact CE2-CG 4.2Å; F67-F71 AromaticContact CG-CD2 3.95Å; F67-F71 HydrophobicContact CG-CD2 3.95Å; F67-F71 HydrophobicContact CZ-CB 4.4Å; F67-F71 WeakPolarHBondContact O-CD2 3.23Å; F67-F71 PolarHBondContact O-N 2.87Å; F67-L72 HydrophobicContact CD1-CD1 4.24Å; F67-L72 HydrophobicContact CD1-CG 4.41Å; F67-L72 HydrophobicContact CE1-CD1 3.92Å; F67-L72 HydrophobicContact CE1-CD2 4.41Å; F67-L72 HydrophobicContact CE1-CG 4.01Å; F67-L88 HydrophobicContact CZ-CD1 4.13Å; F67-L88 HydrophobicContact CZ-CD2 4.27Å; F67-F90 AromaticContact CE1-CE1 3.9Å; F67-F90 HydrophobicContact CE1-CE1 3.9Å; F67-F90 HydrophobicContact CE1-CZ 4.01Å; F67-F90 HydrophobicContact CE2-CE1 4.44Å; F67-F90 AromaticContact CZ-CE1 3.68Å; F67-F90 HydrophobicContact CZ-CE1 3.68Å; F67-F90 AromaticContact CZ-CZ 3.64Å; F67-F90 HydrophobicContact CZ-CZ 3.64Å; F67-W123 HydrophobicContact CB-CE3 4.41Å; F67-W123 HydrophobicContact CD1-CE3 4.49Å; F67-W123 AromaticContact CD1-CZ3 3.87Å; F67-W123 HydrophobicContact CD1-CZ3 3.87Å; F67-W123 HydrophobicContact CE1-CZ3 4.21Å; F67-W123 HydrophobicContact CG-CE3 4.34Å; F67-W123 HydrophobicContact CG-CZ3 4.14Å; F67-T126 HydrophobicContact CD2-CG2 3.77Å; F67-T126 HydrophobicContact CE2-CG2 3.65Å; F67-T126 HydrophobicContact CZ-CG2 4.44Å; F67-V127 HydrophobicContact CB-CG2 3.75Å; F67-V127 HydrophobicContact CD2-CG2 4.28Å
68	T	93.5	Very high	89.9	Confident	31 Å²	31	44.1 Å²	44.1	19%	0.19	25%	0.247	C	C	.	.	I	π-helix	trans	-61	-42.2	179.5	-56.4	0	0	0	0	111.5	F64 N65 L66 L72 S73	F64-T68 PolarHBondContact O-N 3.47Å; F64-T68 PolarHBondContact O-OG1 3.33Å; N65-T68 PolarHBondContact O-N 3.49Å; L66-T68 PolarHBondContact O-N 2.91Å; T68-L72 HydrophobicContact CG2-CB 4.32Å; T68-L72 HydrophobicContact CG2-CD1 4.47Å; T68-L72 CarbonylContact O-C 3.46Å; T68-L72 WeakPolarHBondContact O-CA 3.28Å; T68-L72 WeakPolarHBondContact O-CB 3.42Å; T68-L72 PolarHBondContact O-N 2.8Å; T68-L72 VanDerWaalsContact O-N 3.17Å; T68-S73 PolarHBondContact O-N 3.05Å; T68-S73 VanDerWaalsContact O-N 3.08Å
69	Q	92.3	Very high	89.6	Confident	40 Å²	40	42.7 Å²	42.7	19%	0.187	24%	0.237	C	C	.	.	I	π-helix	trans	-67.2	-42.9	177.5	-73	174.1	30.4	0	0	112.5	I26 N65 L66 F67 S73	I26-Q69 HydrophobicContact CD1-CB 4Å; I26-Q69 HydrophobicContact CD1-CG 4.39Å; N65-Q69 WeakPolarHBondContact O-CB 3.35Å; N65-Q69 VanDerWaalsContact O-CG 3.29Å; N65-Q69 WeakPolarHBondContact O-CG 3.39Å; N65-Q69 PolarHBondContact O-N 3.06Å; L66-Q69 PolarHBondContact O-N 3.16Å; F67-Q69 VanDerWaalsContact C-N 3.32Å; F67-Q69 PolarHBondContact O-N 2.99Å; Q69-S73 WeakPolarHBondContact O-CB 3.24Å
70	A	92.8	Very high	89.1	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.259	C	S	.	.	I	π-helix	trans	-81.9	-32.4	-173	0	0	0	0	0	114.1	I31 L66 F67 Y135	I31-A70 HydrophobicContact CD1-CB 3.61Å; I31-A70 HydrophobicContact CG1-CB 4.07Å; L66-A70 VanDerWaalsContact O-CB 3.23Å; L66-A70 WeakPolarHBondContact O-CB 3.29Å; L66-A70 PolarHBondContact O-N 3.26Å; F67-A70 PolarHBondContact O-N 2.95Å; A70-Y135 PolarHBondContact O-OH 3.38Å
71	F	93.5	Very high	88.6	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.009	26%	0.257	C	S	.	.	I	π-helix	trans	-122.5	-20.4	-169.1	-53.3	-73.5	0	0	0	114.1	F67 P83 L88 R108 V127 N130 L131 Q134 Y135	F67-F71 HydrophobicContact CB-CD2 4.38Å; F67-F71 AromaticContact CD2-CD2 3.35Å; F67-F71 HydrophobicContact CD2-CD2 3.35Å; F67-F71 AromaticContact CD2-CE2 3.87Å; F67-F71 HydrophobicContact CD2-CE2 3.87Å; F67-F71 HydrophobicContact CD2-CG 4.26Å; F67-F71 HydrophobicContact CE2-CB 4.29Å; F67-F71 AromaticContact CE2-CD2 3.7Å; F67-F71 HydrophobicContact CE2-CD2 3.7Å; F67-F71 HydrophobicContact CE2-CE2 4.38Å; F67-F71 HydrophobicContact CE2-CG 4.2Å; F67-F71 AromaticContact CG-CD2 3.95Å; F67-F71 HydrophobicContact CG-CD2 3.95Å; F67-F71 HydrophobicContact CZ-CB 4.4Å; F67-F71 WeakPolarHBondContact O-CD2 3.23Å; F67-F71 PolarHBondContact O-N 2.87Å; F71-P83 HydrophobicContact CD1-CB 4.43Å; F71-L88 HydrophobicContact CB-CD2 3.89Å; F71-R108 WeakPolarHBondContact O-CD 3.37Å; F71-V127 HydrophobicContact CE2-CG1 4.5Å; F71-N130 HydrophobicContact CD1-CB 3.96Å; F71-N130 HydrophobicContact CD2-CB 4.34Å; F71-N130 HydrophobicContact CE1-CB 3.46Å; F71-N130 VanDerWaalsContact CE1-CB 3.46Å; F71-N130 HydrophobicContact CE2-CB 3.92Å; F71-N130 HydrophobicContact CG-CB 4.37Å; F71-N130 HydrophobicContact CZ-CB 3.46Å; F71-N130 VanDerWaalsContact CZ-CB 3.46Å; F71-L131 HydrophobicContact CZ-CB 4.33Å; F71-Q134 VanDerWaalsContact CD1-OE1 3.24Å; F71-Y135 AromaticContact CD1-CE2 3.96Å; F71-Y135 HydrophobicContact CD1-CE2 3.96Å; F71-Y135 AromaticContact CE1-CD2 3.93Å; F71-Y135 HydrophobicContact CE1-CD2 3.93Å; F71-Y135 AromaticContact CE1-CE2 3.5Å; F71-Y135 HydrophobicContact CE1-CE2 3.5Å; F71-Y135 HydrophobicContact CZ-CE2 4.3Å
72	L	92.2	Very high	88.1	Confident	47 Å²	47	42.4 Å²	42.4	25%	0.246	24%	0.241	C	C	.	.	I	π-helix	trans	-111.5	-7.8	-178.7	-57.6	-177.7	0	0	0	113.8	F67 T68 P74 L88 R108 L113	F67-L72 HydrophobicContact CD1-CD1 4.24Å; F67-L72 HydrophobicContact CD1-CG 4.41Å; F67-L72 HydrophobicContact CE1-CD1 3.92Å; F67-L72 HydrophobicContact CE1-CD2 4.41Å; F67-L72 HydrophobicContact CE1-CG 4.01Å; T68-L72 HydrophobicContact CG2-CB 4.32Å; T68-L72 HydrophobicContact CG2-CD1 4.47Å; T68-L72 CarbonylContact O-C 3.46Å; T68-L72 WeakPolarHBondContact O-CA 3.28Å; T68-L72 WeakPolarHBondContact O-CB 3.42Å; T68-L72 PolarHBondContact O-N 2.8Å; T68-L72 VanDerWaalsContact O-N 3.17Å; L72-P74 WeakPolarHBondContact O-CD 3.49Å; L72-L88 HydrophobicContact CD2-CD1 3.54Å; L72-R108 HydrophobicContact CD2-CG 4.01Å; L72-L113 HydrophobicContact CD1-CD1 4.4Å; L72-L113 HydrophobicContact CD2-CD1 3.89Å
73	S	89.2	Confident	87.6	Confident	21 Å²	21	41 Å²	41	15%	0.147	24%	0.237	C	C	.	.			trans	-64.3	122	179.7	-179.1	0	0	0	0	111	T68 Q69 A75 L76	T68-S73 PolarHBondContact O-N 3.05Å; T68-S73 VanDerWaalsContact O-N 3.08Å; Q69-S73 WeakPolarHBondContact O-CB 3.24Å; S73-A75 PolarHBondContact O-N 3.4Å; S73-A75 VanDerWaalsContact O-N 3.15Å; S73-L76 PolarHBondContact O-N 3.38Å
74	P	84.4	Confident	87.1	Confident	97 Å²	97	42.7 Å²	42.7	63%	0.63	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-60	-25.9	176.9	-24.3	34.5	0	0	0	113.3	L72 L76 E77	L72-P74 WeakPolarHBondContact O-CD 3.49Å; P74-L76 PolarHBondContact O-N 3.45Å; P74-E77 WeakPolarHBondContact O-CB 3.49Å; P74-E77 PolarHBondContact O-N 2.73Å
75	A	81.1	Confident	86.8	Confident	51 Å²	51	45 Å²	45	42%	0.421	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-66.1	-22.2	177.8	0	0	0	0	0	113	V23 S73	V23-A75 HydrophobicContact CG1-CB 3.72Å; S73-A75 PolarHBondContact O-N 3.4Å; S73-A75 VanDerWaalsContact O-N 3.15Å
76	L	82.7	Confident	86.6	Confident	7 Å²	7	44.5 Å²	44.5	4%	0.037	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-95.7	-10.5	-179	-88	80.1	0	0	0	113.1	I26 S73 P74 N78 S79 G82 Y135	I26-L76 HydrophobicContact CB-CD1 3.85Å; I26-L76 HydrophobicContact CD1-CD1 4.32Å; I26-L76 HydrophobicContact CG2-CD1 4.07Å; I26-L76 HydrophobicContact CG2-CD2 3.99Å; S73-L76 PolarHBondContact O-N 3.38Å; P74-L76 PolarHBondContact O-N 3.45Å; L76-N78 VanDerWaalsContact C-N 3.3Å; L76-N78 PolarHBondContact O-N 3.13Å; L76-S79 PolarHBondContact O-N 3.33Å; L76-S79 VanDerWaalsContact O-N 3.12Å; L76-G82 VanDerWaalsContact O-CA 3.3Å; L76-G82 WeakPolarHBondContact O-CA 3.4Å; L76-Y135 VanDerWaalsContact CD2-OH 3.24Å; L76-Y135 WeakPolarHBondContact CD2-OH 3.4Å
77	E	76.8	Confident	86.5	Confident	92 Å²	92	47.5 Å²	47.5	43%	0.43	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-41	-171.7	179.3	167.3	178.2	0	0	113.7	P74 R108	P74-E77 WeakPolarHBondContact O-CB 3.49Å; P74-E77 PolarHBondContact O-N 2.73Å; E77-R108 VanDerWaalsContact CD-CZ 3.41Å; E77-R108 VanDerWaalsContact CD-NH1 3.33Å; E77-R108 IonicContact OE1-CZ 3.87Å; E77-R108 IonicContact OE1-NH1 3.57Å; E77-R108 IonicContact OE1-NH2 2.97Å; E77-R108 PolarHBondContact OE1-NH2 3.37Å; E77-R108 IonicContact OE2-CZ 3.66Å; E77-R108 IonicContact OE2-NH1 2.68Å; E77-R108 PolarHBondContact OE2-NH1 2.91Å; E77-R108 IonicContact OE2-NH2 3.08Å; E77-R108 PolarHBondContact OE2-NH2 3.35Å; E77-R108 VanDerWaalsContact OE2-NH2 3.13Å
78	N	76.3	Confident	86.5	Confident	154 Å²	154	47.4 Å²	47.4	82%	0.824	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.3	16.7	177.5	-59.6	-38.8	0	0	0	111.9	L76	L76-N78 VanDerWaalsContact C-N 3.3Å; L76-N78 PolarHBondContact O-N 3.13Å
79	S	80.8	Confident	86.6	Confident	48 Å²	48	47 Å²	47	34%	0.336	28%	0.277	S	S	.	.			trans	-83	144.2	179.6	-175.6	0	0	0	0	110.4	L76 D81 G82	L76-S79 PolarHBondContact O-N 3.33Å; L76-S79 VanDerWaalsContact O-N 3.12Å; S79-D81 PolarHBondContact O-N 2.88Å; S79-D81 PolarHBondContact OG-N 3.23Å; S79-G82 WeakPolarHBondContact O-CA 3.39Å; S79-G82 PolarHBondContact O-N 2.76Å
80	V	75.7	Confident	86.8	Confident	99 Å²	99	45.1 Å²	45.1	60%	0.6	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-29.5	170.1	-172.4	0	0	0	0	111	G82 R217 H218	V80-G82 PolarHBondContact O-N 3.05Å; V80-R217 WeakPolarHBondContact O-CD 2.9Å; V80-H218 WeakPolarHBondContact CG1-NE2 3.48Å
81	D	79.5	Confident	86.9	Confident	48 Å²	48	45.4 Å²	45.4	26%	0.257	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	3.5	171.7	-70.7	-57.2	0	0	0	113	S79 Y135 H218	S79-D81 PolarHBondContact O-N 2.88Å; S79-D81 PolarHBondContact OG-N 3.23Å; D81-Y135 WeakPolarHBondContact O-CE1 3.07Å; D81-H218 IonicContact OD1-CE1 3.69Å; D81-H218 PolarHBondContact OD1-CE1 2.82Å; D81-H218 IonicContact OD1-ND1 3.13Å; D81-H218 IonicContact OD1-NE2 2.82Å
82	G	83.8	Confident	86.9	Confident	2 Å²	2	47 Å²	47	2%	0.021	28%	0.277	C	S	.	.	S	Bend	trans	-81.1	171.7	-176.4	0	0	0	0	0	115.2	L76 S79 V80	L76-G82 VanDerWaalsContact O-CA 3.3Å; L76-G82 WeakPolarHBondContact O-CA 3.4Å; S79-G82 WeakPolarHBondContact O-CA 3.39Å; S79-G82 PolarHBondContact O-N 2.76Å; V80-G82 PolarHBondContact O-N 3.05Å
83	P	86.1	Confident	86.6	Confident	22 Å²	22	48.5 Å²	48.5	14%	0.143	29%	0.285	C	S	.	.			trans	-61.8	141.2	169.8	28	-33.8	0	0	0	111.1	F71 D85 Q134 Y135	F71-P83 HydrophobicContact CD1-CB 4.43Å; P83-D85 PolarHBondContact O-N 3.06Å; P83-Q134 HydrophobicContact CB-CB 4.17Å; P83-Y135 HydrophobicContact CB-CE2 4.32Å
84	G	85.3	Confident	86.1	Confident	36 Å²	36	52 Å²	52	37%	0.371	30%	0.301	S	S	.	.	S	Bend	trans	-76	-17.3	-174.8	0	0	0	0	0	118.8	Q134	G84-Q134 WeakPolarHBondContact CA-O 3.42Å; G84-Q134 PolarHBondContact N-O 3.12Å; G84-Q134 VanDerWaalsContact N-O 3.08Å
85	D	89.5	Confident	85.3	Confident	87 Å²	87	56.2 Å²	56.2	47%	0.465	31%	0.31	S	S	.	.			trans	-149	160.8	-171.2	-163	-7.2	0	0	0	107.9	P83	P83-D85 PolarHBondContact O-N 3.06Å
86	D	90.9	Very high	84.5	Confident	44 Å²	44	59 Å²	59	24%	0.235	31%	0.314	C	S	.	.	S	Bend	trans	-94.5	-1.2	-179.8	68.2	15.5	0	0	0	113.9	R107 R108	D86-R107 HydrophobicContact CB-CG 4.22Å; D86-R107 CarbonylContact O-C 3.5Å; D86-R107 WeakPolarHBondContact O-CA 3.27Å; D86-R107 IonicContact OD1-NE 3.72Å; D86-R107 IonicContact OD1-NH2 2.68Å; D86-R107 IonicContact OD2-CZ 3.45Å; D86-R107 IonicContact OD2-NE 2.76Å; D86-R107 PolarHBondContact OD2-NE 3.09Å; D86-R107 IonicContact OD2-NH2 3.8Å; D86-R107 PolarHBondContact OD2-NH2 3.23Å; D86-R108 HydrophobicContact CB-CB 4.42Å; D86-R108 PolarHBondContact O-N 3.27Å
87	L	94.3	Very high	83.7	Confident	67 Å²	67	68.5 Å²	68.5	35%	0.351	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	119.7	175.3	-62.4	-179.2	0	0	0	111.5	F89 V105 Q134	L87-F89 HydrophobicContact CB-CE2 4.27Å; L87-V105 HydrophobicContact CB-CG1 4.27Å; L87-V105 HydrophobicContact CD2-CG1 4.26Å; L87-Q134 PolarHBondContact O-NE2 2.91Å
88	L	96.3	Very high	83.2	Confident	1 Å²	1	72 Å²	72	1%	0.005	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127.5	175.7	-59.8	177.2	0	0	0	110.4	F67 F71 L72 F90 V105 F106 R108 L113 N130	F67-L88 HydrophobicContact CZ-CD1 4.13Å; F67-L88 HydrophobicContact CZ-CD2 4.27Å; F71-L88 HydrophobicContact CB-CD2 3.89Å; L72-L88 HydrophobicContact CD2-CD1 3.54Å; L88-F90 HydrophobicContact CB-CD2 4.48Å; L88-F90 HydrophobicContact CB-CE2 3.65Å; L88-F90 HydrophobicContact CB-CZ 4.15Å; L88-F90 HydrophobicContact CD1-CZ 4.38Å; L88-V105 WeakPolarHBondContact O-CA 3.18Å; L88-F106 WeakPolarHBondContact CB-O 3.34Å; L88-F106 PolarHBondContact N-O 3.46Å; L88-F106 PolarHBondContact O-N 3.27Å; L88-R108 HydrophobicContact CD1-CB 4.14Å; L88-R108 HydrophobicContact CD1-CG 4.3Å; L88-R108 HydrophobicContact CG-CB 4.36Å; L88-L113 HydrophobicContact CD1-CD2 3.98Å; L88-N130 WeakPolarHBondContact CA-OD1 3.47Å
89	F	96.4	Very high	82.9	Confident	23 Å²	23	72.4 Å²	72.4	10%	0.101	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	129.9	179.4	-60.2	-96.4	0	0	0	110	L87 V105 T126 L129 N130 M133 P167	L87-F89 HydrophobicContact CB-CE2 4.27Å; F89-V105 HydrophobicContact CD1-CG2 3.7Å; F89-V105 HydrophobicContact CE1-CG1 4.39Å; F89-V105 HydrophobicContact CE1-CG2 3.89Å; F89-T126 WeakPolarHBondContact O-CG2 3.39Å; F89-L129 HydrophobicContact CB-CD2 3.54Å; F89-L129 HydrophobicContact CB-CG 3.98Å; F89-L129 HydrophobicContact CD1-CD2 4.45Å; F89-L129 HydrophobicContact CG-CD2 4.15Å; F89-L129 HydrophobicContact CG-CG 4.38Å; F89-N130 PolarHBondContact N-OD1 2.88Å; F89-N130 PolarHBondContact O-ND2 3.06Å; F89-M133 HydrophobicContact CD2-CG 4.38Å; F89-M133 HydrophobicContact CE2-CB 4.32Å; F89-M133 HydrophobicContact CE2-CE 4.02Å; F89-M133 HydrophobicContact CE2-CG 4.26Å; F89-M133 HydrophobicContact CZ-CE 3.88Å; F89-P167 HydrophobicContact CD1-CG 3.96Å; F89-P167 HydrophobicContact CE1-CG 3.75Å
90	F	96.4	Very high	82.5	Confident	0 Å²	0	77.1 Å²	77.1	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	123	177.1	-63.5	-96.1	0	0	0	109.4	F67 L88 L103 S104 F106 L113 P114 V121 W123 T126	F67-F90 AromaticContact CE1-CE1 3.9Å; F67-F90 HydrophobicContact CE1-CE1 3.9Å; F67-F90 HydrophobicContact CE1-CZ 4.01Å; F67-F90 HydrophobicContact CE2-CE1 4.44Å; F67-F90 AromaticContact CZ-CE1 3.68Å; F67-F90 HydrophobicContact CZ-CE1 3.68Å; F67-F90 AromaticContact CZ-CZ 3.64Å; F67-F90 HydrophobicContact CZ-CZ 3.64Å; L88-F90 HydrophobicContact CB-CD2 4.48Å; L88-F90 HydrophobicContact CB-CE2 3.65Å; L88-F90 HydrophobicContact CB-CZ 4.15Å; L88-F90 HydrophobicContact CD1-CZ 4.38Å; F90-L103 WeakPolarHBondContact O-CA 3.44Å; F90-S104 WeakPolarHBondContact CB-OG 3.47Å; F90-S104 PolarHBondContact N-O 2.86Å; F90-S104 PolarHBondContact O-N 2.89Å; F90-F106 AromaticContact CD2-CD2 3.65Å; F90-F106 HydrophobicContact CD2-CD2 3.65Å; F90-F106 HydrophobicContact CD2-CE2 4.32Å; F90-F106 HydrophobicContact CE2-CB 4.23Å; F90-F106 AromaticContact CE2-CD2 3.75Å; F90-F106 HydrophobicContact CE2-CD2 3.75Å; F90-F106 HydrophobicContact CE2-CG 4.46Å; F90-L113 HydrophobicContact CE2-CD2 4.12Å; F90-L113 HydrophobicContact CZ-CD2 4.01Å; F90-P114 HydrophobicContact CD1-CB 4.1Å; F90-P114 HydrophobicContact CD1-CG 3.68Å; F90-P114 HydrophobicContact CD2-CG 4.25Å; F90-P114 HydrophobicContact CE1-CB 4.1Å; F90-P114 HydrophobicContact CE1-CG 3.8Å; F90-P114 HydrophobicContact CE2-CG 4.36Å; F90-P114 HydrophobicContact CG-CG 3.91Å; F90-P114 HydrophobicContact CZ-CG 4.15Å; F90-V121 HydrophobicContact CB-CG1 4.5Å; F90-V121 HydrophobicContact CD1-CG1 4.17Å; F90-W123 HydrophobicContact CD1-CH2 4.33Å; F90-W123 HydrophobicContact CD1-CZ3 4.19Å; F90-W123 HydrophobicContact CE1-CH2 4.02Å; F90-W123 AromaticContact CE1-CZ3 3.88Å; F90-W123 HydrophobicContact CE1-CZ3 3.88Å; F90-T126 HydrophobicContact CD1-CG2 4.01Å; F90-T126 HydrophobicContact CE1-CG2 4.49Å
91	V	94.9	Very high	82.7	Confident	6 Å²	6	73.8 Å²	73.8	4%	0.036	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	128.1	-179.8	-175.3	0	0	0	0	108.9	L103 D122 E125 T126 L129 Y183	V91-L103 HydrophobicContact CB-CD2 4.12Å; V91-L103 HydrophobicContact CG1-CD2 4.23Å; V91-L103 HydrophobicContact CG2-CD2 3.71Å; V91-D122 HydrophobicContact CB-CB 4.48Å; V91-D122 HydrophobicContact CG1-CB 4.48Å; V91-D122 PolarHBondContact O-N 2.93Å; V91-E125 HydrophobicContact CB-CB 3.93Å; V91-E125 HydrophobicContact CG1-CB 3.9Å; V91-E125 HydrophobicContact CG2-CB 3.98Å; V91-T126 PolarHBondContact N-OG1 2.97Å; V91-L129 HydrophobicContact CG2-CB 4.42Å; V91-L129 HydrophobicContact CG2-CD2 3.95Å; V91-Y183 HydrophobicContact CG1-CD1 4.46Å; V91-Y183 HydrophobicContact CG1-CE1 3.93Å; V91-Y183 HydrophobicContact CG2-CE1 4.28Å
92	H	92.8	Very high	83.2	Confident	36 Å²	36	77.6 Å²	77.6	17%	0.167	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	139.8	179.4	-69.5	-154.2	0	0	0	111.2	L94 E102 S104 Y120	H92-L94 PolarHBondContact O-N 2.99Å; H92-E102 HydrophobicContact CB-CB 4.13Å; H92-E102 WeakPolarHBondContact CB-O 3.09Å; H92-E102 PolarHBondContact N-O 3.5Å; H92-S104 PolarHBondContact NE2-OG 2.8Å; H92-Y120 CarbonylContact C-O 3.5Å; H92-Y120 VanDerWaalsContact CA-O 3.27Å; H92-Y120 WeakPolarHBondContact CA-O 3.33Å; H92-Y120 AromaticContact CD2-CD2 3.97Å; H92-Y120 AromaticContact CE1-CD2 3.77Å; H92-Y120 AromaticContact CE1-CE2 3.77Å; H92-Y120 AromaticContact CG-CD2 3.96Å; H92-Y120 AromaticContact ND1-CD2 3.82Å; H92-Y120 AromaticContact NE2-CD2 3.85Å; H92-Y120 AromaticContact NE2-CE2 3.59Å
93	L	85.9	Confident	83.6	Confident	78 Å²	78	78.7 Å²	78.7	41%	0.408	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-62.3	121.9	173.5	-75.4	164.9	0	0	0	110.5	K95 D119 Y120 D122	L93-K95 PolarHBondContact O-N 3.42Å; L93-D119 WeakPolarHBondContact CD1-O 3.06Å; L93-Y120 PolarHBondContact N-O 2.94Å; L93-D122 HydrophobicContact CD2-CB 3.74Å; L93-D122 HydrophobicContact CG-CB 4.01Å
94	L	77.8	Confident	84	Confident	93 Å²	93	78.7 Å²	78.7	49%	0.487	38%	0.384	S	S	.	.			trans	-71.8	100.5	176.3	-72.8	174.5	0	0	0	110.5	H92 Q96 R99 P101	H92-L94 PolarHBondContact O-N 2.99Å; L94-Q96 PolarHBondContact O-N 3.19Å; L94-R99 HydrophobicContact CD2-CB 4.16Å; L94-R99 WeakPolarHBondContact CD2-O 3.48Å; L94-P101 HydrophobicContact CD2-CB 4.48Å
95	K	68.2	Low	84.5	Confident	186 Å²	186	80.4 Å²	80.4	81%	0.809	39%	0.387	S	S	*	.	S	Bend	trans	-63.4	-20.8	173.5	-65.6	-175.4	179.7	-179.7	0	113.2	L93	L93-K95 PolarHBondContact O-N 3.42Å
96	Q	64.6	Low	84.8	Confident	110 Å²	110	79 Å²	79	51%	0.514	38%	0.377	S	S	.	.	S	Bend	trans	-137.9	135.5	-177.7	-67.9	-172.4	-27.2	0	0	110.8	L94 D98 R99	L94-Q96 PolarHBondContact O-N 3.19Å; Q96-D98 PolarHBondContact O-N 3.17Å; Q96-D98 VanDerWaalsContact O-N 3.15Å; Q96-R99 HydrophobicContact CB-CG 4.18Å; Q96-R99 PolarHBondContact O-N 3.29Å
97	K	66.6	Low	84.9	Confident	207 Å²	207	83.4 Å²	83.4	90%	0.9	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.1	-178	-73.7	-173.2	175.6	-176.6	0	114.6
98	D	65.8	Low	84.7	Confident	164 Å²	164	82.8 Å²	82.8	88%	0.877	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	4.7	-174	-62.4	-41	0	0	0	114.2	Q96	Q96-D98 PolarHBondContact O-N 3.17Å; Q96-D98 VanDerWaalsContact O-N 3.15Å
99	R	70.2	Confident	84.4	Confident	164 Å²	164	88.4 Å²	88.4	62%	0.619	41%	0.413	S	S	*	.	S	Bend	trans	-91.7	142.5	179.2	-73.4	-171.6	175.7	-159.9	-6.6	111.5	L94 Q96	L94-R99 HydrophobicContact CD2-CB 4.16Å; L94-R99 WeakPolarHBondContact CD2-O 3.48Å; Q96-R99 HydrophobicContact CB-CG 4.18Å; Q96-R99 PolarHBondContact O-N 3.29Å
100	K	71.9	Confident	84.2	Confident	147 Å²	147	88.9 Å²	88.9	64%	0.639	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-61.3	140.2	166.7	-68.4	-172.5	177.5	-175.7	0	108.8	E180	K100-E180 IonicContact NZ-OE1 3.27Å; K100-E180 PolarHBondContact NZ-OE1 2.74Å
101	P	80	Confident	83.9	Confident	29 Å²	29	94.1 Å²	94.1	19%	0.188	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-60.8	140.7	173.9	24.9	-30.8	0	0	0	110.3	L94 Y183	L94-P101 HydrophobicContact CD2-CB 4.48Å; P101-Y183 HydrophobicContact CB-CD1 4Å; P101-Y183 HydrophobicContact CG-CD1 4Å; P101-Y183 WeakPolarHBondContact CG-O 3.38Å
102	E	88.8	Confident	83.7	Confident	127 Å²	127	99.4 Å²	99.4	59%	0.593	48%	0.484	S	S	*	.			trans	-105.2	136.4	176.9	-173.3	170.8	-179.6	0	0	108.5	H92	H92-E102 HydrophobicContact CB-CB 4.13Å; H92-E102 WeakPolarHBondContact CB-O 3.09Å; H92-E102 PolarHBondContact N-O 3.5Å
103	L	93.5	Very high	83.7	Confident	26 Å²	26	99.2 Å²	99.2	14%	0.136	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	135	178.5	-60.9	-178.1	0	0	0	108.8	F90 V91 L129 P167 I181 Y183	F90-L103 WeakPolarHBondContact O-CA 3.44Å; V91-L103 HydrophobicContact CB-CD2 4.12Å; V91-L103 HydrophobicContact CG1-CD2 4.23Å; V91-L103 HydrophobicContact CG2-CD2 3.71Å; L103-L129 HydrophobicContact CD1-CD2 4.27Å; L103-L129 HydrophobicContact CD2-CD2 4.16Å; L103-P167 HydrophobicContact CD1-CB 3.69Å; L103-P167 HydrophobicContact CD1-CG 4.12Å; L103-I181 HydrophobicContact CD1-CG2 3.8Å; L103-I181 HydrophobicContact CG-CG2 4.04Å; L103-Y183 HydrophobicContact CD1-CG 4.39Å; L103-Y183 HydrophobicContact CD2-CD1 4.4Å; L103-Y183 HydrophobicContact CD2-CG 4.35Å
104	S	94.3	Very high	84.1	Confident	22 Å²	22	96 Å²	96	15%	0.154	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	133.6	165.9	50.5	0	0	0	0	109.9	F90 H92	F90-S104 WeakPolarHBondContact CB-OG 3.47Å; F90-S104 PolarHBondContact N-O 2.86Å; F90-S104 PolarHBondContact O-N 2.89Å; H92-S104 PolarHBondContact NE2-OG 2.8Å
105	V	95.4	Very high	84.8	Confident	72 Å²	72	97.7 Å²	97.7	44%	0.436	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	127.5	179.9	-173.1	0	0	0	0	108.8	L87 L88 F89	L87-V105 HydrophobicContact CB-CG1 4.27Å; L87-V105 HydrophobicContact CD2-CG1 4.26Å; L88-V105 WeakPolarHBondContact O-CA 3.18Å; F89-V105 HydrophobicContact CD1-CG2 3.7Å; F89-V105 HydrophobicContact CE1-CG1 4.39Å; F89-V105 HydrophobicContact CE1-CG2 3.89Å
106	F	96	Very high	85.8	Confident	58 Å²	58	92 Å²	92	25%	0.254	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	151.7	176	-64.2	-81.1	0	0	0	110.1	L88 F90 L113 P114	L88-F106 WeakPolarHBondContact CB-O 3.34Å; L88-F106 PolarHBondContact N-O 3.46Å; L88-F106 PolarHBondContact O-N 3.27Å; F90-F106 AromaticContact CD2-CD2 3.65Å; F90-F106 HydrophobicContact CD2-CD2 3.65Å; F90-F106 HydrophobicContact CD2-CE2 4.32Å; F90-F106 HydrophobicContact CE2-CB 4.23Å; F90-F106 AromaticContact CE2-CD2 3.75Å; F90-F106 HydrophobicContact CE2-CD2 3.75Å; F90-F106 HydrophobicContact CE2-CG 4.46Å; F106-L113 HydrophobicContact CB-CD2 3.79Å; F106-L113 HydrophobicContact CG-CD2 4.46Å; F106-P114 HydrophobicContact CD2-CG 4.5Å; F106-P114 HydrophobicContact CE2-CG 4.14Å
107	R	93.8	Very high	86.9	Confident	136 Å²	136	92.5 Å²	92.5	51%	0.513	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	146.7	167.1	-156.5	171.2	-163.4	139.6	14.6	109.8	D86 N109 S110	D86-R107 HydrophobicContact CB-CG 4.22Å; D86-R107 CarbonylContact O-C 3.5Å; D86-R107 WeakPolarHBondContact O-CA 3.27Å; D86-R107 IonicContact OD1-NE 3.72Å; D86-R107 IonicContact OD1-NH2 2.68Å; D86-R107 IonicContact OD2-CZ 3.45Å; D86-R107 IonicContact OD2-NE 2.76Å; D86-R107 PolarHBondContact OD2-NE 3.09Å; D86-R107 IonicContact OD2-NH2 3.8Å; D86-R107 PolarHBondContact OD2-NH2 3.23Å; R107-N109 WeakPolarHBondContact CB-OD1 3.34Å; R107-N109 VanDerWaalsContact CD-OD1 3.23Å; R107-N109 WeakPolarHBondContact CD-OD1 3.34Å; R107-N109 VanDerWaalsContact CG-OD1 3.25Å; R107-N109 WeakPolarHBondContact CG-OD1 3.37Å; R107-N109 PolarHBondContact O-N 2.78Å; R107-N109 VanDerWaalsContact O-N 3.14Å; R107-S110 WeakPolarHBondContact O-CB 3.23Å; R107-S110 PolarHBondContact O-N 2.97Å
108	R	89.6	Confident	87.9	Confident	54 Å²	54	85 Å²	85	20%	0.204	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-32.4	179.2	-173.7	-175.9	61.8	87.8	13.2	113.8	F71 L72 E77 D86 L88 S110 L113	F71-R108 WeakPolarHBondContact O-CD 3.37Å; L72-R108 HydrophobicContact CD2-CG 4.01Å; E77-R108 VanDerWaalsContact CD-CZ 3.41Å; E77-R108 VanDerWaalsContact CD-NH1 3.33Å; E77-R108 IonicContact OE1-CZ 3.87Å; E77-R108 IonicContact OE1-NH1 3.57Å; E77-R108 IonicContact OE1-NH2 2.97Å; E77-R108 PolarHBondContact OE1-NH2 3.37Å; E77-R108 IonicContact OE2-CZ 3.66Å; E77-R108 IonicContact OE2-NH1 2.68Å; E77-R108 PolarHBondContact OE2-NH1 2.91Å; E77-R108 IonicContact OE2-NH2 3.08Å; E77-R108 PolarHBondContact OE2-NH2 3.35Å; E77-R108 VanDerWaalsContact OE2-NH2 3.13Å; D86-R108 HydrophobicContact CB-CB 4.42Å; D86-R108 PolarHBondContact O-N 3.27Å; L88-R108 HydrophobicContact CD1-CB 4.14Å; L88-R108 HydrophobicContact CD1-CG 4.3Å; L88-R108 HydrophobicContact CG-CB 4.36Å; R108-S110 VanDerWaalsContact C-N 3.34Å; R108-L113 WeakPolarHBondContact O-CD1 3.4Å
109	N	89.1	Confident	88.9	Confident	119 Å²	119	83.7 Å²	83.7	64%	0.636	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	10.8	178.3	66.5	-7	0	0	0	114	R107	R107-N109 WeakPolarHBondContact CB-OD1 3.34Å; R107-N109 VanDerWaalsContact CD-OD1 3.23Å; R107-N109 WeakPolarHBondContact CD-OD1 3.34Å; R107-N109 VanDerWaalsContact CG-OD1 3.25Å; R107-N109 WeakPolarHBondContact CG-OD1 3.37Å; R107-N109 PolarHBondContact O-N 2.78Å; R107-N109 VanDerWaalsContact O-N 3.14Å
110	S	92.7	Very high	89.9	Confident	33 Å²	33	79.2 Å²	79.2	23%	0.231	41%	0.406	C	S	.	.			trans	-63.7	137.2	177.2	179	0	0	0	0	111.2	R107 R108 N112 L113	R107-S110 WeakPolarHBondContact O-CB 3.23Å; R107-S110 PolarHBondContact O-N 2.97Å; R108-S110 VanDerWaalsContact C-N 3.34Å; S110-N112 PolarHBondContact O-N 2.79Å; S110-N112 PolarHBondContact OG-N 3.31Å; S110-L113 WeakPolarHBondContact O-CG 3.18Å
111	S	90.1	Very high	91	Very high	110 Å²	110	72.3 Å²	72.3	77%	0.769	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-16.4	172.7	61.1	0	0	0	0	113.2
112	N	91	Very high	91.6	Very high	117 Å²	117	73 Å²	73	63%	0.626	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	29.2	-171.4	-60.2	-20.1	0	0	0	112	S110	S110-N112 PolarHBondContact O-N 2.79Å; S110-N112 PolarHBondContact OG-N 3.31Å
113	L	93.3	Very high	91.9	Very high	32 Å²	32	67.1 Å²	67.1	17%	0.168	35%	0.351	C	S	.	.			trans	-62.6	138.5	176.1	-69.7	174.3	0	0	0	110.8	L72 L88 F90 F106 R108 S110	L72-L113 HydrophobicContact CD1-CD1 4.4Å; L72-L113 HydrophobicContact CD2-CD1 3.89Å; L88-L113 HydrophobicContact CD1-CD2 3.98Å; F90-L113 HydrophobicContact CE2-CD2 4.12Å; F90-L113 HydrophobicContact CZ-CD2 4.01Å; F106-L113 HydrophobicContact CB-CD2 3.79Å; F106-L113 HydrophobicContact CG-CD2 4.46Å; R108-L113 WeakPolarHBondContact O-CD1 3.4Å; S110-L113 WeakPolarHBondContact O-CG 3.18Å
114	P	93.7	Very high	92	Very high	9 Å²	9	68.2 Å²	68.2	6%	0.058	36%	0.355	C	S	.	.			trans	-55.6	140.1	172.5	-24.8	34.2	0	0	0	112	F90 F106 D118 Y120 V121 W123	F90-P114 HydrophobicContact CD1-CB 4.1Å; F90-P114 HydrophobicContact CD1-CG 3.68Å; F90-P114 HydrophobicContact CD2-CG 4.25Å; F90-P114 HydrophobicContact CE1-CB 4.1Å; F90-P114 HydrophobicContact CE1-CG 3.8Å; F90-P114 HydrophobicContact CE2-CG 4.36Å; F90-P114 HydrophobicContact CG-CG 3.91Å; F90-P114 HydrophobicContact CZ-CG 4.15Å; F106-P114 HydrophobicContact CD2-CG 4.5Å; F106-P114 HydrophobicContact CE2-CG 4.14Å; P114-D118 VanDerWaalsContact CA-OD2 3.29Å; P114-D118 WeakPolarHBondContact CA-OD2 3.31Å; P114-Y120 WeakPolarHBondContact CG-OH 3.3Å; P114-V121 HydrophobicContact CB-CG2 3.84Å; P114-V121 HydrophobicContact CG-CG2 4.29Å; P114-W123 HydrophobicContact CB-CH2 4.12Å; P114-W123 HydrophobicContact CB-CZ2 4.38Å
115	K	92.1	Very high	92	Very high	129 Å²	129	69.6 Å²	69.6	56%	0.561	36%	0.359	S	S	*	.			trans	-108.3	164.1	179.8	-62.1	177.3	-175.4	175.6	0	109.6	T117 D118	K115-T117 PolarHBondContact O-N 3.36Å; K115-D118 PolarHBondContact N-OD2 2.85Å; K115-D118 VanDerWaalsContact O-CB 3.29Å; K115-D118 WeakPolarHBondContact O-CB 3.47Å; K115-D118 PolarHBondContact O-N 3.07Å
116	L	89.8	Confident	92.1	Very high	68 Å²	68	66.1 Å²	66.1	36%	0.356	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-24	174.5	-177.9	60.2	0	0	0	113.6	F64 D118	F64-L116 HydrophobicContact CB-CD1 3.76Å; F64-L116 HydrophobicContact CD1-CB 3.86Å; F64-L116 HydrophobicContact CD1-CD1 4.28Å; F64-L116 HydrophobicContact CD1-CD2 4.15Å; F64-L116 HydrophobicContact CD1-CG 4.32Å; F64-L116 HydrophobicContact CD2-CB 3.98Å; F64-L116 HydrophobicContact CD2-CD1 4.41Å; F64-L116 HydrophobicContact CE1-CB 3.9Å; F64-L116 HydrophobicContact CE2-CB 4.03Å; F64-L116 HydrophobicContact CG-CB 3.9Å; F64-L116 HydrophobicContact CG-CD1 3.88Å; F64-L116 HydrophobicContact CG-CG 4.32Å; F64-L116 HydrophobicContact CZ-CB 3.99Å; L116-D118 PolarHBondContact O-N 3.35Å
117	T	87.2	Confident	92.1	Very high	120 Å²	120	63.4 Å²	63.4	74%	0.736	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-17.8	175.7	52.2	0	0	0	0	113.9	K115 D119	K115-T117 PolarHBondContact O-N 3.36Å; T117-D119 PolarHBondContact O-N 2.85Å
118	D	88.1	Confident	92.3	Very high	50 Å²	50	57 Å²	57	27%	0.267	30%	0.302	S	S	.	.			trans	-81	105.6	-179.3	-65.9	-40	0	0	0	109.8	P114 K115 L116 Y120	P114-D118 VanDerWaalsContact CA-OD2 3.29Å; P114-D118 WeakPolarHBondContact CA-OD2 3.31Å; K115-D118 PolarHBondContact N-OD2 2.85Å; K115-D118 VanDerWaalsContact O-CB 3.29Å; K115-D118 WeakPolarHBondContact O-CB 3.47Å; K115-D118 PolarHBondContact O-N 3.07Å; L116-D118 PolarHBondContact O-N 3.35Å; D118-Y120 HydrophobicContact CB-CD1 3.88Å; D118-Y120 HydrophobicContact CB-CE1 3.53Å; D118-Y120 PolarHBondContact O-N 2.88Å
119	D	86.7	Confident	92.7	Very high	136 Å²	136	54.4 Å²	54.4	73%	0.727	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	2.2	-174	71.5	-17.5	0	0	0	114.3	L93 T117	L93-D119 WeakPolarHBondContact CD1-O 3.06Å; T117-D119 PolarHBondContact O-N 2.85Å
120	Y	91.2	Very high	93	Very high	69 Å²	69	48.8 Å²	48.8	27%	0.271	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-10.7	-179.9	71.4	-92.8	0	0	0	113.3	H92 L93 P114 D118	H92-Y120 CarbonylContact C-O 3.5Å; H92-Y120 VanDerWaalsContact CA-O 3.27Å; H92-Y120 WeakPolarHBondContact CA-O 3.33Å; H92-Y120 AromaticContact CD2-CD2 3.97Å; H92-Y120 AromaticContact CE1-CD2 3.77Å; H92-Y120 AromaticContact CE1-CE2 3.77Å; H92-Y120 AromaticContact CG-CD2 3.96Å; H92-Y120 AromaticContact ND1-CD2 3.82Å; H92-Y120 AromaticContact NE2-CD2 3.85Å; H92-Y120 AromaticContact NE2-CE2 3.59Å; L93-Y120 PolarHBondContact N-O 2.94Å; P114-Y120 WeakPolarHBondContact CG-OH 3.3Å; D118-Y120 HydrophobicContact CB-CD1 3.88Å; D118-Y120 HydrophobicContact CB-CE1 3.53Å; D118-Y120 PolarHBondContact O-N 2.88Å
121	V	94	Very high	93.2	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.018	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	131	-176.8	179.9	0	0	0	0	110.9	F90 P114 W123	F90-V121 HydrophobicContact CB-CG1 4.5Å; F90-V121 HydrophobicContact CD1-CG1 4.17Å; P114-V121 HydrophobicContact CB-CG2 3.84Å; P114-V121 HydrophobicContact CG-CG2 4.29Å; V121-W123 HydrophobicContact CB-CZ2 4.16Å; V121-W123 HydrophobicContact CG1-CD2 3.88Å; V121-W123 HydrophobicContact CG1-CE3 4.1Å; V121-W123 HydrophobicContact CG1-CG 4.36Å; V121-W123 HydrophobicContact CG1-CH2 4.27Å; V121-W123 HydrophobicContact CG1-CZ2 4.05Å; V121-W123 HydrophobicContact CG1-CZ3 4.3Å; V121-W123 PolarHBondContact O-N 3.27Å
122	D	93.3	Very high	93.5	Very high	42 Å²	42	42.1 Å²	42.1	23%	0.225	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	98.5	166.1	-168.1	-33.1	0	0	0	108.9	V91 L93 E124 E125 T126	V91-D122 HydrophobicContact CB-CB 4.48Å; V91-D122 HydrophobicContact CG1-CB 4.48Å; V91-D122 PolarHBondContact O-N 2.93Å; L93-D122 HydrophobicContact CD2-CB 3.74Å; L93-D122 HydrophobicContact CG-CB 4.01Å; D122-E124 VanDerWaalsContact C-N 3.3Å; D122-E124 PolarHBondContact O-N 2.91Å; D122-E124 PolarHBondContact OD1-N 3.38Å; D122-E124 VanDerWaalsContact OD1-N 3.16Å; D122-E125 HydrophobicContact CB-CB 4.19Å; D122-E125 HydrophobicContact CB-CG 4.48Å; D122-E125 PolarHBondContact OD1-N 2.82Å; D122-T126 WeakPolarHBondContact O-CB 3.5Å; D122-T126 PolarHBondContact O-N 3.08Å; D122-T126 PolarHBondContact O-OG1 2.78Å
123	W	95.4	Very high	93.7	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.015	20%	0.195	C	C	.	.	H	α-helix	trans	-68.2	-29.2	-176.1	-69.1	105.4	0	0	0	113.2	W63 F64 F67 F90 P114 V121 T126 V127	W63-W123 HydrophobicContact CB-CB 3.58Å; F64-W123 HydrophobicContact CB-CD2 4.15Å; F64-W123 HydrophobicContact CB-CE3 4.48Å; F64-W123 HydrophobicContact CB-CG 4.29Å; F64-W123 AromaticContact CD2-CD2 3.92Å; F64-W123 HydrophobicContact CD2-CD2 3.92Å; F64-W123 AromaticContact CD2-CE2 3.69Å; F64-W123 AromaticContact CD2-CE3 3.93Å; F64-W123 HydrophobicContact CD2-CE3 3.93Å; F64-W123 AromaticContact CD2-CH2 3.53Å; F64-W123 HydrophobicContact CD2-CH2 3.53Å; F64-W123 AromaticContact CD2-CZ2 3.51Å; F64-W123 HydrophobicContact CD2-CZ2 3.51Å; F64-W123 AromaticContact CD2-CZ3 3.74Å; F64-W123 HydrophobicContact CD2-CZ3 3.74Å; F64-W123 AromaticContact CE2-CH2 3.72Å; F64-W123 HydrophobicContact CE2-CH2 3.72Å; F64-W123 AromaticContact CE2-CZ2 3.9Å; F64-W123 HydrophobicContact CE2-CZ2 3.9Å; F64-W123 HydrophobicContact CE2-CZ3 4.22Å; F67-W123 HydrophobicContact CB-CE3 4.41Å; F67-W123 HydrophobicContact CD1-CE3 4.49Å; F67-W123 AromaticContact CD1-CZ3 3.87Å; F67-W123 HydrophobicContact CD1-CZ3 3.87Å; F67-W123 HydrophobicContact CE1-CZ3 4.21Å; F67-W123 HydrophobicContact CG-CE3 4.34Å; F67-W123 HydrophobicContact CG-CZ3 4.14Å; F90-W123 HydrophobicContact CD1-CH2 4.33Å; F90-W123 HydrophobicContact CD1-CZ3 4.19Å; F90-W123 HydrophobicContact CE1-CH2 4.02Å; F90-W123 AromaticContact CE1-CZ3 3.88Å; F90-W123 HydrophobicContact CE1-CZ3 3.88Å; P114-W123 HydrophobicContact CB-CH2 4.12Å; P114-W123 HydrophobicContact CB-CZ2 4.38Å; V121-W123 HydrophobicContact CB-CZ2 4.16Å; V121-W123 HydrophobicContact CG1-CD2 3.88Å; V121-W123 HydrophobicContact CG1-CE3 4.1Å; V121-W123 HydrophobicContact CG1-CG 4.36Å; V121-W123 HydrophobicContact CG1-CH2 4.27Å; V121-W123 HydrophobicContact CG1-CZ2 4.05Å; V121-W123 HydrophobicContact CG1-CZ3 4.3Å; V121-W123 PolarHBondContact O-N 3.27Å; W123-T126 HydrophobicContact CE3-CG2 4.35Å; W123-V127 WeakPolarHBondContact O-CG2 3.44Å; W123-V127 PolarHBondContact O-N 3.16Å
124	E	95.1	Very high	93.7	Very high	49 Å²	49	37.2 Å²	37.2	23%	0.229	19%	0.188	C	C	.	.	H	α-helix	trans	-68.3	-54.9	178.4	174.8	166.1	-173.6	0	0	110.2	H59 W63 D122 T126 V127 Y128	H59-E124 IonicContact CE1-OE2 2.74Å; H59-E124 PolarHBondContact CE1-OE2 3.03Å; H59-E124 VanDerWaalsContact CE1-OE2 3.27Å; H59-E124 IonicContact NE2-OE2 2.78Å; H59-E124 PolarHBondContact NE2-OE2 2.94Å; W63-E124 HydrophobicContact CD2-CB 3.91Å; W63-E124 HydrophobicContact CD2-CG 4.14Å; W63-E124 HydrophobicContact CG-CB 4Å; W63-E124 HydrophobicContact CH2-CG 4.12Å; W63-E124 HydrophobicContact CZ2-CB 4.3Å; W63-E124 HydrophobicContact CZ2-CG 3.67Å; D122-E124 VanDerWaalsContact C-N 3.3Å; D122-E124 PolarHBondContact O-N 2.91Å; D122-E124 PolarHBondContact OD1-N 3.38Å; D122-E124 VanDerWaalsContact OD1-N 3.16Å; E124-T126 VanDerWaalsContact C-N 3.25Å; E124-T126 PolarHBondContact O-N 3.06Å; E124-V127 PolarHBondContact O-N 2.82Å; E124-V127 VanDerWaalsContact O-N 3.17Å; E124-Y128 HydrophobicContact CG-CD2 4.08Å; E124-Y128 HydrophobicContact CG-CE2 3.33Å; E124-Y128 WeakPolarHBondContact O-CD2 3.04Å; E124-Y128 PolarHBondContact O-N 2.97Å; E124-Y128 WeakPolarHBondContact OE1-CE2 3.35Å; E124-Y128 PolarHBondContact OE1-OH 3.31Å
125	E	95	Very high	93.7	Very high	51 Å²	51	37 Å²	37	24%	0.238	19%	0.186	C	C	.	.	H	α-helix	trans	-63.6	-33.9	177.7	-67.5	-71.1	117.1	0	0	111.8	V91 D122 Y128 L129 Y183	V91-E125 HydrophobicContact CB-CB 3.93Å; V91-E125 HydrophobicContact CG1-CB 3.9Å; V91-E125 HydrophobicContact CG2-CB 3.98Å; D122-E125 HydrophobicContact CB-CB 4.19Å; D122-E125 HydrophobicContact CB-CG 4.48Å; D122-E125 PolarHBondContact OD1-N 2.82Å; E125-Y128 PolarHBondContact O-N 2.79Å; E125-L129 WeakPolarHBondContact O-CB 3.06Å; E125-L129 PolarHBondContact O-N 3.04Å; E125-Y183 PolarHBondContact OE2-OH 3.27Å
126	T	96.6	Very high	93.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.3	-46.8	173.4	-68	0	0	0	0	111.6	F67 F89 F90 V91 D122 W123 E124 Y128 N130	F67-T126 HydrophobicContact CD2-CG2 3.77Å; F67-T126 HydrophobicContact CE2-CG2 3.65Å; F67-T126 HydrophobicContact CZ-CG2 4.44Å; F89-T126 WeakPolarHBondContact O-CG2 3.39Å; F90-T126 HydrophobicContact CD1-CG2 4.01Å; F90-T126 HydrophobicContact CE1-CG2 4.49Å; V91-T126 PolarHBondContact N-OG1 2.97Å; D122-T126 WeakPolarHBondContact O-CB 3.5Å; D122-T126 PolarHBondContact O-N 3.08Å; D122-T126 PolarHBondContact O-OG1 2.78Å; W123-T126 HydrophobicContact CE3-CG2 4.35Å; E124-T126 VanDerWaalsContact C-N 3.25Å; E124-T126 PolarHBondContact O-N 3.06Å; T126-Y128 VanDerWaalsContact C-N 3.35Å; T126-Y128 PolarHBondContact O-N 2.69Å; T126-N130 PolarHBondContact O-N 3.28Å; T126-N130 VanDerWaalsContact O-N 3.11Å; T126-N130 PolarHBondContact O-ND2 3.01Å
127	V	97.2	Very high	94	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.4	-44.7	176.5	167.4	0	0	0	0	110.8	I35 W63 L66 F67 F71 W123 E124 L131	I35-V127 HydrophobicContact CD1-CG1 4.21Å; W63-V127 HydrophobicContact CE3-CB 3.94Å; W63-V127 HydrophobicContact CE3-CG1 4.07Å; W63-V127 HydrophobicContact CE3-CG2 4.1Å; W63-V127 HydrophobicContact CZ3-CB 4.29Å; W63-V127 HydrophobicContact CZ3-CG1 4.04Å; L66-V127 HydrophobicContact CD2-CG1 4.07Å; L66-V127 HydrophobicContact CG-CG1 4.48Å; F67-V127 HydrophobicContact CB-CG2 3.75Å; F67-V127 HydrophobicContact CD2-CG2 4.28Å; F71-V127 HydrophobicContact CE2-CG1 4.5Å; W123-V127 WeakPolarHBondContact O-CG2 3.44Å; W123-V127 PolarHBondContact O-N 3.16Å; E124-V127 PolarHBondContact O-N 2.82Å; E124-V127 VanDerWaalsContact O-N 3.17Å; V127-L131 WeakPolarHBondContact O-CB 3.35Å; V127-L131 PolarHBondContact O-N 2.94Å
128	Y	97.2	Very high	94.5	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.008	12%	0.124	C	C	.	.	H	α-helix	trans	-59.3	-49.5	178.6	-68.7	-24.5	0	0	0	113.1	I35 R39 W63 E124 E125 T126 L131 L132 L604	I35-Y128 HydrophobicContact CG2-CE1 3.85Å; R39-Y128 PolarHBondContact NE-OH 2.84Å; R39-Y128 PolarHBondContact NH2-OH 2.82Å; W63-Y128 AromaticContact CH2-CE1 3.67Å; W63-Y128 HydrophobicContact CH2-CE1 3.67Å; W63-Y128 AromaticContact CH2-CZ 3.68Å; W63-Y128 VanDerWaalsContact CH2-OH 3.29Å; W63-Y128 WeakPolarHBondContact CH2-OH 3.31Å; W63-Y128 AromaticContact CZ3-CE1 3.86Å; W63-Y128 HydrophobicContact CZ3-CE1 3.86Å; E124-Y128 HydrophobicContact CG-CD2 4.08Å; E124-Y128 HydrophobicContact CG-CE2 3.33Å; E124-Y128 WeakPolarHBondContact O-CD2 3.04Å; E124-Y128 PolarHBondContact O-N 2.97Å; E124-Y128 WeakPolarHBondContact OE1-CE2 3.35Å; E124-Y128 PolarHBondContact OE1-OH 3.31Å; E125-Y128 PolarHBondContact O-N 2.79Å; T126-Y128 VanDerWaalsContact C-N 3.35Å; T126-Y128 PolarHBondContact O-N 2.69Å; Y128-L131 PolarHBondContact O-N 3.28Å; Y128-L132 WeakPolarHBondContact O-CG 3.17Å; Y128-L132 PolarHBondContact O-N 3.09Å; Y128-L132 VanDerWaalsContact O-N 3.11Å; Y128-L604 HydrophobicContact CD1-CD1 3.79Å; Y128-L604 HydrophobicContact CD1-CD2 4.09Å; Y128-L604 HydrophobicContact CD2-CD1 3.73Å; Y128-L604 HydrophobicContact CE1-CD1 4.42Å; Y128-L604 HydrophobicContact CE2-CD1 4.38Å; Y128-L604 HydrophobicContact CG-CD1 3.43Å; Y128-L604 VanDerWaalsContact CG-CD1 3.43Å; Y128-L604 HydrophobicContact CG-CD2 4.35Å
129	L	97.3	Very high	94.9	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.9	-49.6	-179.5	178.6	56.7	0	0	0	111.2	F89 V91 L103 E125 L131 L132 M133 P167 Y183 L186	F89-L129 HydrophobicContact CB-CD2 3.54Å; F89-L129 HydrophobicContact CB-CG 3.98Å; F89-L129 HydrophobicContact CD1-CD2 4.45Å; F89-L129 HydrophobicContact CG-CD2 4.15Å; F89-L129 HydrophobicContact CG-CG 4.38Å; V91-L129 HydrophobicContact CG2-CB 4.42Å; V91-L129 HydrophobicContact CG2-CD2 3.95Å; L103-L129 HydrophobicContact CD1-CD2 4.27Å; L103-L129 HydrophobicContact CD2-CD2 4.16Å; E125-L129 WeakPolarHBondContact O-CB 3.06Å; E125-L129 PolarHBondContact O-N 3.04Å; L129-L131 VanDerWaalsContact C-N 3.32Å; L129-L131 PolarHBondContact O-N 2.92Å; L129-L132 PolarHBondContact O-N 3.03Å; L129-M133 HydrophobicContact CD1-CG 3.84Å; L129-M133 HydrophobicContact CD1-SD 4.43Å; L129-M133 HydrophobicContact CG-CG 4.36Å; L129-M133 WeakPolarHBondContact O-CB 3.46Å; L129-M133 WeakPolarHBondContact O-CG 3.3Å; L129-M133 PolarHBondContact O-N 3.25Å; L129-P167 HydrophobicContact CD1-CB 4.3Å; L129-Y183 HydrophobicContact CB-CE2 4.36Å; L129-Y183 HydrophobicContact CD1-CD2 4.27Å; L129-Y183 HydrophobicContact CD1-CE2 4.08Å; L129-Y183 HydrophobicContact CD2-CD2 4.24Å; L129-Y183 HydrophobicContact CD2-CE2 4.14Å; L129-Y183 HydrophobicContact CG-CE2 4.43Å; L129-L186 HydrophobicContact CD1-CD2 3.86Å
130	N	96.4	Very high	95.4	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-65.8	-36	-179.3	-71.3	-82.2	0	0	0	112.3	F71 L88 F89 T126 M133 Q134	F71-N130 HydrophobicContact CD1-CB 3.96Å; F71-N130 HydrophobicContact CD2-CB 4.34Å; F71-N130 HydrophobicContact CE1-CB 3.46Å; F71-N130 VanDerWaalsContact CE1-CB 3.46Å; F71-N130 HydrophobicContact CE2-CB 3.92Å; F71-N130 HydrophobicContact CG-CB 4.37Å; F71-N130 HydrophobicContact CZ-CB 3.46Å; F71-N130 VanDerWaalsContact CZ-CB 3.46Å; L88-N130 WeakPolarHBondContact CA-OD1 3.47Å; F89-N130 PolarHBondContact N-OD1 2.88Å; F89-N130 PolarHBondContact O-ND2 3.06Å; T126-N130 PolarHBondContact O-N 3.28Å; T126-N130 VanDerWaalsContact O-N 3.11Å; T126-N130 PolarHBondContact O-ND2 3.01Å; N130-M133 PolarHBondContact O-N 3.47Å; N130-Q134 WeakPolarHBondContact O-CB 3.23Å; N130-Q134 PolarHBondContact O-N 3.05Å; N130-Q134 PolarHBondContact OD1-NE2 3.49Å
131	L	95.9	Very high	95.6	Very high	2 Å²	2	13.2 Å²	13.2	1%	0.01	7%	0.067	C	C	.	.	H	α-helix	trans	-57.6	-52.2	175.1	178.4	67.4	0	0	0	110.6	L28 I31 I35 F71 V127 Y128 L129 M133 Y135 F136 L604	L28-L131 HydrophobicContact CD1-CD1 3.68Å; I31-L131 HydrophobicContact CG2-CD1 4.14Å; I35-L131 HydrophobicContact CD1-CD2 3.69Å; F71-L131 HydrophobicContact CZ-CB 4.33Å; V127-L131 WeakPolarHBondContact O-CB 3.35Å; V127-L131 PolarHBondContact O-N 2.94Å; Y128-L131 PolarHBondContact O-N 3.28Å; L129-L131 VanDerWaalsContact C-N 3.32Å; L129-L131 PolarHBondContact O-N 2.92Å; L131-M133 VanDerWaalsContact C-N 3.31Å; L131-M133 PolarHBondContact O-N 2.74Å; L131-Y135 HydrophobicContact CD1-CD2 4.08Å; L131-Y135 HydrophobicContact CD1-CG 4.08Å; L131-Y135 WeakPolarHBondContact O-CB 3.24Å; L131-Y135 PolarHBondContact O-N 3.42Å; L131-Y135 VanDerWaalsContact O-N 3.15Å; L131-F136 HydrophobicContact CD1-CE2 4.31Å; L131-F136 HydrophobicContact CG-CE2 4.14Å; L131-L604 HydrophobicContact CD2-CD2 4.39Å
132	L	96.6	Very high	95.7	Very high	1 Å²	1	13.1 Å²	13.1	1%	0.005	7%	0.066	C	C	.	.	H	α-helix	trans	-64.8	-34.1	-179.8	-68.4	-171.4	0	0	0	113.1	Y128 L129 F136 Y138 L186 C600 I603 L604 L607	Y128-L132 WeakPolarHBondContact O-CG 3.17Å; Y128-L132 PolarHBondContact O-N 3.09Å; Y128-L132 VanDerWaalsContact O-N 3.11Å; L129-L132 PolarHBondContact O-N 3.03Å; L132-F136 HydrophobicContact CD2-CD2 4.44Å; L132-Y138 VanDerWaalsContact O-CE2 3.23Å; L132-Y138 WeakPolarHBondContact O-CE2 3.37Å; L132-Y138 PolarHBondContact O-OH 3.02Å; L132-L186 HydrophobicContact CB-CD1 4.25Å; L132-L186 HydrophobicContact CD1-CD1 3.76Å; L132-C600 HydrophobicContact CD1-CB 4.4Å; L132-C600 WeakPolarHBondContact CD1-SG 3.12Å; L132-I603 HydrophobicContact CD1-CB 3.95Å; L132-I603 HydrophobicContact CD1-CD1 4.32Å; L132-I603 HydrophobicContact CD1-CG2 3.97Å; L132-I603 HydrophobicContact CD2-CB 4.38Å; L132-I603 HydrophobicContact CD2-CG2 3.62Å; L132-I603 HydrophobicContact CG-CG2 4.43Å; L132-L604 HydrophobicContact CD1-CD2 4.25Å; L132-L604 HydrophobicContact CD1-CG 4.13Å; L132-L604 HydrophobicContact CD2-CD2 3.84Å; L132-L604 HydrophobicContact CD2-CG 4.38Å; L132-L604 HydrophobicContact CG-CD2 3.93Å; L132-L604 HydrophobicContact CG-CG 4.36Å; L132-L607 HydrophobicContact CD2-CD1 3.73Å
133	M	95.2	Very high	95.7	Very high	43 Å²	43	11.1 Å²	11.1	21%	0.212	6%	0.056	C	C	.	.	H	α-helix	trans	-77.7	-33.2	-176.9	-68.9	-66.3	-58.9	0	0	113.3	F89 L129 N130 L131 A165	F89-M133 HydrophobicContact CD2-CG 4.38Å; F89-M133 HydrophobicContact CE2-CB 4.32Å; F89-M133 HydrophobicContact CE2-CE 4.02Å; F89-M133 HydrophobicContact CE2-CG 4.26Å; F89-M133 HydrophobicContact CZ-CE 3.88Å; L129-M133 HydrophobicContact CD1-CG 3.84Å; L129-M133 HydrophobicContact CD1-SD 4.43Å; L129-M133 HydrophobicContact CG-CG 4.36Å; L129-M133 WeakPolarHBondContact O-CB 3.46Å; L129-M133 WeakPolarHBondContact O-CG 3.3Å; L129-M133 PolarHBondContact O-N 3.25Å; N130-M133 PolarHBondContact O-N 3.47Å; L131-M133 VanDerWaalsContact C-N 3.31Å; L131-M133 PolarHBondContact O-N 2.74Å; M133-A165 WeakPolarHBondContact CE-O 3.42Å; M133-A165 VanDerWaalsContact SD-C 3.59Å; M133-A165 HydrophobicContact SD-CB 3.56Å; M133-A165 VanDerWaalsContact SD-CB 3.56Å; M133-A165 VanDerWaalsContact SD-O 3.37Å
134	Q	92.9	Very high	95.7	Very high	3 Å²	3	11 Å²	11	1%	0.014	6%	0.056	C	C	.	.	H	α-helix	trans	-112.9	-29.8	-164.9	-64.1	172.5	19.6	0	0	114.3	F71 P83 G84 L87 N130 R217	F71-Q134 VanDerWaalsContact CD1-OE1 3.24Å; P83-Q134 HydrophobicContact CB-CB 4.17Å; G84-Q134 WeakPolarHBondContact CA-O 3.42Å; G84-Q134 PolarHBondContact N-O 3.12Å; G84-Q134 VanDerWaalsContact N-O 3.08Å; L87-Q134 PolarHBondContact O-NE2 2.91Å; N130-Q134 WeakPolarHBondContact O-CB 3.23Å; N130-Q134 PolarHBondContact O-N 3.05Å; N130-Q134 PolarHBondContact OD1-NE2 3.49Å; Q134-R217 PolarHBondContact O-NH2 3.23Å; Q134-R217 VanDerWaalsContact O-NH2 3.09Å
135	Y	93.7	Very high	95.5	Very high	5 Å²	5	8.7 Å²	8.7	2%	0.02	5%	0.045	C	C	.	.	S	Bend	trans	-95.6	-14.2	-174.8	-79.4	-98.4	0	0	0	114.1	L28 I31 A70 F71 L76 D81 P83 L131	L28-Y135 HydrophobicContact CB-CD1 4.08Å; L28-Y135 HydrophobicContact CB-CE1 4.47Å; L28-Y135 HydrophobicContact CD1-CD1 3.74Å; L28-Y135 HydrophobicContact CD1-CG 4.03Å; L28-Y135 HydrophobicContact CG-CD1 4.33Å; I31-Y135 HydrophobicContact CD1-CE1 3.89Å; I31-Y135 HydrophobicContact CD1-CE2 4.49Å; A70-Y135 PolarHBondContact O-OH 3.38Å; F71-Y135 AromaticContact CD1-CE2 3.96Å; F71-Y135 HydrophobicContact CD1-CE2 3.96Å; F71-Y135 AromaticContact CE1-CD2 3.93Å; F71-Y135 HydrophobicContact CE1-CD2 3.93Å; F71-Y135 AromaticContact CE1-CE2 3.5Å; F71-Y135 HydrophobicContact CE1-CE2 3.5Å; F71-Y135 HydrophobicContact CZ-CE2 4.3Å; L76-Y135 VanDerWaalsContact CD2-OH 3.24Å; L76-Y135 WeakPolarHBondContact CD2-OH 3.4Å; D81-Y135 WeakPolarHBondContact O-CE1 3.07Å; P83-Y135 HydrophobicContact CB-CE2 4.32Å; L131-Y135 HydrophobicContact CD1-CD2 4.08Å; L131-Y135 HydrophobicContact CD1-CG 4.08Å; L131-Y135 WeakPolarHBondContact O-CB 3.24Å; L131-Y135 PolarHBondContact O-N 3.42Å; L131-Y135 VanDerWaalsContact O-N 3.15Å
136	F	94.9	Very high	95.3	Very high	10 Å²	10	7.5 Å²	7.5	4%	0.044	4%	0.041	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	140.6	-176.7	-66.8	-82.4	0	0	0	112.3	L28 M32 L131 L132 Y138 A214 Y215 D216 V221 L607	L28-F136 HydrophobicContact CD1-CE2 4.37Å; L28-F136 HydrophobicContact CD1-CZ 4.29Å; L28-F136 HydrophobicContact CD2-CE1 4.32Å; L28-F136 HydrophobicContact CD2-CZ 4.12Å; M32-F136 HydrophobicContact SD-CZ 4.29Å; L131-F136 HydrophobicContact CD1-CE2 4.31Å; L131-F136 HydrophobicContact CG-CE2 4.14Å; L132-F136 HydrophobicContact CD2-CD2 4.44Å; F136-Y138 HydrophobicContact CB-CE2 3.89Å; F136-A214 HydrophobicContact CD1-CB 4.39Å; F136-Y215 CarbonylContact C-O 3.52Å; F136-Y215 VanDerWaalsContact CA-O 3.24Å; F136-Y215 WeakPolarHBondContact CA-O 3.32Å; F136-D216 HydrophobicContact CE1-CB 4.45Å; F136-V221 HydrophobicContact CE1-CG1 4.22Å; F136-L607 HydrophobicContact CD1-CD1 4Å; F136-L607 HydrophobicContact CD1-CD2 4.09Å; F136-L607 HydrophobicContact CD2-CD1 4.01Å; F136-L607 HydrophobicContact CE1-CD1 3.86Å; F136-L607 HydrophobicContact CE1-CD2 3.71Å; F136-L607 HydrophobicContact CE1-CG 4.28Å; F136-L607 HydrophobicContact CE2-CD1 3.86Å; F136-L607 HydrophobicContact CG-CD1 4.08Å; F136-L607 HydrophobicContact CZ-CB 4.38Å; F136-L607 HydrophobicContact CZ-CD1 3.79Å; F136-L607 HydrophobicContact CZ-CD2 4.25Å; F136-L607 HydrophobicContact CZ-CG 4.37Å
137	V	94.7	Very high	94.7	Very high	46 Å²	46	13.5 Å²	13.5	28%	0.279	6%	0.064	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	131.7	168.6	179.7	0	0	0	0	107.8	T162 A214 Y215	V137-T162 HydrophobicContact CG1-CG2 3.75Å; V137-A214 WeakPolarHBondContact O-CA 3.47Å; V137-Y215 PolarHBondContact N-O 2.83Å; V137-Y215 PolarHBondContact O-N 2.76Å
138	Y	97	Very high	93.9	Very high	3 Å²	3	16.7 Å²	16.7	1%	0.012	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	135.2	-177.5	-61	-92.9	0	0	0	110.4	L132 F136 T162 V163 A165 F188 L212 T213 A214 I603	L132-Y138 VanDerWaalsContact O-CE2 3.23Å; L132-Y138 WeakPolarHBondContact O-CE2 3.37Å; L132-Y138 PolarHBondContact O-OH 3.02Å; F136-Y138 HydrophobicContact CB-CE2 3.89Å; Y138-T162 CarbonylContact O-C 3.53Å; Y138-T162 WeakPolarHBondContact O-CA 3.43Å; Y138-T162 WeakPolarHBondContact O-CG2 3.18Å; Y138-V163 PolarHBondContact O-N 2.91Å; Y138-A165 HydrophobicContact CD2-CB 4.16Å; Y138-A165 HydrophobicContact CE2-CB 3.7Å; Y138-F188 HydrophobicContact CD1-CD1 4.17Å; Y138-F188 AromaticContact CD1-CE1 3.31Å; Y138-F188 HydrophobicContact CD1-CE1 3.31Å; Y138-F188 AromaticContact CD1-CZ 3.86Å; Y138-F188 HydrophobicContact CD1-CZ 3.86Å; Y138-F188 HydrophobicContact CD2-CD1 4.46Å; Y138-F188 AromaticContact CD2-CE1 3.77Å; Y138-F188 HydrophobicContact CD2-CE1 3.77Å; Y138-F188 AromaticContact CE1-CE1 3.59Å; Y138-F188 HydrophobicContact CE1-CE1 3.59Å; Y138-F188 AromaticContact CE1-CZ 3.76Å; Y138-F188 HydrophobicContact CE1-CZ 3.76Å; Y138-F188 HydrophobicContact CE2-CE1 4.05Å; Y138-F188 AromaticContact CG-CD1 3.98Å; Y138-F188 HydrophobicContact CG-CD1 3.98Å; Y138-F188 AromaticContact CG-CE1 3.4Å; Y138-F188 HydrophobicContact CG-CE1 3.4Å; Y138-F188 HydrophobicContact CG-CZ 4.36Å; Y138-F188 AromaticContact CZ-CE1 3.96Å; Y138-L212 HydrophobicContact CD1-CD1 4.48Å; Y138-T213 WeakPolarHBondContact CA-O 3.15Å; Y138-A214 HydrophobicContact CD1-CB 3.64Å; Y138-A214 HydrophobicContact CE1-CB 3.51Å; Y138-I603 HydrophobicContact CE1-CG2 4.32Å
139	V	96.5	Very high	92.9	Very high	14 Å²	14	17.4 Å²	17.4	9%	0.085	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	122.6	177.9	-175.4	0	0	0	0	108.9	T213 Y215	V139-T213 PolarHBondContact N-O 3.14Å; V139-T213 PolarHBondContact O-N 3.1Å; V139-Y215 HydrophobicContact CB-CE2 4.07Å; V139-Y215 HydrophobicContact CG2-CD2 4.1Å; V139-Y215 HydrophobicContact CG2-CE2 3.94Å
140	V	97	Very high	91.8	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	125.9	168.4	176.6	0	0	0	0	108.2	V142 S160 Q161 V163 I190 F197 V210 E211 L212 I596	V140-V142 HydrophobicContact CG1-CG2 4.22Å; V140-S160 CarbonylContact O-C 3.51Å; V140-S160 WeakPolarHBondContact O-CA 3.44Å; V140-Q161 PolarHBondContact N-O 3.31Å; V140-Q161 PolarHBondContact O-N 2.94Å; V140-V163 HydrophobicContact CB-CG1 4.37Å; V140-V163 HydrophobicContact CG2-CB 4.48Å; V140-V163 HydrophobicContact CG2-CG1 3.85Å; V140-V163 HydrophobicContact CG2-CG2 3.77Å; V140-I190 HydrophobicContact CB-CD1 4.06Å; V140-I190 HydrophobicContact CG1-CD1 3.89Å; V140-I190 HydrophobicContact CG2-CD1 4.06Å; V140-F197 HydrophobicContact CG1-CZ 4.31Å; V140-V210 HydrophobicContact CG1-CG1 4.33Å; V140-E211 CarbonylContact C-O 3.58Å; V140-E211 WeakPolarHBondContact CA-O 3.35Å; V140-L212 HydrophobicContact CG2-CD1 3.71Å; V140-I596 HydrophobicContact CG1-CD1 4.04Å; V140-I596 HydrophobicContact CG2-CD1 3.86Å
141	T	95.7	Very high	90.7	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.9	177.1	-65.3	0	0	0	0	110.7	K158 F159 S160 E211 L616 N617	T141-K158 HydrophobicContact CG2-CD 4.01Å; T141-K158 HydrophobicContact CG2-CG 3.89Å; T141-F159 CarbonylContact C-O 3.59Å; T141-F159 WeakPolarHBondContact CA-O 3.47Å; T141-S160 WeakPolarHBondContact CG2-OG 3.4Å; T141-S160 PolarHBondContact OG1-OG 3.24Å; T141-E211 PolarHBondContact N-O 2.88Å; T141-E211 PolarHBondContact O-N 3.31Å; T141-L616 HydrophobicContact CG2-CB 3.67Å; T141-L616 HydrophobicContact CG2-CD1 4.44Å; T141-N617 WeakPolarHBondContact CB-ND2 3.22Å; T141-N617 WeakPolarHBondContact CG2-OD1 3.29Å; T141-N617 PolarHBondContact OG1-ND2 3.41Å; T141-N617 PolarHBondContact OG1-OD1 3.2Å
142	V	95.7	Very high	89.7	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	125.5	-175.2	-178	0	0	0	0	108.2	V140 K158 F159 F197 I208 N209 P593	V140-V142 HydrophobicContact CG1-CG2 4.22Å; V142-K158 CarbonylContact O-C 3.58Å; V142-K158 WeakPolarHBondContact O-CA 3.37Å; V142-F159 HydrophobicContact CB-CB 4.47Å; V142-F159 PolarHBondContact N-O 3.09Å; V142-F159 PolarHBondContact O-N 3.13Å; V142-F197 HydrophobicContact CB-CD1 4.14Å; V142-F197 HydrophobicContact CB-CE1 3.89Å; V142-F197 HydrophobicContact CG2-CD1 3.93Å; V142-F197 HydrophobicContact CG2-CE1 3.4Å; V142-F197 HydrophobicContact CG2-CE2 4.46Å; V142-F197 HydrophobicContact CG2-CZ 3.71Å; V142-I208 HydrophobicContact CG1-CD1 3.57Å; V142-I208 HydrophobicContact CG1-CG1 3.57Å; V142-N209 CarbonylContact C-O 3.5Å; V142-N209 VanDerWaalsContact CA-O 3.24Å; V142-N209 WeakPolarHBondContact CA-O 3.2Å; V142-P593 HydrophobicContact CG2-CG 3.64Å
143	A	94.5	Very high	89	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	124.4	176.8	0	0	0	0	0	110.8	I155 K157 N209 L616	A143-I155 HydrophobicContact CB-CG2 4.16Å; A143-K157 CarbonylContact C-O 3.56Å; A143-K157 VanDerWaalsContact CA-O 3.28Å; A143-K157 WeakPolarHBondContact CA-O 3.33Å; A143-N209 HydrophobicContact CB-CB 4.4Å; A143-N209 PolarHBondContact N-O 2.84Å; A143-N209 PolarHBondContact O-N 2.94Å; A143-N209 PolarHBondContact O-ND2 3.26Å; A143-L616 HydrophobicContact CB-CD1 3.93Å; A143-L616 HydrophobicContact CB-CD2 3.89Å; A143-L616 HydrophobicContact CB-CG 4.44Å
144	V	94.5	Very high	88.6	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.012	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	125.6	166.6	-179.2	0	0	0	0	107	L156 K157 F159 E206 C207	V144-L156 HydrophobicContact CG1-CB 4.42Å; V144-L156 HydrophobicContact CG1-CD1 4.36Å; V144-L156 PolarHBondContact O-N 2.83Å; V144-K157 HydrophobicContact CB-CB 4.37Å; V144-K157 PolarHBondContact N-O 3.31Å; V144-K157 PolarHBondContact O-N 2.81Å; V144-F159 HydrophobicContact CG2-CE2 4.48Å; V144-E206 HydrophobicContact CG1-CB 4.32Å; V144-C207 CarbonylContact C-O 3.55Å; V144-C207 WeakPolarHBondContact CA-O 3.44Å
145	C	91.8	Very high	88.5	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	151.8	-177.9	-63.3	0	0	0	0	111.4	W153 Q154 E206 C207 N209	C145-W153 HydrophobicContact CB-CB 4.48Å; C145-W153 HydrophobicContact CB-CE3 4.24Å; C145-Q154 CarbonylContact C-O 3.5Å; C145-Q154 VanDerWaalsContact CA-O 3.23Å; C145-Q154 WeakPolarHBondContact CA-O 3.38Å; C145-E206 CarbonylContact O-C 3.54Å; C145-E206 VanDerWaalsContact O-CA 3.27Å; C145-E206 WeakPolarHBondContact O-CA 3.4Å; C145-C207 PolarHBondContact N-O 2.95Å; C145-C207 PolarHBondContact O-N 2.84Å; C145-N209 PolarHBondContact SG-ND2 2.97Å
146	T	89.7	Confident	88.4	Confident	26 Å²	26	37.7 Å²	37.7	16%	0.16	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	151.1	171.7	-166.4	0	0	0	0	111.2	T148 W153 Q154 L156 S205	T146-T148 PolarHBondContact O-N 3.39Å; T146-W153 CarbonylContact O-C 3.54Å; T146-W153 WeakPolarHBondContact O-CA 3.5Å; T146-Q154 HydrophobicContact CG2-CB 4.45Å; T146-Q154 PolarHBondContact N-O 3.29Å; T146-Q154 PolarHBondContact O-N 3.18Å; T146-L156 HydrophobicContact CG2-CD1 3.99Å; T146-L156 HydrophobicContact CG2-CD2 3.68Å; T146-L156 HydrophobicContact CG2-CG 3.89Å; T146-S205 PolarHBondContact OG1-O 3.26Å
147	R	84.2	Confident	88.3	Confident	126 Å²	126	41.5 Å²	41.5	48%	0.475	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	112.5	-176.5	-169.9	177.5	-178.9	-153.7	9.1	110.9	G149 P150 W153	R147-G149 WeakPolarHBondContact CG-O 3.23Å; R147-G149 PolarHBondContact NE-O 2.87Å; R147-P150 PolarHBondContact NE-O 3.19Å; R147-P150 PolarHBondContact NH2-O 3.09Å; R147-W153 HydrophobicContact CB-CD2 4.02Å; R147-W153 HydrophobicContact CB-CE3 3.9Å; R147-W153 HydrophobicContact CB-CH2 3.77Å; R147-W153 HydrophobicContact CB-CZ2 3.87Å; R147-W153 HydrophobicContact CB-CZ3 3.76Å; R147-W153 HydrophobicContact CG-CD2 4.33Å; R147-W153 HydrophobicContact CG-CH2 4.36Å; R147-W153 HydrophobicContact CG-CZ2 3.96Å
148	T	81.1	Confident	88.2	Confident	68 Å²	68	42.1 Å²	42.1	42%	0.417	21%	0.21	S	C	.	.			trans	-93.3	-29.6	175.4	48.6	0	0	0	0	112.3	T146 E152 Q154	T146-T148 PolarHBondContact O-N 3.39Å; T148-E152 PolarHBondContact N-O 3.5Å; T148-E152 PolarHBondContact OG1-O 2.93Å; T148-Q154 HydrophobicContact CG2-CB 3.56Å
149	G	76	Confident	88.1	Confident	16 Å²	16	43.5 Å²	43.5	17%	0.165	22%	0.216	C	C	.	.	S	Bend	trans	-140.8	-175.4	179.4	0	0	0	0	0	113.8	R147 Q151 E152	R147-G149 WeakPolarHBondContact CG-O 3.23Å; R147-G149 PolarHBondContact NE-O 2.87Å; G149-Q151 PolarHBondContact O-N 3.37Å; G149-E152 PolarHBondContact N-O 3.49Å
150	P	73.7	Confident	88	Confident	109 Å²	109	44.3 Å²	44.3	71%	0.708	22%	0.222	S	C	*	.	S	Bend	trans	-54.2	-41.1	178.8	-27.4	35.5	0	0	0	113.3	R147	R147-P150 PolarHBondContact NE-O 3.19Å; R147-P150 PolarHBondContact NH2-O 3.09Å
151	Q	73.3	Confident	87.9	Confident	90 Å²	90	46.6 Å²	46.6	42%	0.421	23%	0.233	S	C	.	.	S	Bend	trans	-130.1	5.7	179	-64.3	-178.9	-36.3	0	0	112.9	G149 H406 M407 D408	G149-Q151 PolarHBondContact O-N 3.37Å; Q151-H406 PolarHBondContact OE1-NE2 3.28Å; Q151-M407 PolarHBondContact O-N 3.26Å; Q151-D408 PolarHBondContact NE2-OD1 2.9Å; Q151-D408 PolarHBondContact NE2-OD2 3.39Å
152	E	75	Confident	87.9	Confident	100 Å²	100	49.1 Å²	49.1	47%	0.467	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	129	-177.8	-65.5	178.7	-176.9	0	0	110.2	T148 G149	T148-E152 PolarHBondContact N-O 3.5Å; T148-E152 PolarHBondContact OG1-O 2.93Å; G149-E152 PolarHBondContact N-O 3.49Å
153	W	82.8	Confident	87.9	Confident	46 Å²	46	49.4 Å²	49.4	17%	0.174	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	126.6	-178.9	-69	75.5	0	0	0	109.8	C145 T146 R147 C207 N404 I405 M407	C145-W153 HydrophobicContact CB-CB 4.48Å; C145-W153 HydrophobicContact CB-CE3 4.24Å; T146-W153 CarbonylContact O-C 3.54Å; T146-W153 WeakPolarHBondContact O-CA 3.5Å; R147-W153 HydrophobicContact CB-CD2 4.02Å; R147-W153 HydrophobicContact CB-CE3 3.9Å; R147-W153 HydrophobicContact CB-CH2 3.77Å; R147-W153 HydrophobicContact CB-CZ2 3.87Å; R147-W153 HydrophobicContact CB-CZ3 3.76Å; R147-W153 HydrophobicContact CG-CD2 4.33Å; R147-W153 HydrophobicContact CG-CH2 4.36Å; R147-W153 HydrophobicContact CG-CZ2 3.96Å; W153-C207 HydrophobicContact CZ3-CB 4.3Å; W153-C207 WeakPolarHBondContact CZ3-SG 3.47Å; W153-N404 CarbonylContact O-C 3.51Å; W153-N404 VanDerWaalsContact O-CA 3.28Å; W153-N404 WeakPolarHBondContact O-CA 3.14Å; W153-I405 PolarHBondContact N-O 2.78Å; W153-I405 PolarHBondContact O-N 3.47Å; W153-M407 HydrophobicContact CB-CG 4.15Å; W153-M407 HydrophobicContact CD2-CE 3.93Å; W153-M407 HydrophobicContact CD2-CG 3.82Å; W153-M407 HydrophobicContact CE3-CE 4.15Å; W153-M407 HydrophobicContact CG-CB 4.38Å; W153-M407 HydrophobicContact CG-CE 4.22Å; W153-M407 HydrophobicContact CG-CG 3.4Å; W153-M407 VanDerWaalsContact CG-CG 3.4Å
154	Q	87	Confident	88	Confident	68 Å²	68	58.4 Å²	58.4	32%	0.318	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	129.5	175.4	-176.1	179.7	16.2	0	0	109	C145 T146 T148 L156	C145-Q154 CarbonylContact C-O 3.5Å; C145-Q154 VanDerWaalsContact CA-O 3.23Å; C145-Q154 WeakPolarHBondContact CA-O 3.38Å; T146-Q154 HydrophobicContact CG2-CB 4.45Å; T146-Q154 PolarHBondContact N-O 3.29Å; T146-Q154 PolarHBondContact O-N 3.18Å; T148-Q154 HydrophobicContact CG2-CB 3.56Å; Q154-L156 PolarHBondContact O-N 2.77Å
155	I	90.8	Very high	88	Confident	7 Å²	7	58.7 Å²	58.7	4%	0.036	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	129.8	167.6	-55.3	174.6	0	0	0	107.7	A143 K158 L402 I405	A143-I155 HydrophobicContact CB-CG2 4.16Å; I155-K158 HydrophobicContact CG2-CB 4.41Å; I155-L402 HydrophobicContact CB-CB 4.26Å; I155-L402 HydrophobicContact CB-CD2 4.22Å; I155-L402 HydrophobicContact CG2-CD2 4.05Å; I155-L402 WeakPolarHBondContact O-CB 3.19Å; I155-L402 WeakPolarHBondContact O-CD1 3.35Å; I155-L402 WeakPolarHBondContact O-CG 3.24Å; I155-I405 HydrophobicContact CD1-CD1 3.63Å; I155-I405 HydrophobicContact CD1-CG1 4.16Å; I155-I405 HydrophobicContact CG1-CD1 3.49Å; I155-I405 VanDerWaalsContact CG1-CD1 3.49Å; I155-I405 HydrophobicContact CG1-CG1 4.1Å
156	L	90.3	Very high	88.2	Confident	60 Å²	60	59.9 Å²	59.9	31%	0.314	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-41.4	174.5	-66	-177.5	0	0	0	111.6	V144 T146 Q154 E206 L402	V144-L156 HydrophobicContact CG1-CB 4.42Å; V144-L156 HydrophobicContact CG1-CD1 4.36Å; V144-L156 PolarHBondContact O-N 2.83Å; T146-L156 HydrophobicContact CG2-CD1 3.99Å; T146-L156 HydrophobicContact CG2-CD2 3.68Å; T146-L156 HydrophobicContact CG2-CG 3.89Å; Q154-L156 PolarHBondContact O-N 2.77Å; L156-E206 HydrophobicContact CD1-CG 3.98Å; L156-L402 WeakPolarHBondContact O-CD1 3.44Å
157	K	92.2	Very high	88.5	Confident	91 Å²	91	58.9 Å²	58.9	40%	0.396	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	147.3	178.1	-64.6	-167	179.3	-168.7	0	109.7	A143 V144 F159 E199	A143-K157 CarbonylContact C-O 3.56Å; A143-K157 VanDerWaalsContact CA-O 3.28Å; A143-K157 WeakPolarHBondContact CA-O 3.33Å; V144-K157 HydrophobicContact CB-CB 4.37Å; V144-K157 PolarHBondContact N-O 3.31Å; V144-K157 PolarHBondContact O-N 2.81Å; K157-F159 HydrophobicContact CB-CE2 3.74Å; K157-F159 HydrophobicContact CB-CZ 3.89Å; K157-F159 HydrophobicContact CD-CE2 4.29Å; K157-F159 HydrophobicContact CD-CZ 3.75Å; K157-F159 HydrophobicContact CG-CZ 4.48Å; K157-E199 PolarHBondContact NZ-O 2.9Å
158	K	93.2	Very high	88.8	Confident	59 Å²	59	53.5 Å²	53.5	26%	0.257	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	136.5	175.2	-169	174.7	82.1	173.9	0	109.9	T141 V142 I155 L616	T141-K158 HydrophobicContact CG2-CD 4.01Å; T141-K158 HydrophobicContact CG2-CG 3.89Å; V142-K158 CarbonylContact O-C 3.58Å; V142-K158 WeakPolarHBondContact O-CA 3.37Å; I155-K158 HydrophobicContact CG2-CB 4.41Å; K158-L616 WeakPolarHBondContact CD-O 3.34Å; K158-L616 PolarHBondContact NZ-O 3.19Å
159	F	94.4	Very high	89.2	Confident	32 Å²	32	51.2 Å²	51.2	14%	0.14	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	136.3	177.2	-50.6	-84.3	0	0	0	108.3	T141 V142 V144 K157 F197 E199 C200	T141-F159 CarbonylContact C-O 3.59Å; T141-F159 WeakPolarHBondContact CA-O 3.47Å; V142-F159 HydrophobicContact CB-CB 4.47Å; V142-F159 PolarHBondContact N-O 3.09Å; V142-F159 PolarHBondContact O-N 3.13Å; V144-F159 HydrophobicContact CG2-CE2 4.48Å; K157-F159 HydrophobicContact CB-CE2 3.74Å; K157-F159 HydrophobicContact CB-CZ 3.89Å; K157-F159 HydrophobicContact CD-CE2 4.29Å; K157-F159 HydrophobicContact CD-CZ 3.75Å; K157-F159 HydrophobicContact CG-CZ 4.48Å; F159-F197 HydrophobicContact CB-CD1 3.65Å; F159-F197 HydrophobicContact CB-CE1 3.79Å; F159-F197 HydrophobicContact CG-CD1 4.22Å; F159-E199 HydrophobicContact CE1-CB 3.87Å; F159-E199 HydrophobicContact CZ-CB 3.95Å; F159-C200 HydrophobicContact CD2-CB 4.14Å; F159-C200 HydrophobicContact CE2-CB 3.77Å; F159-C200 HydrophobicContact CZ-CB 4.35Å
160	S	95	Very high	89.6	Confident	30 Å²	30	54.3 Å²	54.3	21%	0.21	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	133.7	179	-60.4	0	0	0	0	109.4	V140 T141 N617	V140-S160 CarbonylContact O-C 3.51Å; V140-S160 WeakPolarHBondContact O-CA 3.44Å; T141-S160 WeakPolarHBondContact CG2-OG 3.4Å; T141-S160 PolarHBondContact OG1-OG 3.24Å; S160-N617 PolarHBondContact OG-OD1 3.27Å
161	Q	95.1	Very high	89.8	Confident	49 Å²	49	53 Å²	53	23%	0.229	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	124.4	-178.7	179.3	59.2	65.2	0	0	109.2	V140 V163 I190 N192 A196 F197	V140-Q161 PolarHBondContact N-O 3.31Å; V140-Q161 PolarHBondContact O-N 2.94Å; Q161-V163 HydrophobicContact CG-CG1 4.42Å; Q161-I190 HydrophobicContact CG-CG2 4.04Å; Q161-N192 PolarHBondContact OE1-ND2 3.43Å; Q161-A196 HydrophobicContact CB-CB 4.38Å; Q161-A196 HydrophobicContact CG-CB 4.2Å; Q161-F197 HydrophobicContact CB-CZ 4.05Å
162	T	95.8	Very high	89.9	Confident	52 Å²	52	49.8 Å²	49.8	32%	0.319	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	135.9	170.7	-54.2	0	0	0	0	109.4	V137 Y138	V137-T162 HydrophobicContact CG1-CG2 3.75Å; Y138-T162 CarbonylContact O-C 3.53Å; Y138-T162 WeakPolarHBondContact O-CA 3.43Å; Y138-T162 WeakPolarHBondContact O-CG2 3.18Å
163	V	96.1	Very high	89.7	Confident	6 Å²	6	48 Å²	48	4%	0.036	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	165	-177.4	-61.8	0	0	0	0	109.9	Y138 V140 Q161 F188 I190 L212	Y138-V163 PolarHBondContact O-N 2.91Å; V140-V163 HydrophobicContact CB-CG1 4.37Å; V140-V163 HydrophobicContact CG2-CB 4.48Å; V140-V163 HydrophobicContact CG2-CG1 3.85Å; V140-V163 HydrophobicContact CG2-CG2 3.77Å; Q161-V163 HydrophobicContact CG-CG1 4.42Å; V163-F188 HydrophobicContact CG2-CB 4.02Å; V163-F188 HydrophobicContact CG2-CD1 3.95Å; V163-F188 HydrophobicContact CG2-CG 4.43Å; V163-I190 HydrophobicContact CG1-CD1 4.32Å; V163-I190 HydrophobicContact CG1-CG1 3.79Å; V163-L212 HydrophobicContact CG2-CD1 4.06Å
164	Y	95.3	Very high	88.8	Confident	190 Å²	190	51.2 Å²	51.2	75%	0.745	25%	0.245	S	C	*	.			trans	-112	138.2	177.1	-59.7	-81.6	0	0	0	109.9
165	A	96.1	Very high	87.4	Confident	8 Å²	8	57.2 Å²	57.2	7%	0.066	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	144	165.4	0	0	0	0	0	109	M133 Y138 L186 Y187 F188	M133-A165 WeakPolarHBondContact CE-O 3.42Å; M133-A165 VanDerWaalsContact SD-C 3.59Å; M133-A165 HydrophobicContact SD-CB 3.56Å; M133-A165 VanDerWaalsContact SD-CB 3.56Å; M133-A165 VanDerWaalsContact SD-O 3.37Å; Y138-A165 HydrophobicContact CD2-CB 4.16Å; Y138-A165 HydrophobicContact CE2-CB 3.7Å; A165-L186 HydrophobicContact CB-CD1 4.37Å; A165-Y187 CarbonylContact C-O 3.56Å; A165-F188 HydrophobicContact CB-CD1 4.3Å; A165-F188 HydrophobicContact CB-CE1 3.55Å; A165-F188 HydrophobicContact CB-CZ 3.97Å
166	S	95.5	Very high	85.9	Confident	25 Å²	25	59 Å²	59	18%	0.175	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	132.7	173.5	-173.4	0	0	0	0	111.3	S168 L186 Y187	S166-S168 WeakPolarHBondContact CB-O 3.21Å; S166-S168 PolarHBondContact O-N 3.25Å; S166-S168 PolarHBondContact OG-N 2.89Å; S166-S168 PolarHBondContact OG-O 2.85Å; S166-S168 PolarHBondContact OG-OG 3.34Å; S166-L186 WeakPolarHBondContact O-CA 3.31Å; S166-Y187 PolarHBondContact N-O 3.43Å; S166-Y187 PolarHBondContact O-N 3.34Å
167	P	95.1	Very high	84.7	Confident	5 Å²	5	62.2 Å²	62.2	3%	0.032	32%	0.317	C	S	.	.	S	Bend	trans	-77.5	-0.5	170.5	34	-35.1	0	0	0	112.9	F89 L103 L129 V182 Y183 L186	F89-P167 HydrophobicContact CD1-CG 3.96Å; F89-P167 HydrophobicContact CE1-CG 3.75Å; L103-P167 HydrophobicContact CD1-CB 3.69Å; L103-P167 HydrophobicContact CD1-CG 4.12Å; L129-P167 HydrophobicContact CD1-CB 4.3Å; P167-V182 VanDerWaalsContact O-CG2 3.3Å; P167-V182 WeakPolarHBondContact O-CG2 3.14Å; P167-V182 PolarHBondContact O-N 2.84Å; P167-Y183 PolarHBondContact O-N 3.23Å; P167-L186 HydrophobicContact CB-CD2 4.12Å
168	S	91.6	Very high	83.9	Confident	12 Å²	12	65.5 Å²	65.5	8%	0.084	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	153.1	179.4	58.4	0	0	0	0	111.4	S166 E179 E180	S166-S168 WeakPolarHBondContact CB-O 3.21Å; S166-S168 PolarHBondContact O-N 3.25Å; S166-S168 PolarHBondContact OG-N 2.89Å; S166-S168 PolarHBondContact OG-O 2.85Å; S166-S168 PolarHBondContact OG-OG 3.34Å; S168-E179 WeakPolarHBondContact CB-OE1 3.45Å; S168-E179 PolarHBondContact OG-OE1 2.93Å; S168-E180 CarbonylContact C-O 3.54Å; S168-E180 VanDerWaalsContact CA-O 3.24Å; S168-E180 WeakPolarHBondContact CA-O 3.3Å
169	H	89	Confident	83.5	Confident	20 Å²	20	68.6 Å²	68.6	9%	0.093	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	140.2	-179.1	167.8	-108	0	0	0	111.6	E180 V182 Y187	H169-E180 PolarHBondContact N-O 3.07Å; H169-E180 PolarHBondContact O-N 2.87Å; H169-V182 HydrophobicContact CB-CB 4.48Å; H169-V182 HydrophobicContact CB-CG1 3.83Å; H169-V182 HydrophobicContact CB-CG2 3.83Å; H169-Y187 HydrophobicContact CB-CD1 3.9Å; H169-Y187 HydrophobicContact CB-CD2 3.96Å; H169-Y187 HydrophobicContact CB-CE1 4.01Å; H169-Y187 HydrophobicContact CB-CE2 4.09Å; H169-Y187 HydrophobicContact CB-CG 3.85Å; H169-Y187 AromaticContact CD2-CD1 3.17Å; H169-Y187 WeakPolarHBondContact CD2-CD1 3.5Å; H169-Y187 AromaticContact CD2-CE1 3.19Å; H169-Y187 WeakPolarHBondContact CD2-CE1 3.36Å; H169-Y187 AromaticContact CG-CD1 3.66Å; H169-Y187 AromaticContact CG-CE1 3.49Å; H169-Y187 VanDerWaalsContact CG-CE1 3.49Å; H169-Y187 AromaticContact CG-CZ 3.88Å; H169-Y187 AromaticContact NE2-CD1 3.99Å; H169-Y187 AromaticContact NE2-CE1 3.62Å
170	R	84.2	Confident	83.2	Confident	81 Å²	81	70 Å²	70	31%	0.306	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	140.9	171.1	64.9	-175.4	-169.3	82	-12.7	109.8	D191	R170-D191 IonicContact CZ-OD1 3.71Å; R170-D191 IonicContact CZ-OD2 3.13Å; R170-D191 IonicContact NE-OD1 3.85Å; R170-D191 IonicContact NE-OD2 2.79Å; R170-D191 IonicContact NH2-OD1 3.06Å; R170-D191 PolarHBondContact NH2-OD1 3.26Å; R170-D191 IonicContact NH2-OD2 3.33Å; R170-D191 PolarHBondContact NH2-OD2 3.08Å
171	Q	78.6	Confident	82.9	Confident	83 Å²	83	72.3 Å²	72.3	39%	0.388	36%	0.36	S	S	.	.			trans	-75.1	130	-178.9	-59.6	-174.2	-2.6	0	0	111.6	N173 M174	Q171-N173 VanDerWaalsContact CB-OD1 3.3Å; Q171-N173 WeakPolarHBondContact CB-OD1 3.33Å; Q171-M174 PolarHBondContact O-N 3.08Å; Q171-M174 PolarHBondContact OE1-SD 3.47Å; Q171-M174 VanDerWaalsContact OE1-SD 3.41Å
172	M	74.2	Confident	82.7	Confident	22 Å²	22	71.2 Å²	71.2	11%	0.108	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-22.3	-177.2	-66.7	-58.7	-72.3	0	0	114.4	M174 Y193 F283	M172-M174 VanDerWaalsContact C-N 3.28Å; M172-M174 PolarHBondContact O-N 3.47Å; M172-Y193 HydrophobicContact CE-CD1 3.67Å; M172-Y193 HydrophobicContact CE-CE1 3.7Å; M172-F283 HydrophobicContact CB-CE1 4.49Å
173	N	70.6	Confident	82.6	Confident	61 Å²	61	69.3 Å²	69.3	33%	0.326	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-9.2	177.3	66.2	-22.1	0	0	0	113.4	Q171 F283 A423	Q171-N173 VanDerWaalsContact CB-OD1 3.3Å; Q171-N173 WeakPolarHBondContact CB-OD1 3.33Å; N173-F283 HydrophobicContact CB-CD2 4.36Å; N173-F283 HydrophobicContact CB-CE2 4.11Å; N173-A423 HydrophobicContact CB-CB 4.46Å
174	M	64.8	Low	82.4	Confident	114 Å²	114	72.2 Å²	72.2	56%	0.562	36%	0.362	S	S	*	.	S	Bend	trans	-118.3	120.2	-179.6	-71.1	179.2	61.1	0	0	109.1	Q171 M172 G176	Q171-M174 PolarHBondContact O-N 3.08Å; Q171-M174 PolarHBondContact OE1-SD 3.47Å; Q171-M174 VanDerWaalsContact OE1-SD 3.41Å; M172-M174 VanDerWaalsContact C-N 3.28Å; M172-M174 PolarHBondContact O-N 3.47Å; M174-G176 PolarHBondContact O-N 3.41Å
175	K	58.1	Low	82.4	Confident	195 Å²	195	65.9 Å²	65.9	85%	0.848	34%	0.342	S	S	*	.			trans	-73.8	82.3	167.1	-168.4	172.8	-176.2	175.2	0	108
176	G	58.5	Low	82.4	Confident	44 Å²	44	65.5 Å²	65.5	45%	0.454	34%	0.339	S	S	.	.	S	Bend	trans	-153.2	153.9	-176.8	0	0	0	0	0	111.9	M174 Y178	M174-G176 PolarHBondContact O-N 3.41Å; G176-Y178 VanDerWaalsContact C-N 3.26Å; G176-Y178 PolarHBondContact O-N 3.39Å
177	S	64.4	Low	82.4	Confident	127 Å²	127	65.4 Å²	65.4	89%	0.888	33%	0.334	S	S	*	.			trans	-88.5	17.9	-179.9	60.8	0	0	0	0	113.1	E179	S177-E179 PolarHBondContact O-N 2.8Å
178	Y	76.7	Confident	82.5	Confident	161 Å²	161	65.1 Å²	65.1	63%	0.631	33%	0.333	S	S	*	.			trans	-79.2	116.7	178.8	-176.6	-97.9	0	0	0	109.3	G176 E180	G176-Y178 VanDerWaalsContact C-N 3.26Å; G176-Y178 PolarHBondContact O-N 3.39Å; Y178-E180 HydrophobicContact CE1-CB 3.97Å
179	E	83.9	Confident	82.7	Confident	124 Å²	124	66.1 Å²	66.1	58%	0.579	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	127.1	-179.8	-177.6	169.4	-157.4	0	0	108.1	S168 S177	S168-E179 WeakPolarHBondContact CB-OE1 3.45Å; S168-E179 PolarHBondContact OG-OE1 2.93Å; S177-E179 PolarHBondContact O-N 2.8Å
180	E	88.1	Confident	82.9	Confident	61 Å²	61	65.2 Å²	65.2	29%	0.285	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	136.5	179.1	179.9	175.9	-166.5	0	0	109.5	K100 S168 H169 Y178 V182	K100-E180 IonicContact NZ-OE1 3.27Å; K100-E180 PolarHBondContact NZ-OE1 2.74Å; S168-E180 CarbonylContact C-O 3.54Å; S168-E180 VanDerWaalsContact CA-O 3.24Å; S168-E180 WeakPolarHBondContact CA-O 3.3Å; H169-E180 PolarHBondContact N-O 3.07Å; H169-E180 PolarHBondContact O-N 2.87Å; Y178-E180 HydrophobicContact CE1-CB 3.97Å; E180-V182 HydrophobicContact CG-CG1 4.4Å; E180-V182 PolarHBondContact O-N 2.83Å
181	I	89.6	Confident	83.2	Confident	78 Å²	78	65.5 Å²	65.5	40%	0.4	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	122.4	169.6	-57	-57.1	0	0	0	109	L103	L103-I181 HydrophobicContact CD1-CG2 3.8Å; L103-I181 HydrophobicContact CG-CG2 4.04Å
182	V	91.3	Very high	83.8	Confident	26 Å²	26	64.5 Å²	64.5	16%	0.158	34%	0.339	C	S	.	.			trans	-119.4	3.3	-173.1	-70.9	0	0	0	0	113.4	P167 H169 E180 D185 Y187	P167-V182 VanDerWaalsContact O-CG2 3.3Å; P167-V182 WeakPolarHBondContact O-CG2 3.14Å; P167-V182 PolarHBondContact O-N 2.84Å; H169-V182 HydrophobicContact CB-CB 4.48Å; H169-V182 HydrophobicContact CB-CG1 3.83Å; H169-V182 HydrophobicContact CB-CG2 3.83Å; E180-V182 HydrophobicContact CG-CG1 4.4Å; E180-V182 PolarHBondContact O-N 2.83Å; V182-D185 CarbonylContact C-O 3.51Å; V182-D185 WeakPolarHBondContact O-CB 2.88Å; V182-D185 PolarHBondContact O-N 3.44Å; V182-Y187 HydrophobicContact CB-CD2 4.22Å; V182-Y187 HydrophobicContact CB-CE2 3.86Å; V182-Y187 HydrophobicContact CG1-CE2 4.17Å; V182-Y187 HydrophobicContact CG2-CD2 3.39Å; V182-Y187 HydrophobicContact CG2-CE2 3.55Å; V182-Y187 HydrophobicContact CG2-CG 4.4Å
183	Y	93.1	Very high	84.7	Confident	12 Å²	12	64.5 Å²	64.5	5%	0.047	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.9	138.8	169.9	-167.2	-96.7	0	0	0	111	V91 P101 L103 E125 L129 P167 C600	V91-Y183 HydrophobicContact CG1-CD1 4.46Å; V91-Y183 HydrophobicContact CG1-CE1 3.93Å; V91-Y183 HydrophobicContact CG2-CE1 4.28Å; P101-Y183 HydrophobicContact CB-CD1 4Å; P101-Y183 HydrophobicContact CG-CD1 4Å; P101-Y183 WeakPolarHBondContact CG-O 3.38Å; L103-Y183 HydrophobicContact CD1-CG 4.39Å; L103-Y183 HydrophobicContact CD2-CD1 4.4Å; L103-Y183 HydrophobicContact CD2-CG 4.35Å; E125-Y183 PolarHBondContact OE2-OH 3.27Å; L129-Y183 HydrophobicContact CB-CE2 4.36Å; L129-Y183 HydrophobicContact CD1-CD2 4.27Å; L129-Y183 HydrophobicContact CD1-CE2 4.08Å; L129-Y183 HydrophobicContact CD2-CD2 4.24Å; L129-Y183 HydrophobicContact CD2-CE2 4.14Å; L129-Y183 HydrophobicContact CG-CE2 4.43Å; P167-Y183 PolarHBondContact O-N 3.23Å; Y183-C600 HydrophobicContact CE2-CB 4.27Å
184	P	92.5	Very high	85.6	Confident	67 Å²	67	66.9 Å²	66.9	44%	0.435	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	cis	-82.2	3.7	11.5	35.7	-38.1	0	0	0	115.6	C600	P184-C600 VanDerWaalsContact O-CB 3.31Å; P184-C600 WeakPolarHBondContact O-CB 3.41Å; P184-C600 PolarHBondContact O-N 2.8Å
185	D	93.7	Very high	86.8	Confident	58 Å²	58	69.3 Å²	69.3	31%	0.31	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	137.9	173.4	-66.1	-34.5	0	0	0	110.5	V182 Y187 P599	V182-D185 CarbonylContact C-O 3.51Å; V182-D185 WeakPolarHBondContact O-CB 2.88Å; V182-D185 PolarHBondContact O-N 3.44Å; D185-Y187 HydrophobicContact CB-CE2 4.4Å; D185-P599 WeakPolarHBondContact OD1-CA 3.47Å; D185-P599 WeakPolarHBondContact OD1-CG 3.39Å
186	L	96.8	Very high	88.3	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	143.4	169.1	-62.4	-175.4	0	0	0	109.6	L129 L132 A165 S166 P167 F188 T597 L598 C600 I603	L129-L186 HydrophobicContact CD1-CD2 3.86Å; L132-L186 HydrophobicContact CB-CD1 4.25Å; L132-L186 HydrophobicContact CD1-CD1 3.76Å; A165-L186 HydrophobicContact CB-CD1 4.37Å; S166-L186 WeakPolarHBondContact O-CA 3.31Å; P167-L186 HydrophobicContact CB-CD2 4.12Å; L186-F188 HydrophobicContact CB-CE2 4.12Å; L186-F188 HydrophobicContact CB-CZ 4.35Å; L186-T597 WeakPolarHBondContact O-CA 3.49Å; L186-T597 WeakPolarHBondContact O-CB 3.33Å; L186-T597 PolarHBondContact O-OG1 2.78Å; L186-L598 PolarHBondContact N-O 2.84Å; L186-L598 PolarHBondContact O-N 3.28Å; L186-C600 HydrophobicContact CG-CB 4.47Å; L186-I603 HydrophobicContact CB-CD1 4.19Å; L186-I603 HydrophobicContact CD1-CD1 3.88Å; L186-I603 HydrophobicContact CG-CD1 4.4Å
187	Y	96.1	Very high	90	Very high	22 Å²	22	59 Å²	59	9%	0.086	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	142.1	175.7	-84.1	-109.8	0	0	0	110.4	A165 S166 H169 V182 D185 F595 T597	A165-Y187 CarbonylContact C-O 3.56Å; S166-Y187 PolarHBondContact N-O 3.43Å; S166-Y187 PolarHBondContact O-N 3.34Å; H169-Y187 HydrophobicContact CB-CD1 3.9Å; H169-Y187 HydrophobicContact CB-CD2 3.96Å; H169-Y187 HydrophobicContact CB-CE1 4.01Å; H169-Y187 HydrophobicContact CB-CE2 4.09Å; H169-Y187 HydrophobicContact CB-CG 3.85Å; H169-Y187 AromaticContact CD2-CD1 3.17Å; H169-Y187 WeakPolarHBondContact CD2-CD1 3.5Å; H169-Y187 AromaticContact CD2-CE1 3.19Å; H169-Y187 WeakPolarHBondContact CD2-CE1 3.36Å; H169-Y187 AromaticContact CG-CD1 3.66Å; H169-Y187 AromaticContact CG-CE1 3.49Å; H169-Y187 VanDerWaalsContact CG-CE1 3.49Å; H169-Y187 AromaticContact CG-CZ 3.88Å; H169-Y187 AromaticContact NE2-CD1 3.99Å; H169-Y187 AromaticContact NE2-CE1 3.62Å; V182-Y187 HydrophobicContact CB-CD2 4.22Å; V182-Y187 HydrophobicContact CB-CE2 3.86Å; V182-Y187 HydrophobicContact CG1-CE2 4.17Å; V182-Y187 HydrophobicContact CG2-CD2 3.39Å; V182-Y187 HydrophobicContact CG2-CE2 3.55Å; V182-Y187 HydrophobicContact CG2-CG 4.4Å; D185-Y187 HydrophobicContact CB-CE2 4.4Å; Y187-F595 HydrophobicContact CD1-CB 4.44Å; Y187-F595 AromaticContact CD1-CD2 3.64Å; Y187-F595 HydrophobicContact CD1-CD2 3.64Å; Y187-F595 HydrophobicContact CD1-CE2 4.07Å; Y187-F595 HydrophobicContact CD1-CG 4.02Å; Y187-F595 AromaticContact CE1-CD2 3.64Å; Y187-F595 HydrophobicContact CE1-CD2 3.64Å; Y187-F595 AromaticContact CE1-CE2 3.56Å; Y187-F595 HydrophobicContact CE1-CE2 3.56Å; Y187-F595 HydrophobicContact CE1-CG 4.25Å; Y187-F595 HydrophobicContact CE1-CZ 4.06Å; Y187-T597 VanDerWaalsContact CD2-OG1 3.3Å; Y187-T597 WeakPolarHBondContact CD2-OG1 3.12Å; Y187-T597 HydrophobicContact CE1-CG2 4.06Å; Y187-T597 HydrophobicContact CE2-CG2 4.3Å; Y187-T597 WeakPolarHBondContact CE2-OG1 2.93Å
188	F	97	Very high	91	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	81.1	177.2	-61.3	-86.3	0	0	0	107.2	Y138 V163 A165 L186 L212 F595 I596 L598 I603	Y138-F188 HydrophobicContact CD1-CD1 4.17Å; Y138-F188 AromaticContact CD1-CE1 3.31Å; Y138-F188 HydrophobicContact CD1-CE1 3.31Å; Y138-F188 AromaticContact CD1-CZ 3.86Å; Y138-F188 HydrophobicContact CD1-CZ 3.86Å; Y138-F188 HydrophobicContact CD2-CD1 4.46Å; Y138-F188 AromaticContact CD2-CE1 3.77Å; Y138-F188 HydrophobicContact CD2-CE1 3.77Å; Y138-F188 AromaticContact CE1-CE1 3.59Å; Y138-F188 HydrophobicContact CE1-CE1 3.59Å; Y138-F188 AromaticContact CE1-CZ 3.76Å; Y138-F188 HydrophobicContact CE1-CZ 3.76Å; Y138-F188 HydrophobicContact CE2-CE1 4.05Å; Y138-F188 AromaticContact CG-CD1 3.98Å; Y138-F188 HydrophobicContact CG-CD1 3.98Å; Y138-F188 AromaticContact CG-CE1 3.4Å; Y138-F188 HydrophobicContact CG-CE1 3.4Å; Y138-F188 HydrophobicContact CG-CZ 4.36Å; Y138-F188 AromaticContact CZ-CE1 3.96Å; V163-F188 HydrophobicContact CG2-CB 4.02Å; V163-F188 HydrophobicContact CG2-CD1 3.95Å; V163-F188 HydrophobicContact CG2-CG 4.43Å; A165-F188 HydrophobicContact CB-CD1 4.3Å; A165-F188 HydrophobicContact CB-CE1 3.55Å; A165-F188 HydrophobicContact CB-CZ 3.97Å; L186-F188 HydrophobicContact CB-CE2 4.12Å; L186-F188 HydrophobicContact CB-CZ 4.35Å; F188-L212 HydrophobicContact CB-CD1 4.45Å; F188-L212 HydrophobicContact CD1-CD1 4.08Å; F188-L212 HydrophobicContact CD1-CD2 4.22Å; F188-L212 HydrophobicContact CD2-CD2 3.52Å; F188-L212 HydrophobicContact CE1-CD2 4.25Å; F188-L212 HydrophobicContact CE2-CD2 3.6Å; F188-L212 HydrophobicContact CG-CD1 4.12Å; F188-L212 HydrophobicContact CG-CD2 3.85Å; F188-L212 HydrophobicContact CZ-CD2 3.96Å; F188-F595 WeakPolarHBondContact O-CA 3.45Å; F188-I596 HydrophobicContact CB-CB 4.41Å; F188-I596 WeakPolarHBondContact CD2-O 3.1Å; F188-I596 PolarHBondContact N-O 3.43Å; F188-I596 PolarHBondContact O-N 2.96Å; F188-I596 VanDerWaalsContact O-N 3.17Å; F188-L598 HydrophobicContact CD2-CD2 3.93Å; F188-L598 HydrophobicContact CE2-CD2 3.54Å; F188-I603 HydrophobicContact CE2-CD1 3.95Å; F188-I603 HydrophobicContact CZ-CD1 3.84Å
189	T	95.1	Very high	91.6	Very high	32 Å²	32	52.2 Å²	52.2	20%	0.196	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	140.6	-175.2	51.2	0	0	0	0	111.4	F595	T189-F595 HydrophobicContact CG2-CB 4.14Å
190	I	94.5	Very high	92.1	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.01	24%	0.244	C	C	.	.			trans	-116.2	89.1	179.5	-46	179.7	0	0	0	107.6	V140 Q161 V163 N192 Y193 F197 P593 T594	V140-I190 HydrophobicContact CB-CD1 4.06Å; V140-I190 HydrophobicContact CG1-CD1 3.89Å; V140-I190 HydrophobicContact CG2-CD1 4.06Å; Q161-I190 HydrophobicContact CG-CG2 4.04Å; V163-I190 HydrophobicContact CG1-CD1 4.32Å; V163-I190 HydrophobicContact CG1-CG1 3.79Å; I190-N192 VanDerWaalsContact C-N 3.34Å; I190-N192 PolarHBondContact O-N 3.45Å; I190-Y193 WeakPolarHBondContact O-CB 3.46Å; I190-Y193 WeakPolarHBondContact O-CD1 3.48Å; I190-Y193 PolarHBondContact O-N 3.13Å; I190-F197 HydrophobicContact CD1-CE2 3.64Å; I190-F197 HydrophobicContact CD1-CZ 4.1Å; I190-F197 HydrophobicContact CG2-CE2 3.94Å; I190-P593 HydrophobicContact CD1-CB 4.17Å; I190-T594 PolarHBondContact N-O 3.37Å
191	D	89.5	Confident	92.3	Very high	87 Å²	87	44.7 Å²	44.7	47%	0.465	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-37.7	-170.8	-70.6	-6.5	0	0	0	112.4	R170 Y193	R170-D191 IonicContact CZ-OD1 3.71Å; R170-D191 IonicContact CZ-OD2 3.13Å; R170-D191 IonicContact NE-OD1 3.85Å; R170-D191 IonicContact NE-OD2 2.79Å; R170-D191 IonicContact NH2-OD1 3.06Å; R170-D191 PolarHBondContact NH2-OD1 3.26Å; R170-D191 IonicContact NH2-OD2 3.33Å; R170-D191 PolarHBondContact NH2-OD2 3.08Å; D191-Y193 VanDerWaalsContact C-N 3.29Å; D191-Y193 PolarHBondContact O-N 3Å
192	N	91.5	Very high	92.5	Very high	61 Å²	61	41 Å²	41	33%	0.326	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	29.1	177.1	68.6	-28	0	0	0	112.4	Q161 I190 E194 E195 A196	Q161-N192 PolarHBondContact OE1-ND2 3.43Å; I190-N192 VanDerWaalsContact C-N 3.34Å; I190-N192 PolarHBondContact O-N 3.45Å; N192-E194 PolarHBondContact O-N 3.44Å; N192-E194 VanDerWaalsContact O-N 3.08Å; N192-E195 HydrophobicContact CB-CB 4.47Å; N192-E195 PolarHBondContact O-N 2.78Å; N192-A196 PolarHBondContact O-N 3.07Å
193	Y	92.5	Very high	92.6	Very high	22 Å²	22	42.8 Å²	42.8	9%	0.086	22%	0.223	C	C	.	.	H	α-helix	trans	-53.7	-33.1	-175.1	69.4	-85.8	0	0	0	114.3	M172 I190 D191 E195 F197 A298 P593 T594	M172-Y193 HydrophobicContact CE-CD1 3.67Å; M172-Y193 HydrophobicContact CE-CE1 3.7Å; I190-Y193 WeakPolarHBondContact O-CB 3.46Å; I190-Y193 WeakPolarHBondContact O-CD1 3.48Å; I190-Y193 PolarHBondContact O-N 3.13Å; D191-Y193 VanDerWaalsContact C-N 3.29Å; D191-Y193 PolarHBondContact O-N 3Å; Y193-E195 VanDerWaalsContact C-N 3.34Å; Y193-F197 PolarHBondContact O-N 2.55Å; Y193-A298 HydrophobicContact CD2-CB 3.97Å; Y193-A298 HydrophobicContact CE2-CB 3.57Å; Y193-P593 WeakPolarHBondContact CB-O 3.49Å; Y193-T594 HydrophobicContact CD1-CG2 4.15Å; Y193-T594 HydrophobicContact CD2-CG2 3.97Å; Y193-T594 HydrophobicContact CE1-CG2 4.37Å; Y193-T594 HydrophobicContact CE2-CG2 4.18Å; Y193-T594 HydrophobicContact CG-CG2 3.94Å
194	E	90.3	Very high	92.4	Very high	111 Å²	111	43.4 Å²	43.4	52%	0.519	23%	0.227	S	C	.	.	H	α-helix	trans	-66.5	-35.9	177.4	-63.9	-167.4	154	0	0	112.2	N192 G198	N192-E194 PolarHBondContact O-N 3.44Å; N192-E194 VanDerWaalsContact O-N 3.08Å; E194-G198 WeakPolarHBondContact O-CA 3.3Å; E194-G198 PolarHBondContact O-N 2.82Å
195	E	90.7	Very high	92.1	Very high	165 Å²	165	42.5 Å²	42.5	77%	0.771	22%	0.223	S	C	*	.	H	α-helix	trans	-80.8	-48.4	177.3	-175.9	180	-176.5	0	0	110.5	N192 Y193 F197	N192-E195 HydrophobicContact CB-CB 4.47Å; N192-E195 PolarHBondContact O-N 2.78Å; Y193-E195 VanDerWaalsContact C-N 3.34Å; E195-F197 VanDerWaalsContact C-N 3.29Å; E195-F197 PolarHBondContact O-N 2.64Å
196	A	89.6	Confident	92.1	Very high	22 Å²	22	40.2 Å²	40.2	18%	0.182	21%	0.21	C	C	.	.	H	α-helix	trans	-62.9	-34	-176.8	0	0	0	0	0	113.1	Q161 N192	Q161-A196 HydrophobicContact CB-CB 4.38Å; Q161-A196 HydrophobicContact CG-CB 4.2Å; N192-A196 PolarHBondContact O-N 3.07Å
197	F	92.2	Very high	91.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129	20.4	-175.3	-51.1	-62.8	0	0	0	113.4	V140 V142 F159 Q161 I190 Y193 E195 E199 C200 S592 P593	V140-F197 HydrophobicContact CG1-CZ 4.31Å; V142-F197 HydrophobicContact CB-CD1 4.14Å; V142-F197 HydrophobicContact CB-CE1 3.89Å; V142-F197 HydrophobicContact CG2-CD1 3.93Å; V142-F197 HydrophobicContact CG2-CE1 3.4Å; V142-F197 HydrophobicContact CG2-CE2 4.46Å; V142-F197 HydrophobicContact CG2-CZ 3.71Å; F159-F197 HydrophobicContact CB-CD1 3.65Å; F159-F197 HydrophobicContact CB-CE1 3.79Å; F159-F197 HydrophobicContact CG-CD1 4.22Å; Q161-F197 HydrophobicContact CB-CZ 4.05Å; I190-F197 HydrophobicContact CD1-CE2 3.64Å; I190-F197 HydrophobicContact CD1-CZ 4.1Å; I190-F197 HydrophobicContact CG2-CE2 3.94Å; Y193-F197 PolarHBondContact O-N 2.55Å; E195-F197 VanDerWaalsContact C-N 3.29Å; E195-F197 PolarHBondContact O-N 2.64Å; F197-E199 PolarHBondContact O-N 3.38Å; F197-C200 HydrophobicContact CB-CB 4.01Å; F197-C200 WeakPolarHBondContact O-CB 3.33Å; F197-C200 PolarHBondContact O-N 3.41Å; F197-S592 PolarHBondContact O-OG 2.98Å; F197-P593 HydrophobicContact CE2-CB 4.37Å
198	G	87.4	Confident	91.9	Very high	30 Å²	30	39.3 Å²	39.3	31%	0.309	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-26.7	-179.8	0	0	0	0	0	113.7	E194	E194-G198 WeakPolarHBondContact O-CA 3.3Å; E194-G198 PolarHBondContact O-N 2.82Å
199	E	88.8	Confident	91.7	Very high	117 Å²	117	39.3 Å²	39.3	55%	0.547	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	2.3	177	-60.1	-168.8	177.3	0	0	114.5	K157 F159 F197 V201	K157-E199 PolarHBondContact NZ-O 2.9Å; F159-E199 HydrophobicContact CE1-CB 3.87Å; F159-E199 HydrophobicContact CZ-CB 3.95Å; F197-E199 PolarHBondContact O-N 3.38Å; E199-V201 PolarHBondContact O-N 2.92Å
200	C	93.1	Very high	91.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.198	C	C	.	.			trans	-76.7	74.6	176.8	-170.6	0	0	0	0	110	F159 F197 I590 A591	F159-C200 HydrophobicContact CD2-CB 4.14Å; F159-C200 HydrophobicContact CE2-CB 3.77Å; F159-C200 HydrophobicContact CZ-CB 4.35Å; F197-C200 HydrophobicContact CB-CB 4.01Å; F197-C200 WeakPolarHBondContact O-CB 3.33Å; F197-C200 PolarHBondContact O-N 3.41Å; C200-I590 WeakPolarHBondContact O-CA 3.44Å; C200-A591 WeakPolarHBondContact CB-O 3.46Å; C200-A591 PolarHBondContact O-N 2.85Å; C200-A591 PolarHBondContact SG-O 3.23Å
201	V	93	Very high	91.8	Very high	26 Å²	26	37.7 Å²	37.7	16%	0.158	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	126.5	-178.8	-178.8	0	0	0	0	109.5	E199 M302 L589 I590	E199-V201 PolarHBondContact O-N 2.92Å; V201-M302 HydrophobicContact CG1-CG 4.36Å; V201-M302 HydrophobicContact CG2-CE 4.05Å; V201-M302 HydrophobicContact CG2-CG 4.39Å; V201-M302 HydrophobicContact CG2-SD 4Å; V201-L589 WeakPolarHBondContact CA-O 3.36Å; V201-I590 HydrophobicContact CG2-CG1 4.03Å
202	L	94	Very high	92.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	147	170.9	-72	95.3	0	0	0	112.1	E206 I208 Y232 I235 L589 A591	L202-E206 WeakPolarHBondContact CA-OE2 3.41Å; L202-I208 HydrophobicContact CD1-CB 4.13Å; L202-I208 HydrophobicContact CD1-CD1 4.49Å; L202-I208 HydrophobicContact CD2-CB 4Å; L202-I208 HydrophobicContact CD2-CG2 4.24Å; L202-Y232 HydrophobicContact CB-CD2 4.01Å; L202-I235 HydrophobicContact CD1-CD1 4.41Å; L202-I235 HydrophobicContact CD2-CD1 3.99Å; L202-L589 PolarHBondContact N-O 2.81Å; L202-L589 PolarHBondContact O-N 2.89Å; L202-A591 HydrophobicContact CD1-CB 3.4Å; L202-A591 VanDerWaalsContact CD1-CB 3.4Å
203	R	92.5	Very high	92.3	Very high	64 Å²	64	30.6 Å²	30.6	24%	0.242	16%	0.159	C	C	.	.			trans	-129.1	174.6	173.6	-60.1	-179.8	172.9	-76.6	-7.8	110.8	E206 Y232 R583 S588	R203-E206 PolarHBondContact N-OE2 2.82Å; R203-E206 WeakPolarHBondContact O-CB 3.43Å; R203-E206 PolarHBondContact O-N 2.84Å; R203-E206 VanDerWaalsContact O-N 3.13Å; R203-Y232 VanDerWaalsContact C-CD2 3.48Å; R203-Y232 VanDerWaalsContact O-CB 3.24Å; R203-Y232 WeakPolarHBondContact O-CB 3.38Å; R203-Y232 WeakPolarHBondContact O-CD2 3.24Å; R203-R583 HydrophobicContact CB-CG 3.48Å; R203-R583 VanDerWaalsContact CB-CG 3.48Å; R203-R583 HydrophobicContact CG-CG 4.34Å; R203-S588 PolarHBondContact NH1-OG 2.85Å; R203-S588 PolarHBondContact NH2-OG 3.5Å
204	D	89.3	Confident	92.5	Very high	25 Å²	25	29.6 Å²	29.6	13%	0.134	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	140.4	175	-170.2	79.5	0	0	0	112	E206 Y232 R582 R583 S586	D204-E206 PolarHBondContact O-N 2.96Å; D204-Y232 HydrophobicContact CB-CD1 4.34Å; D204-Y232 HydrophobicContact CB-CE1 4.13Å; D204-R582 HydrophobicContact CB-CB 4.32Å; D204-R582 VanDerWaalsContact OD2-CB 3.29Å; D204-R582 WeakPolarHBondContact OD2-CB 3.49Å; D204-R583 WeakPolarHBondContact O-CG 3.09Å; D204-S586 PolarHBondContact N-OG 2.71Å
205	S	87.4	Confident	92.7	Very high	48 Å²	48	26 Å²	26	34%	0.336	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	16.2	-175.9	-52.8	0	0	0	0	116	T146	T146-S205 PolarHBondContact OG1-O 3.26Å
206	E	92.1	Very high	92.7	Very high	10 Å²	10	18.6 Å²	18.6	5%	0.047	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	161.2	170.9	-60.5	169.5	-179.5	0	0	111.3	V144 C145 L156 L202 R203 D204 Y232 R583	V144-E206 HydrophobicContact CG1-CB 4.32Å; C145-E206 CarbonylContact O-C 3.54Å; C145-E206 VanDerWaalsContact O-CA 3.27Å; C145-E206 WeakPolarHBondContact O-CA 3.4Å; L156-E206 HydrophobicContact CD1-CG 3.98Å; L202-E206 WeakPolarHBondContact CA-OE2 3.41Å; R203-E206 PolarHBondContact N-OE2 2.82Å; R203-E206 WeakPolarHBondContact O-CB 3.43Å; R203-E206 PolarHBondContact O-N 2.84Å; R203-E206 VanDerWaalsContact O-N 3.13Å; D204-E206 PolarHBondContact O-N 2.96Å; E206-Y232 WeakPolarHBondContact O-CB 3.42Å; E206-Y232 PolarHBondContact O-N 3.49Å; E206-R583 WeakPolarHBondContact OE1-CD 3.35Å; E206-R583 IonicContact OE1-NH1 2.71Å; E206-R583 PolarHBondContact OE1-NH1 3.04Å; E206-R583 VanDerWaalsContact OE1-NH1 3.13Å
207	C	93.4	Very high	92.5	Very high	3 Å²	3	22.6 Å²	22.6	2%	0.02	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	156.8	173.1	66	0	0	0	0	111.1	V144 C145 W153 V230 M407	V144-C207 CarbonylContact C-O 3.55Å; V144-C207 WeakPolarHBondContact CA-O 3.44Å; C145-C207 PolarHBondContact N-O 2.95Å; C145-C207 PolarHBondContact O-N 2.84Å; W153-C207 HydrophobicContact CZ3-CB 4.3Å; W153-C207 WeakPolarHBondContact CZ3-SG 3.47Å; C207-V230 WeakPolarHBondContact CA-O 3.39Å; C207-V230 WeakPolarHBondContact CB-O 3.26Å; C207-M407 WeakPolarHBondContact SG-CE 3.42Å
208	I	95.4	Very high	92.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	129	173.5	-175.5	172.7	0	0	0	108.9	V142 L202 V210 T229 V230 I235 A591	V142-I208 HydrophobicContact CG1-CD1 3.57Å; V142-I208 HydrophobicContact CG1-CG1 3.57Å; L202-I208 HydrophobicContact CD1-CB 4.13Å; L202-I208 HydrophobicContact CD1-CD1 4.49Å; L202-I208 HydrophobicContact CD2-CB 4Å; L202-I208 HydrophobicContact CD2-CG2 4.24Å; I208-V210 HydrophobicContact CD1-CG2 4.46Å; I208-V210 HydrophobicContact CG1-CG2 4.26Å; I208-T229 CarbonylContact O-C 3.57Å; I208-T229 VanDerWaalsContact O-CA 3.3Å; I208-T229 WeakPolarHBondContact O-CA 3.48Å; I208-T229 PolarHBondContact O-OG1 3.24Å; I208-V230 HydrophobicContact CG2-CB 3.87Å; I208-V230 PolarHBondContact N-O 3.4Å; I208-V230 PolarHBondContact O-N 3.47Å; I208-I235 HydrophobicContact CG2-CD1 3.69Å; I208-A591 HydrophobicContact CD1-CB 3.96Å
209	N	94.3	Very high	92.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	137.6	171.4	-55.3	-74.4	0	0	0	108.7	V142 A143 C145 G228 T229 M407 L616	V142-N209 CarbonylContact C-O 3.5Å; V142-N209 VanDerWaalsContact CA-O 3.24Å; V142-N209 WeakPolarHBondContact CA-O 3.2Å; A143-N209 HydrophobicContact CB-CB 4.4Å; A143-N209 PolarHBondContact N-O 2.84Å; A143-N209 PolarHBondContact O-N 2.94Å; A143-N209 PolarHBondContact O-ND2 3.26Å; C145-N209 PolarHBondContact SG-ND2 2.97Å; N209-G228 CarbonylContact C-O 3.53Å; N209-G228 WeakPolarHBondContact CA-O 3.23Å; N209-T229 WeakPolarHBondContact OD1-CB 3.3Å; N209-T229 PolarHBondContact OD1-OG1 2.8Å; N209-M407 WeakPolarHBondContact OD1-CE 3.19Å; N209-L616 HydrophobicContact CB-CD1 3.79Å; N209-L616 HydrophobicContact CB-CD2 4.44Å
210	V	95.5	Very high	92	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	123.9	179.6	-176.8	0	0	0	0	108.1	V140 I208 L227 G228 P593 I596	V140-V210 HydrophobicContact CG1-CG1 4.33Å; I208-V210 HydrophobicContact CD1-CG2 4.46Å; I208-V210 HydrophobicContact CG1-CG2 4.26Å; V210-L227 CarbonylContact O-C 3.53Å; V210-L227 VanDerWaalsContact O-CA 3.31Å; V210-L227 WeakPolarHBondContact O-CA 3.4Å; V210-G228 PolarHBondContact N-O 2.8Å; V210-G228 PolarHBondContact O-N 3.19Å; V210-P593 HydrophobicContact CG1-CG 4.38Å; V210-P593 HydrophobicContact CG2-CG 3.93Å; V210-I596 HydrophobicContact CG1-CD1 3.61Å; V210-I596 HydrophobicContact CG1-CG1 4.34Å
211	E	94.9	Very high	91.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	130.1	179.5	-177.6	-177.4	83	0	0	109.3	V140 T141 T213 V224 F226 L227 I615 L616 N617	V140-E211 CarbonylContact C-O 3.58Å; V140-E211 WeakPolarHBondContact CA-O 3.35Å; T141-E211 PolarHBondContact N-O 2.88Å; T141-E211 PolarHBondContact O-N 3.31Å; E211-T213 PolarHBondContact OE1-OG1 2.78Å; E211-V224 HydrophobicContact CG-CG1 3.98Å; E211-F226 CarbonylContact C-O 3.58Å; E211-F226 VanDerWaalsContact CA-O 3.3Å; E211-F226 WeakPolarHBondContact CA-O 3.3Å; E211-L227 HydrophobicContact CB-CD1 4.06Å; E211-L227 HydrophobicContact CG-CD1 4.32Å; E211-I615 PolarHBondContact OE2-N 2.99Å; E211-L616 HydrophobicContact CB-CB 4.39Å; E211-L616 HydrophobicContact CB-CD1 3.76Å; E211-L616 HydrophobicContact CB-CG 4.18Å; E211-L616 PolarHBondContact OE2-N 3.06Å; E211-N617 PolarHBondContact OE1-N 2.97Å; E211-N617 PolarHBondContact OE1-ND2 3.03Å
212	L	97	Very high	91.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	116.9	166.5	178.5	67.5	0	0	0	107.5	Y138 V140 V163 F188 C225 F226 I596 L598	Y138-L212 HydrophobicContact CD1-CD1 4.48Å; V140-L212 HydrophobicContact CG2-CD1 3.71Å; V163-L212 HydrophobicContact CG2-CD1 4.06Å; F188-L212 HydrophobicContact CB-CD1 4.45Å; F188-L212 HydrophobicContact CD1-CD1 4.08Å; F188-L212 HydrophobicContact CD1-CD2 4.22Å; F188-L212 HydrophobicContact CD2-CD2 3.52Å; F188-L212 HydrophobicContact CE1-CD2 4.25Å; F188-L212 HydrophobicContact CE2-CD2 3.6Å; F188-L212 HydrophobicContact CG-CD1 4.12Å; F188-L212 HydrophobicContact CG-CD2 3.85Å; F188-L212 HydrophobicContact CZ-CD2 3.96Å; L212-C225 HydrophobicContact CD2-CB 4.06Å; L212-C225 HydrophobicContact CG-CB 4.25Å; L212-C225 PolarHBondContact O-N 3.06Å; L212-F226 HydrophobicContact CB-CB 3.8Å; L212-F226 PolarHBondContact N-O 3.15Å; L212-F226 PolarHBondContact O-N 2.97Å; L212-I596 HydrophobicContact CB-CD1 3.92Å; L212-I596 HydrophobicContact CD2-CG2 4.12Å; L212-L598 HydrophobicContact CD2-CD2 3.79Å
213	T	95.9	Very high	91.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	132.9	176.3	-50.7	0	0	0	0	109.6	Y138 V139 E211 Y215 G223 P614	Y138-T213 WeakPolarHBondContact CA-O 3.15Å; V139-T213 PolarHBondContact N-O 3.14Å; V139-T213 PolarHBondContact O-N 3.1Å; E211-T213 PolarHBondContact OE1-OG1 2.78Å; T213-Y215 HydrophobicContact CG2-CD1 4.48Å; T213-Y215 HydrophobicContact CG2-CD2 4.14Å; T213-Y215 HydrophobicContact CG2-CE1 3.86Å; T213-Y215 HydrophobicContact CG2-CE2 3.47Å; T213-Y215 VanDerWaalsContact CG2-CE2 3.47Å; T213-Y215 WeakPolarHBondContact CG2-OH 3.36Å; T213-G223 WeakPolarHBondContact CA-O 3.19Å; T213-P614 HydrophobicContact CG2-CB 4.32Å
214	A	96.4	Very high	91.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	137.2	170.4	0	0	0	0	0	109.3	F136 V137 Y138 H222 G223 C225 L607	F136-A214 HydrophobicContact CD1-CB 4.39Å; V137-A214 WeakPolarHBondContact O-CA 3.47Å; Y138-A214 HydrophobicContact CD1-CB 3.64Å; Y138-A214 HydrophobicContact CE1-CB 3.51Å; A214-H222 CarbonylContact O-C 3.56Å; A214-H222 WeakPolarHBondContact O-CA 3.46Å; A214-H222 WeakPolarHBondContact O-CB 3.24Å; A214-G223 PolarHBondContact N-O 2.8Å; A214-G223 PolarHBondContact O-N 2.85Å; A214-C225 VanDerWaalsContact CB-SG 3.59Å; A214-L607 HydrophobicContact CB-CD1 4.22Å; A214-L607 HydrophobicContact CB-CD2 3.94Å
215	Y	94.1	Very high	92.2	Very high	35 Å²	35	29.4 Å²	29.4	14%	0.137	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	142.2	177.9	-59.2	-90.8	0	0	0	109.1	F136 V137 V139 T213 V221 H222 N617	F136-Y215 CarbonylContact C-O 3.52Å; F136-Y215 VanDerWaalsContact CA-O 3.24Å; F136-Y215 WeakPolarHBondContact CA-O 3.32Å; V137-Y215 PolarHBondContact N-O 2.83Å; V137-Y215 PolarHBondContact O-N 2.76Å; V139-Y215 HydrophobicContact CB-CE2 4.07Å; V139-Y215 HydrophobicContact CG2-CD2 4.1Å; V139-Y215 HydrophobicContact CG2-CE2 3.94Å; T213-Y215 HydrophobicContact CG2-CD1 4.48Å; T213-Y215 HydrophobicContact CG2-CD2 4.14Å; T213-Y215 HydrophobicContact CG2-CE1 3.86Å; T213-Y215 HydrophobicContact CG2-CE2 3.47Å; T213-Y215 VanDerWaalsContact CG2-CE2 3.47Å; T213-Y215 WeakPolarHBondContact CG2-OH 3.36Å; Y215-V221 CarbonylContact C-O 3.57Å; Y215-V221 WeakPolarHBondContact CA-O 3.37Å; Y215-H222 HydrophobicContact CD1-CB 3.6Å; Y215-H222 HydrophobicContact CE1-CB 3.95Å; Y215-H222 HydrophobicContact CG-CB 4.34Å; Y215-N617 VanDerWaalsContact OH-CB 3.23Å; Y215-N617 WeakPolarHBondContact OH-CB 3.4Å; Y215-N617 PolarHBondContact OH-ND2 3.47Å
216	D	91.3	Very high	92.5	Very high	10 Å²	10	27.3 Å²	27.3	5%	0.053	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	167	160.8	73.3	-36.4	0	0	0	110.6	L28 F136 H218 G219 R220 V221	L28-D216 HydrophobicContact CD2-CB 3.41Å; L28-D216 VanDerWaalsContact CD2-CB 3.41Å; F136-D216 HydrophobicContact CE1-CB 4.45Å; D216-H218 PolarHBondContact O-N 2.84Å; D216-H218 VanDerWaalsContact O-N 3.14Å; D216-H218 WeakPolarHBondContact OD2-CB 3.34Å; D216-G219 PolarHBondContact O-N 2.82Å; D216-G219 VanDerWaalsContact O-N 3.1Å; D216-G219 WeakPolarHBondContact OD1-CA 3.24Å; D216-G219 PolarHBondContact OD1-N 2.88Å; D216-R220 PolarHBondContact OD1-N 2.85Å; D216-R220 PolarHBondContact OD2-N 2.95Å; D216-V221 HydrophobicContact CB-CB 4.15Å; D216-V221 PolarHBondContact N-O 3.44Å; D216-V221 PolarHBondContact OD1-N 3.09Å; D216-V221 VanDerWaalsContact OD1-O 3.06Å
217	R	85.1	Confident	92.6	Very high	107 Å²	107	27.8 Å²	27.8	40%	0.404	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-23.8	179.8	-65.3	177.5	179.3	-93.4	-29.1	113.7	V80 Q134	V80-R217 WeakPolarHBondContact O-CD 2.9Å; Q134-R217 PolarHBondContact O-NH2 3.23Å; Q134-R217 VanDerWaalsContact O-NH2 3.09Å
218	H	85.4	Confident	92.6	Very high	74 Å²	74	27.6 Å²	27.6	34%	0.343	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-5.4	179.9	-59.6	92.4	0	0	0	113.5	V80 D81 D216 R220	V80-H218 WeakPolarHBondContact CG1-NE2 3.48Å; D81-H218 IonicContact OD1-CE1 3.69Å; D81-H218 PolarHBondContact OD1-CE1 2.82Å; D81-H218 IonicContact OD1-ND1 3.13Å; D81-H218 IonicContact OD1-NE2 2.82Å; D216-H218 PolarHBondContact O-N 2.84Å; D216-H218 VanDerWaalsContact O-N 3.14Å; D216-H218 WeakPolarHBondContact OD2-CB 3.34Å; H218-R220 HydrophobicContact CB-CG 3.9Å; H218-R220 PolarHBondContact O-N 3.48Å
219	G	84.9	Confident	92.5	Very high	43 Å²	43	28 Å²	28	44%	0.443	13%	0.132	S	C	.	.	S	Bend	trans	66.8	10	-173.2	0	0	0	0	0	115.2	D216	D216-G219 PolarHBondContact O-N 2.82Å; D216-G219 VanDerWaalsContact O-N 3.1Å; D216-G219 WeakPolarHBondContact OD1-CA 3.24Å; D216-G219 PolarHBondContact OD1-N 2.88Å
220	R	86.8	Confident	92.5	Very high	200 Å²	200	28 Å²	28	76%	0.755	13%	0.133	S	C	*	.	S	Bend	trans	-78.5	-31.4	179.8	-64.4	178.4	179.9	173.7	2.8	112.7	D216 H218	D216-R220 PolarHBondContact OD1-N 2.85Å; D216-R220 PolarHBondContact OD2-N 2.95Å; H218-R220 HydrophobicContact CB-CG 3.9Å; H218-R220 PolarHBondContact O-N 3.48Å
221	V	90.3	Very high	92.4	Very high	16 Å²	16	30 Å²	30	10%	0.097	15%	0.146	C	C	.	.	S	Bend	trans	-119.9	124	180	179.8	0	0	0	0	107.6	M32 F136 Y215 D216	M32-V221 HydrophobicContact CE-CG1 3.9Å; M32-V221 HydrophobicContact SD-CG1 4.13Å; F136-V221 HydrophobicContact CE1-CG1 4.22Å; Y215-V221 CarbonylContact C-O 3.57Å; Y215-V221 WeakPolarHBondContact CA-O 3.37Å; D216-V221 HydrophobicContact CB-CB 4.15Å; D216-V221 PolarHBondContact N-O 3.44Å; D216-V221 PolarHBondContact OD1-N 3.09Å; D216-V221 VanDerWaalsContact OD1-O 3.06Å
222	H	93.2	Very high	92.4	Very high	47 Å²	47	30.4 Å²	30.4	22%	0.218	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	162.4	175.4	56.3	-96.2	0	0	0	111.2	A214 Y215	A214-H222 CarbonylContact O-C 3.56Å; A214-H222 WeakPolarHBondContact O-CA 3.46Å; A214-H222 WeakPolarHBondContact O-CB 3.24Å; Y215-H222 HydrophobicContact CD1-CB 3.6Å; Y215-H222 HydrophobicContact CE1-CB 3.95Å; Y215-H222 HydrophobicContact CG-CB 4.34Å
223	G	93.6	Very high	92.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	140.2	176.7	0	0	0	0	0	112.3	T213 A214 C225	T213-G223 WeakPolarHBondContact CA-O 3.19Å; A214-G223 PolarHBondContact N-O 2.8Å; A214-G223 PolarHBondContact O-N 2.85Å; G223-C225 PolarHBondContact O-N 3Å
224	V	94.3	Very high	92.1	Very high	6 Å²	6	36 Å²	36	4%	0.036	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	96.3	176.7	-179.2	0	0	0	0	110	E211 L227 E606 R612 E613 P614	E211-V224 HydrophobicContact CG-CG1 3.98Å; V224-L227 HydrophobicContact CG1-CB 3.89Å; V224-E606 VanDerWaalsContact O-CD 3.3Å; V224-E606 WeakPolarHBondContact O-CG 3.18Å; V224-R612 HydrophobicContact CB-CB 4.22Å; V224-R612 HydrophobicContact CG2-CB 4.36Å; V224-R612 PolarHBondContact N-O 3.32Å; V224-E613 WeakPolarHBondContact CG2-O 3.01Å; V224-P614 VanDerWaalsContact CG2-CA 3.5Å; V224-P614 HydrophobicContact CG2-CB 4.25Å
225	C	94.5	Very high	91.9	Very high	18 Å²	18	36 Å²	36	12%	0.122	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	-32	-175.7	-51.4	0	0	0	0	112.8	L212 A214 G223 L598 I603	L212-C225 HydrophobicContact CD2-CB 4.06Å; L212-C225 HydrophobicContact CG-CB 4.25Å; L212-C225 PolarHBondContact O-N 3.06Å; A214-C225 VanDerWaalsContact CB-SG 3.59Å; G223-C225 PolarHBondContact O-N 3Å; C225-L598 HydrophobicContact CB-CD1 4.03Å; C225-L598 VanDerWaalsContact O-CD1 3.24Å; C225-L598 WeakPolarHBondContact O-CD1 3.18Å; C225-I603 HydrophobicContact CB-CG1 4.4Å
226	F	95.3	Very high	91.9	Very high	5 Å²	5	36.3 Å²	36.3	2%	0.022	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	138.8	178.2	-174.7	-84.3	0	0	0	109.5	E211 L212 G288 A295 L413 I596	E211-F226 CarbonylContact C-O 3.58Å; E211-F226 VanDerWaalsContact CA-O 3.3Å; E211-F226 WeakPolarHBondContact CA-O 3.3Å; L212-F226 HydrophobicContact CB-CB 3.8Å; L212-F226 PolarHBondContact N-O 3.15Å; L212-F226 PolarHBondContact O-N 2.97Å; F226-G288 VanDerWaalsContact CE2-CA 3.47Å; F226-A295 HydrophobicContact CE1-CB 4.19Å; F226-A295 HydrophobicContact CZ-CB 3.95Å; F226-L413 HydrophobicContact CE1-CD1 3.96Å; F226-L413 HydrophobicContact CE1-CD2 4.27Å; F226-L413 HydrophobicContact CZ-CD1 4.02Å; F226-L413 HydrophobicContact CZ-CD2 3.8Å; F226-I596 HydrophobicContact CB-CG2 3.95Å; F226-I596 HydrophobicContact CD1-CD1 4.33Å; F226-I596 HydrophobicContact CD1-CG2 4.13Å; F226-I596 HydrophobicContact CD2-CG2 3.9Å; F226-I596 HydrophobicContact CE2-CG2 4.41Å; F226-I596 HydrophobicContact CG-CG2 3.74Å
227	L	93.6	Very high	91.9	Very high	19 Å²	19	42.3 Å²	42.3	10%	0.099	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	135.9	175.6	174.4	65.6	0	0	0	108.8	V210 E211 V224 P289 I410 P411 I615	V210-L227 CarbonylContact O-C 3.53Å; V210-L227 VanDerWaalsContact O-CA 3.31Å; V210-L227 WeakPolarHBondContact O-CA 3.4Å; E211-L227 HydrophobicContact CB-CD1 4.06Å; E211-L227 HydrophobicContact CG-CD1 4.32Å; V224-L227 HydrophobicContact CG1-CB 3.89Å; L227-P289 WeakPolarHBondContact O-CG 3.41Å; L227-I410 HydrophobicContact CD1-CG1 4.44Å; L227-I410 HydrophobicContact CD1-CG2 4.15Å; L227-I410 HydrophobicContact CD2-CG1 4.27Å; L227-I410 HydrophobicContact CG-CG2 4.08Å; L227-P411 VanDerWaalsContact O-CG 3.3Å; L227-P411 WeakPolarHBondContact O-CG 3.49Å; L227-I615 HydrophobicContact CD2-CD1 3.62Å; L227-I615 HydrophobicContact CD2-CG1 4.47Å
228	G	93	Very high	92.2	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.3	169.8	165.5	0	0	0	0	0	114.9	N209 V210 P411	N209-G228 CarbonylContact C-O 3.53Å; N209-G228 WeakPolarHBondContact CA-O 3.23Å; V210-G228 PolarHBondContact N-O 2.8Å; V210-G228 PolarHBondContact O-N 3.19Å; G228-P411 CarbonylContact C-O 3.56Å; G228-P411 WeakPolarHBondContact CA-O 3.45Å
229	T	93.4	Very high	92.4	Very high	8 Å²	8	36.2 Å²	36.2	5%	0.049	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	145.1	-174.7	-165.2	0	0	0	0	112.8	I208 N209 M407 I410 P411 L413	I208-T229 CarbonylContact O-C 3.57Å; I208-T229 VanDerWaalsContact O-CA 3.3Å; I208-T229 WeakPolarHBondContact O-CA 3.48Å; I208-T229 PolarHBondContact O-OG1 3.24Å; N209-T229 WeakPolarHBondContact OD1-CB 3.3Å; N209-T229 PolarHBondContact OD1-OG1 2.8Å; T229-M407 HydrophobicContact CG2-CE 4.24Å; T229-M407 HydrophobicContact CG2-SD 4.46Å; T229-M407 WeakPolarHBondContact OG1-CE 3.17Å; T229-I410 HydrophobicContact CG2-CG2 4.17Å; T229-P411 PolarHBondContact N-O 3.4Å; T229-L413 PolarHBondContact O-N 2.95Å
230	V	94.2	Very high	92.6	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	127.2	171	-170.6	0	0	0	0	109.2	C207 I208 T234 I235 M284 V286 I297 L413	C207-V230 WeakPolarHBondContact CA-O 3.39Å; C207-V230 WeakPolarHBondContact CB-O 3.26Å; I208-V230 HydrophobicContact CG2-CB 3.87Å; I208-V230 PolarHBondContact N-O 3.4Å; I208-V230 PolarHBondContact O-N 3.47Å; V230-T234 HydrophobicContact CG1-CG2 3.95Å; V230-I235 HydrophobicContact CB-CD1 4.38Å; V230-I235 HydrophobicContact CB-CG1 4.49Å; V230-I235 HydrophobicContact CG1-CD1 4.1Å; V230-I235 HydrophobicContact CG1-CG1 3.7Å; V230-M284 HydrophobicContact CG1-CE 4.02Å; V230-V286 HydrophobicContact CG2-CG1 4.18Å; V230-I297 HydrophobicContact CG2-CD1 4.19Å; V230-L413 HydrophobicContact CG2-CB 3.83Å; V230-L413 HydrophobicContact CG2-CD1 4.11Å; V230-L413 HydrophobicContact CG2-CG 4.43Å
231	S	93.9	Very high	92.5	Very high	40 Å²	40	35.6 Å²	35.6	28%	0.28	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	150.5	176.1	65	0	0	0	0	112.3	D233 T234 I235	S231-D233 PolarHBondContact O-N 3.42Å; S231-T234 WeakPolarHBondContact O-CB 3.38Å; S231-T234 PolarHBondContact O-N 2.8Å; S231-T234 VanDerWaalsContact O-N 3.09Å; S231-T234 PolarHBondContact OG-N 3.36Å; S231-T234 PolarHBondContact OG-OG1 2.76Å; S231-I235 PolarHBondContact O-N 3.03Å
232	Y	94.6	Very high	92.1	Very high	10 Å²	10	35.2 Å²	35.2	4%	0.039	17%	0.169	C	C	.	.	H	α-helix	trans	-51.3	-42.1	170.1	168.6	-94.4	0	0	0	112	L202 R203 D204 E206 T234 I235 K236 V587 L589	L202-Y232 HydrophobicContact CB-CD2 4.01Å; R203-Y232 VanDerWaalsContact C-CD2 3.48Å; R203-Y232 VanDerWaalsContact O-CB 3.24Å; R203-Y232 WeakPolarHBondContact O-CB 3.38Å; R203-Y232 WeakPolarHBondContact O-CD2 3.24Å; D204-Y232 HydrophobicContact CB-CD1 4.34Å; D204-Y232 HydrophobicContact CB-CE1 4.13Å; E206-Y232 WeakPolarHBondContact O-CB 3.42Å; E206-Y232 PolarHBondContact O-N 3.49Å; Y232-T234 VanDerWaalsContact C-N 3.27Å; Y232-T234 PolarHBondContact O-N 3.06Å; Y232-I235 PolarHBondContact O-N 3.02Å; Y232-K236 HydrophobicContact CD1-CB 4.43Å; Y232-K236 HydrophobicContact CE1-CB 4.05Å; Y232-K236 HydrophobicContact CE1-CG 4.22Å; Y232-K236 HydrophobicContact CE2-CB 4.45Å; Y232-K236 VanDerWaalsContact O-CB 3.23Å; Y232-K236 WeakPolarHBondContact O-CB 3.18Å; Y232-K236 PolarHBondContact O-N 2.88Å; Y232-V587 WeakPolarHBondContact CE2-O 3.37Å; Y232-V587 PolarHBondContact OH-O 2.74Å; Y232-V587 VanDerWaalsContact OH-O 3.08Å; Y232-L589 HydrophobicContact CE2-CD1 4.01Å; Y232-L589 HydrophobicContact CE2-CG 4.2Å
233	D	92.3	Very high	91.2	Very high	85 Å²	85	34.8 Å²	34.8	46%	0.455	17%	0.172	S	C	.	.	H	α-helix	trans	-57.1	-41.2	179.3	-68.3	-40.7	0	0	0	112.4	S231 K236 Q237	S231-D233 PolarHBondContact O-N 3.42Å; D233-K236 PolarHBondContact O-N 2.97Å; D233-Q237 WeakPolarHBondContact O-CB 3.41Å; D233-Q237 WeakPolarHBondContact O-CG 3.38Å; D233-Q237 PolarHBondContact O-N 3.43Å
234	T	93.4	Very high	90.2	Very high	32 Å²	32	40.7 Å²	40.7	20%	0.196	20%	0.199	C	C	.	.	H	α-helix	trans	-67.2	-45.8	179.3	-57.5	0	0	0	0	110.9	V230 S231 Y232 F238 P415	V230-T234 HydrophobicContact CG1-CG2 3.95Å; S231-T234 WeakPolarHBondContact O-CB 3.38Å; S231-T234 PolarHBondContact O-N 2.8Å; S231-T234 VanDerWaalsContact O-N 3.09Å; S231-T234 PolarHBondContact OG-N 3.36Å; S231-T234 PolarHBondContact OG-OG1 2.76Å; Y232-T234 VanDerWaalsContact C-N 3.27Å; Y232-T234 PolarHBondContact O-N 3.06Å; T234-F238 PolarHBondContact O-N 2.73Å; T234-F238 VanDerWaalsContact O-N 3.09Å; T234-P415 HydrophobicContact CG2-CG 3.4Å; T234-P415 VanDerWaalsContact CG2-CG 3.4Å
235	I	93.8	Very high	88.9	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.7	-45.7	176.8	-68.5	170.7	0	0	0	110.3	L202 I208 V230 S231 Y232 F238 Y239 M284 I299 L589 A591	L202-I235 HydrophobicContact CD1-CD1 4.41Å; L202-I235 HydrophobicContact CD2-CD1 3.99Å; I208-I235 HydrophobicContact CG2-CD1 3.69Å; V230-I235 HydrophobicContact CB-CD1 4.38Å; V230-I235 HydrophobicContact CB-CG1 4.49Å; V230-I235 HydrophobicContact CG1-CD1 4.1Å; V230-I235 HydrophobicContact CG1-CG1 3.7Å; S231-I235 PolarHBondContact O-N 3.03Å; Y232-I235 PolarHBondContact O-N 3.02Å; I235-F238 PolarHBondContact O-N 2.75Å; I235-Y239 WeakPolarHBondContact O-CB 3.3Å; I235-Y239 PolarHBondContact O-N 3.16Å; I235-M284 HydrophobicContact CG1-CE 3.73Å; I235-I299 HydrophobicContact CG2-CD1 3.74Å; I235-I299 HydrophobicContact CG2-CG1 3.96Å; I235-I299 HydrophobicContact CG2-CG2 3.83Å; I235-L589 HydrophobicContact CG2-CD1 3.75Å; I235-A591 HydrophobicContact CD1-CB 4.27Å
236	K	92.8	Very high	87.1	Confident	41 Å²	41	44.5 Å²	44.5	18%	0.178	23%	0.229	C	C	.	.	H	α-helix	trans	-63.6	-46	-179.1	-179.4	56.6	177	156.7	0	111.6	Y232 D233 F238 Y239 D240 L589	Y232-K236 HydrophobicContact CD1-CB 4.43Å; Y232-K236 HydrophobicContact CE1-CB 4.05Å; Y232-K236 HydrophobicContact CE1-CG 4.22Å; Y232-K236 HydrophobicContact CE2-CB 4.45Å; Y232-K236 VanDerWaalsContact O-CB 3.23Å; Y232-K236 WeakPolarHBondContact O-CB 3.18Å; Y232-K236 PolarHBondContact O-N 2.88Å; D233-K236 PolarHBondContact O-N 2.97Å; K236-F238 VanDerWaalsContact C-N 3.34Å; K236-F238 PolarHBondContact O-N 2.91Å; K236-Y239 PolarHBondContact O-N 3.35Å; K236-D240 WeakPolarHBondContact CE-OD1 3.39Å; K236-D240 WeakPolarHBondContact CE-OD2 3.44Å; K236-D240 IonicContact NZ-OD1 3.68Å; K236-D240 PolarHBondContact NZ-OD1 2.84Å; K236-D240 IonicContact NZ-OD2 3.8Å; K236-D240 PolarHBondContact NZ-OD2 2.83Å; K236-D240 WeakPolarHBondContact O-CB 3.46Å; K236-D240 PolarHBondContact O-N 2.78Å; K236-L589 HydrophobicContact CB-CD1 4.17Å; K236-L589 HydrophobicContact CD-CD1 4.03Å
237	Q	91.7	Very high	85.2	Confident	136 Å²	136	47.8 Å²	47.8	64%	0.636	25%	0.253	S	S	*	.	H	α-helix	trans	-59.5	-42.8	175.4	-75.1	174.3	36.4	0	0	112.3	D233 R241	D233-Q237 WeakPolarHBondContact O-CB 3.41Å; D233-Q237 WeakPolarHBondContact O-CG 3.38Å; D233-Q237 PolarHBondContact O-N 3.43Å; Q237-R241 WeakPolarHBondContact O-CB 3Å; Q237-R241 PolarHBondContact O-N 2.78Å
238	F	90.9	Very high	83.1	Confident	17 Å²	17	50.7 Å²	50.7	8%	0.075	27%	0.272	C	S	.	.	H	α-helix	trans	-63.8	-44.9	175.6	174	-92.1	0	0	0	112	T234 I235 K236 R241 S242 R282 F283 M284 I299 S419	T234-F238 PolarHBondContact O-N 2.73Å; T234-F238 VanDerWaalsContact O-N 3.09Å; I235-F238 PolarHBondContact O-N 2.75Å; K236-F238 VanDerWaalsContact C-N 3.34Å; K236-F238 PolarHBondContact O-N 2.91Å; F238-R241 PolarHBondContact O-N 3.17Å; F238-S242 VanDerWaalsContact O-CB 3.26Å; F238-S242 WeakPolarHBondContact O-CB 3.11Å; F238-S242 PolarHBondContact O-N 3.48Å; F238-S242 PolarHBondContact O-OG 3.25Å; F238-R282 HydrophobicContact CE1-CB 4.01Å; F238-F283 WeakPolarHBondContact CZ-O 3.37Å; F238-M284 HydrophobicContact CB-CG 4.38Å; F238-M284 HydrophobicContact CB-SD 3.6Å; F238-M284 HydrophobicContact CD1-CB 3.64Å; F238-M284 HydrophobicContact CD1-CG 3.89Å; F238-M284 HydrophobicContact CD1-SD 3.98Å; F238-M284 HydrophobicContact CD2-CB 4.34Å; F238-M284 HydrophobicContact CD2-CG 3.85Å; F238-M284 HydrophobicContact CD2-SD 4.16Å; F238-M284 HydrophobicContact CE1-CB 3.51Å; F238-M284 HydrophobicContact CE1-CG 4.1Å; F238-M284 HydrophobicContact CE2-CB 4.23Å; F238-M284 HydrophobicContact CE2-CG 4.06Å; F238-M284 HydrophobicContact CG-CB 4.06Å; F238-M284 HydrophobicContact CG-CG 3.75Å; F238-M284 HydrophobicContact CG-SD 3.63Å; F238-M284 HydrophobicContact CZ-CB 3.83Å; F238-M284 HydrophobicContact CZ-CG 4.18Å; F238-I299 HydrophobicContact CD1-CD1 3.61Å; F238-I299 HydrophobicContact CE1-CD1 4.07Å; F238-S419 WeakPolarHBondContact CE2-OG 3.3Å
239	Y	89.9	Confident	81	Confident	37 Å²	37	52.8 Å²	52.8	15%	0.145	29%	0.293	C	S	.	.	H	α-helix	trans	-61.8	-45.6	179.5	-176.3	-96.5	0	0	0	111.9	I235 K236 S242 S243 R282 I299 S301 L589	I235-Y239 WeakPolarHBondContact O-CB 3.3Å; I235-Y239 PolarHBondContact O-N 3.16Å; K236-Y239 PolarHBondContact O-N 3.35Å; Y239-S242 PolarHBondContact O-N 2.9Å; Y239-S243 PolarHBondContact O-N 3.07Å; Y239-S243 PolarHBondContact O-OG 2.71Å; Y239-S243 VanDerWaalsContact O-OG 3.07Å; Y239-R282 HydrophobicContact CD2-CG 4.2Å; Y239-R282 HydrophobicContact CE2-CG 4.26Å; Y239-I299 HydrophobicContact CD2-CB 4.48Å; Y239-I299 HydrophobicContact CD2-CG2 3.71Å; Y239-I299 HydrophobicContact CE2-CG2 4.49Å; Y239-I299 HydrophobicContact CG-CG2 4.31Å; Y239-S301 VanDerWaalsContact OH-CB 3.3Å; Y239-S301 WeakPolarHBondContact OH-CB 3.3Å; Y239-L589 HydrophobicContact CD1-CD2 4.12Å; Y239-L589 HydrophobicContact CD2-CD2 4.43Å; Y239-L589 HydrophobicContact CE1-CD2 4.32Å; Y239-L589 HydrophobicContact CG-CD2 4.18Å
240	D	88.8	Confident	78.5	Confident	52 Å²	52	58.2 Å²	58.2	28%	0.278	32%	0.322	S	S	.	.	H	α-helix	trans	-67.2	-41.4	179.9	-70	-14.1	0	0	0	111.9	K236 S242 S243 Q244	K236-D240 WeakPolarHBondContact CE-OD1 3.39Å; K236-D240 WeakPolarHBondContact CE-OD2 3.44Å; K236-D240 IonicContact NZ-OD1 3.68Å; K236-D240 PolarHBondContact NZ-OD1 2.84Å; K236-D240 IonicContact NZ-OD2 3.8Å; K236-D240 PolarHBondContact NZ-OD2 2.83Å; K236-D240 WeakPolarHBondContact O-CB 3.46Å; K236-D240 PolarHBondContact O-N 2.78Å; D240-S242 VanDerWaalsContact C-N 3.34Å; D240-S242 PolarHBondContact O-N 3.2Å; D240-S243 WeakPolarHBondContact CA-OG 3.31Å; D240-S243 PolarHBondContact O-N 2.69Å; D240-S243 PolarHBondContact O-OG 3.09Å; D240-Q244 WeakPolarHBondContact O-CB 3.27Å; D240-Q244 VanDerWaalsContact O-CG 3.23Å; D240-Q244 WeakPolarHBondContact O-CG 3.44Å; D240-Q244 PolarHBondContact O-N 2.81Å; D240-Q244 VanDerWaalsContact O-N 3.08Å
241	R	85.8	Confident	75.7	Confident	178 Å²	178	64.5 Å²	64.5	67%	0.672	36%	0.355	S	S	*	.	H	α-helix	trans	-63.1	-41.9	174.4	-177.8	-178.4	-74.1	-104.2	2	111.8	Q237 F238 A245	Q237-R241 WeakPolarHBondContact O-CB 3Å; Q237-R241 PolarHBondContact O-N 2.78Å; F238-R241 PolarHBondContact O-N 3.17Å; R241-A245 PolarHBondContact O-N 2.97Å; R241-A245 VanDerWaalsContact O-N 3.09Å
242	S	81	Confident	73.1	Confident	7 Å²	7	67.8 Å²	67.8	5%	0.049	37%	0.373	C	S	.	.	H	α-helix	trans	-67.5	-39.3	-179.4	-65.5	0	0	0	0	112.2	F238 Y239 D240 C246 R282	F238-S242 VanDerWaalsContact O-CB 3.26Å; F238-S242 WeakPolarHBondContact O-CB 3.11Å; F238-S242 PolarHBondContact O-N 3.48Å; F238-S242 PolarHBondContact O-OG 3.25Å; Y239-S242 PolarHBondContact O-N 2.9Å; D240-S242 VanDerWaalsContact C-N 3.34Å; D240-S242 PolarHBondContact O-N 3.2Å; S242-C246 PolarHBondContact O-N 2.85Å; S242-R282 VanDerWaalsContact C-NH1 3.34Å; S242-R282 PolarHBondContact O-NH1 3.13Å
243	S	75.1	Confident	70.1	Confident	38 Å²	38	73.8 Å²	73.8	27%	0.266	41%	0.405	S	S	.	.	H	α-helix	trans	-67.1	-43.2	176.1	55.1	0	0	0	0	112	Y239 D240 A245 C246 S247	Y239-S243 PolarHBondContact O-N 3.07Å; Y239-S243 PolarHBondContact O-OG 2.71Å; Y239-S243 VanDerWaalsContact O-OG 3.07Å; D240-S243 WeakPolarHBondContact CA-OG 3.31Å; D240-S243 PolarHBondContact O-N 2.69Å; D240-S243 PolarHBondContact O-OG 3.09Å; S243-A245 PolarHBondContact O-N 2.89Å; S243-C246 PolarHBondContact O-N 3.21Å; S243-S247 PolarHBondContact O-N 2.9Å; S243-S247 PolarHBondContact O-OG 3.35Å
244	Q	72.1	Confident	67.2	Low	124 Å²	124	77.7 Å²	77.7	58%	0.579	42%	0.42	S	S	*	.	H	α-helix	trans	-62.5	-38.6	176.2	-71	170.6	12.2	0	0	113.5	D240 C246 S247 T248	D240-Q244 WeakPolarHBondContact O-CB 3.27Å; D240-Q244 VanDerWaalsContact O-CG 3.23Å; D240-Q244 WeakPolarHBondContact O-CG 3.44Å; D240-Q244 PolarHBondContact O-N 2.81Å; D240-Q244 VanDerWaalsContact O-N 3.08Å; Q244-C246 VanDerWaalsContact C-N 3.3Å; Q244-C246 PolarHBondContact O-N 3.06Å; Q244-S247 PolarHBondContact O-N 3.29Å; Q244-T248 PolarHBondContact O-N 3.12Å; Q244-T248 PolarHBondContact O-OG1 3.48Å
245	A	67.4	Low	64.3	Low	55 Å²	55	87.7 Å²	87.7	46%	0.455	46%	0.455	S	S	.	.	H	α-helix	trans	-60.6	-38.6	177.3	0	0	0	0	0	112.2	R241 S243 G249	R241-A245 PolarHBondContact O-N 2.97Å; R241-A245 VanDerWaalsContact O-N 3.09Å; S243-A245 PolarHBondContact O-N 2.89Å; A245-G249 PolarHBondContact O-N 3.08Å
246	C	57	Low	61.5	Low	49 Å²	49	92.7 Å²	92.7	33%	0.331	49%	0.489	S	S	.	.	H	α-helix	trans	-69.8	-37.7	175.5	-73.5	0	0	0	0	112.8	S242 S243 Q244 R282	S242-C246 PolarHBondContact O-N 2.85Å; S243-C246 PolarHBondContact O-N 3.21Å; Q244-C246 VanDerWaalsContact C-N 3.3Å; Q244-C246 PolarHBondContact O-N 3.06Å; C246-R282 VanDerWaalsContact SG-CZ 3.58Å; C246-R282 PolarHBondContact SG-NH1 3.42Å; C246-R282 PolarHBondContact SG-NH2 3.02Å
247	S	53.9	Low	58.4	Low	75 Å²	75	94.1 Å²	94.1	52%	0.524	52%	0.516	S	S	.	.	H	α-helix	trans	-67.8	-35.4	177.3	-56.3	0	0	0	0	112.7	S243 Q244 N250	S243-S247 PolarHBondContact O-N 2.9Å; S243-S247 PolarHBondContact O-OG 3.35Å; Q244-S247 PolarHBondContact O-N 3.29Å; S247-N250 PolarHBondContact O-N 3.26Å
248	T	50.9	Low	55.7	Low	80 Å²	80	98 Å²	98	49%	0.491	53%	0.526	S	S	.	.	H	α-helix	trans	-72.1	-33.2	-177.3	-44.9	0	0	0	0	112.2	Q244 N250 L251	Q244-T248 PolarHBondContact O-N 3.12Å; Q244-T248 PolarHBondContact O-OG1 3.48Å; T248-N250 PolarHBondContact O-N 3.12Å; T248-L251 PolarHBondContact O-N 3.23Å; T248-L251 VanDerWaalsContact O-N 3.12Å
249	G	48.1	Very low	52.8	Low	43 Å²	43	108.5 Å²	108.5	44%	0.443	57%	0.565	S	S	.	*	H	α-helix	trans	-59.2	-30.1	174.4	0	0	0	0	0	113.7	A245	A245-G249 PolarHBondContact O-N 3.08Å
250	N	40.3	Very low	50	Low	123 Å²	123	114.4 Å²	114.4	66%	0.658	60%	0.6	S	S	*	*	H	α-helix	trans	-79.2	-21.5	177.5	-72.7	-14.8	0	0	0	113.5	S247 T248	S247-N250 PolarHBondContact O-N 3.26Å; T248-N250 PolarHBondContact O-N 3.12Å
251	L	36.6	Very low	47.3	Very low	133 Å²	133	119.9 Å²	119.9	70%	0.696	63%	0.629	S	S	*	*	H	α-helix	trans	-84	-24.2	179.9	-75.7	167.1	0	0	0	113.5	T248 N253	T248-L251 PolarHBondContact O-N 3.23Å; T248-L251 VanDerWaalsContact O-N 3.12Å; L251-N253 VanDerWaalsContact C-N 3.27Å; L251-N253 PolarHBondContact O-N 3.02Å
252	V	38.2	Very low	44.8	Very low	109 Å²	109	122.4 Å²	122.4	66%	0.661	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-73.3	-19.2	-179.2	-177.3	0	0	0	0	112.4	H254	V252-H254 PolarHBondContact O-N 3.25Å
253	N	33	Very low	42.4	Very low	135 Å²	135	131.2 Å²	131.2	72%	0.722	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-86.4	2.1	179.8	-74.4	-17.1	0	0	0	115.2	L251	L251-N253 VanDerWaalsContact C-N 3.27Å; L251-N253 PolarHBondContact O-N 3.02Å
254	H	31.1	Very low	40.2	Very low	167 Å²	167	134.9 Å²	134.9	77%	0.773	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-105.9	9.1	178.3	-73	-62.3	0	0	0	115.6	V252	V252-H254 PolarHBondContact O-N 3.25Å
255	R	32.4	Very low	38	Very low	243 Å²	243	135.1 Å²	135.1	92%	0.917	71%	0.712	S	S	*	*	S	Bend	trans	-112.3	6.4	178.9	-134.6	-177.8	-170.2	-155.4	2.2	117.4	G257	R255-G257 PolarHBondContact O-N 3.38Å
256	S	34.3	Very low	36.2	Very low	104 Å²	104	137.7 Å²	137.7	73%	0.727	73%	0.727	S	S	*	*			trans	-100.7	73.9	164.6	-171.6	0	0	0	0	110.2	Y258	S256-Y258 PolarHBondContact O-N 3.47Å
257	G	28.6	Very low	34.9	Very low	72 Å²	72	143.7 Å²	143.7	74%	0.742	74%	0.744	S	S	*	*			trans	-70.1	78.2	160.9	0	0	0	0	0	109.7	R255	R255-G257 PolarHBondContact O-N 3.38Å
258	Y	34.6	Very low	34	Very low	217 Å²	217	151 Å²	151	85%	0.851	76%	0.761	S	S	*	*			trans	-123.4	114.7	153.2	-95.4	-89	0	0	0	107.7	S256 D260	S256-Y258 PolarHBondContact O-N 3.47Å; Y258-D260 PolarHBondContact O-N 3.5Å
259	R	29.9	Very low	33	Very low	237 Å²	237	153.3 Å²	153.3	89%	0.894	78%	0.781	S	S	*	*			trans	-50.1	122.6	176.3	-68.5	167.5	155.9	162.3	-7.1	110
260	D	31.2	Very low	32.2	Very low	161 Å²	161	155.6 Å²	155.6	86%	0.861	79%	0.79	S	S	*	*			trans	-151.8	107.5	136.3	-94.3	-29.2	0	0	0	109.8	Y258 R262	Y258-D260 PolarHBondContact O-N 3.5Å; D260-R262 PolarHBondContact O-N 3.46Å; D260-R262 VanDerWaalsContact O-N 3.15Å
261	N	32.4	Very low	31.7	Very low	168 Å²	168	155 Å²	155	90%	0.898	80%	0.796	S	S	*	*			trans	-59.7	105.1	162.3	-82.8	-21.2	0	0	0	108.9
262	R	32.4	Very low	31.4	Very low	231 Å²	231	153.7 Å²	153.7	87%	0.872	80%	0.797	S	S	*	*			trans	-141	109.5	151	-73.7	-165.8	-176.7	-179.8	1.5	110.1	D260	D260-R262 PolarHBondContact O-N 3.46Å; D260-R262 VanDerWaalsContact O-N 3.15Å
263	M	30.3	Very low	31.1	Very low	191 Å²	191	153.6 Å²	153.6	94%	0.941	80%	0.799	S	S	*	*			trans	-51.7	136.5	165.3	-67.6	145	107.2	0	0	110.4
264	S	30.4	Very low	31.2	Very low	115 Å²	115	152.7 Å²	152.7	80%	0.804	80%	0.8	S	S	*	*			trans	-154.2	106.7	146.1	-28.2	0	0	0	0	111.3
265	N	25.8	Very low	31.4	Very low	130 Å²	130	151.7 Å²	151.7	70%	0.695	80%	0.801	S	S	*	*			trans	45.5	96.1	147	-81.5	-1.7	0	0	0	120.2	Y267	N265-Y267 HydrophobicContact CB-CD2 4.38Å; N265-Y267 PolarHBondContact O-N 2.88Å
266	S	28	Very low	31.6	Very low	108 Å²	108	144.9 Å²	144.9	76%	0.755	78%	0.782	S	S	*	*				-50.9	101.8	121.6	52.4	0	0	0	0	111.3
267	Y	30.6	Very low	32.1	Very low	176 Å²	176	143 Å²	143	69%	0.69	76%	0.764	S	S	*	*			trans	-163.7	82	151.1	-80.6	-66.6	0	0	0	108.2	N265	N265-Y267 HydrophobicContact CB-CD2 4.38Å; N265-Y267 PolarHBondContact O-N 2.88Å
268	Y	35.7	Very low	33	Very low	228 Å²	228	144.7 Å²	144.7	89%	0.894	75%	0.748	S	S	*	*			trans	-166	71.9	137.2	-75.6	-59.9	0	0	0	105.9	S270	Y268-S270 PolarHBondContact O-N 3.25Å
269	S	28.4	Very low	34.1	Very low	129 Å²	129	139 Å²	139	90%	0.902	74%	0.736	S	S	*	*			trans	-72.8	68.2	157.6	-70.3	0	0	0	0	107.7	S271	S269-S271 PolarHBondContact O-N 2.95Å
270	S	31.8	Very low	36.4	Very low	91 Å²	91	128.8 Å²	128.8	64%	0.636	70%	0.701	S	S	*	*			trans	-70.8	116.1	151.5	42.1	0	0	0	0	104.8	Y268 S272	Y268-S270 PolarHBondContact O-N 3.25Å; S270-S272 PolarHBondContact O-N 3.43Å
271	S	29.9	Very low	39.1	Very low	111 Å²	111	121.7 Å²	121.7	78%	0.776	66%	0.664	S	S	*	*			trans	-32.6	103	170.2	47.1	0	0	0	0	109.7	S269	S269-S271 PolarHBondContact O-N 2.95Å
272	S	30.4	Very low	41.7	Very low	105 Å²	105	115.2 Å²	115.2	73%	0.734	63%	0.627	S	S	*	*			trans	-56.8	126.7	172.3	-56.6	0	0	0	0	105.6	S270	S270-S272 PolarHBondContact O-N 3.43Å
273	P	31.9	Very low	44.6	Very low	107 Å²	107	105.3 Å²	105.3	70%	0.695	59%	0.59	S	S	*	*	S	Bend	trans	-52.2	152.8	174.2	22.8	-30.8	0	0	0	108.4	N275	P273-N275 PolarHBondContact O-N 3.28Å; P273-N275 VanDerWaalsContact O-N 3.09Å
274	P	35.7	Very low	47.6	Very low	115 Å²	115	96.2 Å²	96.2	75%	0.747	55%	0.545	S	S	*	.	S	Bend	trans	-41.6	123.9	-170	16.6	-31.3	0	0	0	109.4	I276	P274-I276 PolarHBondContact O-N 3.16Å
275	N	35	Very low	50.6	Low	146 Å²	146	94.6 Å²	94.6	78%	0.781	52%	0.521	S	S	*	.			trans	-57.2	77.8	-168.8	-167.1	-9.3	0	0	0	110.4	P273 D277	P273-N275 PolarHBondContact O-N 3.28Å; P273-N275 VanDerWaalsContact O-N 3.09Å; N275-D277 PolarHBondContact O-N 2.98Å; N275-D277 VanDerWaalsContact O-N 3.07Å
276	I	36.3	Very low	53.8	Low	101 Å²	101	88.4 Å²	88.4	52%	0.518	49%	0.488	S	S	.	.			trans	-68.4	105.5	167.3	-68.1	168.1	0	0	0	103.5	P274 Y278	P274-I276 PolarHBondContact O-N 3.16Å; I276-Y278 HydrophobicContact CB-CD2 4.23Å; I276-Y278 HydrophobicContact CB-CE2 3.86Å; I276-Y278 HydrophobicContact CG2-CD1 4.46Å; I276-Y278 HydrophobicContact CG2-CD2 3.89Å; I276-Y278 HydrophobicContact CG2-CE1 4.23Å; I276-Y278 HydrophobicContact CG2-CE2 3.61Å; I276-Y278 HydrophobicContact CG2-CG 4.3Å; I276-Y278 WeakPolarHBondContact O-CD2 3.35Å; I276-Y278 PolarHBondContact O-N 2.82Å
277	D	45.8	Very low	56.7	Low	65 Å²	65	86.3 Å²	86.3	35%	0.348	47%	0.468	S	S	.	.			trans	-72.5	71.2	-176.5	-167.9	8.9	0	0	0	110	N275 T279 S280	N275-D277 PolarHBondContact O-N 2.98Å; N275-D277 VanDerWaalsContact O-N 3.07Å; D277-T279 PolarHBondContact O-N 3.01Å; D277-T279 WeakPolarHBondContact OD1-CB 3.44Å; D277-T279 PolarHBondContact OD1-OG1 3.41Å; D277-S280 PolarHBondContact O-N 3.23Å; D277-S280 VanDerWaalsContact O-N 3.13Å
278	Y	46.7	Very low	59.3	Low	106 Å²	106	78.1 Å²	78.1	42%	0.416	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-14.6	172.1	-70.7	-81.6	0	0	0	111.9	I276 S280	I276-Y278 HydrophobicContact CB-CD2 4.23Å; I276-Y278 HydrophobicContact CB-CE2 3.86Å; I276-Y278 HydrophobicContact CG2-CD1 4.46Å; I276-Y278 HydrophobicContact CG2-CD2 3.89Å; I276-Y278 HydrophobicContact CG2-CE1 4.23Å; I276-Y278 HydrophobicContact CG2-CE2 3.61Å; I276-Y278 HydrophobicContact CG2-CG 4.3Å; I276-Y278 WeakPolarHBondContact O-CD2 3.35Å; I276-Y278 PolarHBondContact O-N 2.82Å; Y278-S280 VanDerWaalsContact C-N 3.27Å; Y278-S280 PolarHBondContact O-N 3.22Å
279	T	58.3	Low	61.3	Low	99 Å²	99	68.8 Å²	68.8	61%	0.607	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-18.5	179.9	84.3	0	0	0	0	113.2	D277	D277-T279 PolarHBondContact O-N 3.01Å; D277-T279 WeakPolarHBondContact OD1-CB 3.44Å; D277-T279 PolarHBondContact OD1-OG1 3.41Å
280	S	77.7	Confident	63.5	Low	21 Å²	21	70.2 Å²	70.2	15%	0.147	40%	0.397	C	S	.	.	S	Bend	trans	-82.4	-30.5	-178.2	-173.9	0	0	0	0	113.4	D277 Y278	D277-S280 PolarHBondContact O-N 3.23Å; D277-S280 VanDerWaalsContact O-N 3.13Å; Y278-S280 VanDerWaalsContact C-N 3.27Å; Y278-S280 PolarHBondContact O-N 3.22Å
281	T	87.1	Confident	65.5	Low	13 Å²	13	69.8 Å²	69.8	8%	0.08	40%	0.399	C	S	.	.			trans	-91.2	133.4	-176.6	-54.9	0	0	0	0	110.8	F283 A298 I299	T281-F283 HydrophobicContact CG2-CE1 4.4Å; T281-F283 HydrophobicContact CG2-CE2 4.22Å; T281-F283 HydrophobicContact CG2-CZ 3.99Å; T281-A298 HydrophobicContact CG2-CB 3.78Å; T281-I299 WeakPolarHBondContact CA-O 3.11Å
282	R	88.6	Confident	68.1	Low	32 Å²	32	69.2 Å²	69.2	12%	0.121	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	131.6	179.8	-57.2	-57.8	179.4	124.8	-0.8	110.2	F238 Y239 S242 C246 A298 I299	F238-R282 HydrophobicContact CE1-CB 4.01Å; Y239-R282 HydrophobicContact CD2-CG 4.2Å; Y239-R282 HydrophobicContact CE2-CG 4.26Å; S242-R282 VanDerWaalsContact C-NH1 3.34Å; S242-R282 PolarHBondContact O-NH1 3.13Å; C246-R282 VanDerWaalsContact SG-CZ 3.58Å; C246-R282 PolarHBondContact SG-NH1 3.42Å; C246-R282 PolarHBondContact SG-NH2 3.02Å; R282-A298 CarbonylContact O-C 3.54Å; R282-I299 PolarHBondContact N-O 3.02Å; R282-I299 PolarHBondContact O-N 3.45Å
283	F	91.9	Very high	70.9	Confident	22 Å²	22	65.1 Å²	65.1	10%	0.096	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	109.1	-176.9	-61.3	-89	0	0	0	109.6	M172 N173 F238 T281 E296 A298 T594	M172-F283 HydrophobicContact CB-CE1 4.49Å; N173-F283 HydrophobicContact CB-CD2 4.36Å; N173-F283 HydrophobicContact CB-CE2 4.11Å; F238-F283 WeakPolarHBondContact CZ-O 3.37Å; T281-F283 HydrophobicContact CG2-CE1 4.4Å; T281-F283 HydrophobicContact CG2-CE2 4.22Å; T281-F283 HydrophobicContact CG2-CZ 3.99Å; F283-E296 HydrophobicContact CB-CG 4.05Å; F283-E296 HydrophobicContact CD1-CG 4.42Å; F283-A298 HydrophobicContact CD1-CB 4.03Å; F283-A298 HydrophobicContact CE1-CB 3.85Å; F283-T594 HydrophobicContact CD1-CG2 4.06Å; F283-T594 HydrophobicContact CE1-CG2 3.94Å
284	M	93.4	Very high	73.9	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	118.3	176.1	-173.4	175.5	67.3	0	0	109.6	V230 I235 F238 V286 E296 I297 I299 P415	V230-M284 HydrophobicContact CG1-CE 4.02Å; I235-M284 HydrophobicContact CG1-CE 3.73Å; F238-M284 HydrophobicContact CB-CG 4.38Å; F238-M284 HydrophobicContact CB-SD 3.6Å; F238-M284 HydrophobicContact CD1-CB 3.64Å; F238-M284 HydrophobicContact CD1-CG 3.89Å; F238-M284 HydrophobicContact CD1-SD 3.98Å; F238-M284 HydrophobicContact CD2-CB 4.34Å; F238-M284 HydrophobicContact CD2-CG 3.85Å; F238-M284 HydrophobicContact CD2-SD 4.16Å; F238-M284 HydrophobicContact CE1-CB 3.51Å; F238-M284 HydrophobicContact CE1-CG 4.1Å; F238-M284 HydrophobicContact CE2-CB 4.23Å; F238-M284 HydrophobicContact CE2-CG 4.06Å; F238-M284 HydrophobicContact CG-CB 4.06Å; F238-M284 HydrophobicContact CG-CG 3.75Å; F238-M284 HydrophobicContact CG-SD 3.63Å; F238-M284 HydrophobicContact CZ-CB 3.83Å; F238-M284 HydrophobicContact CZ-CG 4.18Å; M284-V286 HydrophobicContact CE-CG1 3.72Å; M284-V286 HydrophobicContact CG-CG1 4.19Å; M284-V286 HydrophobicContact SD-CG1 4.37Å; M284-E296 CarbonylContact O-C 3.37Å; M284-E296 WeakPolarHBondContact O-CA 3.45Å; M284-I297 HydrophobicContact CE-CD1 4.28Å; M284-I297 PolarHBondContact N-O 3.22Å; M284-I297 PolarHBondContact O-N 3.05Å; M284-I299 HydrophobicContact CB-CD1 3.53Å; M284-I299 HydrophobicContact CB-CG1 4.5Å; M284-I299 HydrophobicContact CE-CD1 4.07Å; M284-I299 HydrophobicContact CG-CD1 4.39Å; M284-I299 HydrophobicContact SD-CD1 4.08Å; M284-P415 HydrophobicContact SD-CG 4.3Å
285	R	93.2	Very high	76.8	Confident	82 Å²	82	55.5 Å²	55.5	31%	0.309	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	127.4	172	-172.7	171.9	-59.5	-161.9	-0.6	110.5	A295 E296 S416	R285-A295 CarbonylContact C-O 3.59Å; R285-A295 WeakPolarHBondContact CA-O 3.49Å; R285-E296 IonicContact CZ-OE2 3.85Å; R285-E296 IonicContact NE-OE2 3.24Å; R285-E296 IonicContact NH2-OE2 3.84Å; R285-E296 PolarHBondContact NH2-OE2 3.44Å; R285-S416 WeakPolarHBondContact CB-OG 3.38Å; R285-S416 WeakPolarHBondContact O-CB 3.44Å; R285-S416 PolarHBondContact O-N 3.28Å; R285-S416 PolarHBondContact O-OG 3.49Å
286	V	93.1	Very high	79.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	144.5	179.7	-62.3	0	0	0	0	110.9	V230 M284 S294 A295 I297 L413 H414	V230-V286 HydrophobicContact CG2-CG1 4.18Å; M284-V286 HydrophobicContact CE-CG1 3.72Å; M284-V286 HydrophobicContact CG-CG1 4.19Å; M284-V286 HydrophobicContact SD-CG1 4.37Å; V286-S294 CarbonylContact O-C 3.6Å; V286-S294 WeakPolarHBondContact O-CA 3.19Å; V286-S294 WeakPolarHBondContact O-CB 3.5Å; V286-A295 HydrophobicContact CG2-CB 3.93Å; V286-A295 WeakPolarHBondContact CG2-O 3.33Å; V286-A295 PolarHBondContact N-O 2.89Å; V286-A295 PolarHBondContact O-N 3.29Å; V286-I297 HydrophobicContact CG2-CD1 4.4Å; V286-L413 HydrophobicContact CB-CB 3.97Å; V286-L413 HydrophobicContact CG2-CB 4.03Å; V286-L413 HydrophobicContact CG2-CD1 3.84Å; V286-H414 CarbonylContact C-O 3.53Å; V286-H414 VanDerWaalsContact CA-O 3.3Å; V286-H414 WeakPolarHBondContact CA-O 3.44Å
287	I	90.5	Very high	82.4	Confident	63 Å²	63	44.7 Å²	44.7	32%	0.323	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	135.2	-179.6	-58.9	174.5	0	0	0	108.9	A291 L413 H414	I287-A291 HydrophobicContact CG2-CB 4.2Å; I287-L413 VanDerWaalsContact O-CD2 3.24Å; I287-L413 WeakPolarHBondContact O-CD2 3.16Å; I287-H414 PolarHBondContact N-O 2.75Å
288	G	85	Confident	84.7	Confident	5 Å²	5	41.7 Å²	41.7	5%	0.052	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-65.3	170	177.2	0	0	0	0	0	114.3	F226 A291 K292 G293	F226-G288 VanDerWaalsContact CE2-CA 3.47Å; G288-A291 PolarHBondContact O-N 3.23Å; G288-A291 VanDerWaalsContact O-N 3.16Å; G288-K292 WeakPolarHBondContact CA-O 3.32Å; G288-G293 PolarHBondContact N-O 3.06Å
289	P	77	Confident	87	Confident	31 Å²	31	36.7 Å²	36.7	20%	0.201	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-58.9	143.9	178.8	-19.6	33.5	0	0	0	111.1	L227 A291 K292 P411 L413	L227-P289 WeakPolarHBondContact O-CG 3.41Å; P289-A291 PolarHBondContact O-N 2.9Å; P289-K292 WeakPolarHBondContact O-CB 3.49Å; P289-K292 PolarHBondContact O-N 3.35Å; P289-P411 HydrophobicContact CB-CB 3.72Å; P289-P411 HydrophobicContact CB-CG 3.5Å; P289-P411 VanDerWaalsContact CB-CG 3.5Å; P289-P411 HydrophobicContact CG-CB 3.86Å; P289-P411 HydrophobicContact CG-CG 3.2Å; P289-L413 HydrophobicContact CG-CD2 4.36Å
290	Q	75.1	Confident	88.5	Confident	159 Å²	159	35.6 Å²	35.6	74%	0.743	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	56.2	21.9	-177.9	-51.2	175.9	-12.7	0	0	113.8	K292	Q290-K292 HydrophobicContact CB-CD 4.33Å; Q290-K292 HydrophobicContact CB-CG 4.31Å; Q290-K292 PolarHBondContact O-N 2.9Å
291	A	73.9	Confident	89.1	Confident	82 Å²	82	36 Å²	36	68%	0.678	19%	0.191	S	C	*	.	G	3₁₀ helix	trans	60.1	21.5	-170.1	0	0	0	0	0	114.8	I287 G288 P289	I287-A291 HydrophobicContact CG2-CB 4.2Å; G288-A291 PolarHBondContact O-N 3.23Å; G288-A291 VanDerWaalsContact O-N 3.16Å; P289-A291 PolarHBondContact O-N 2.9Å
292	K	82.6	Confident	88.8	Confident	100 Å²	100	38.7 Å²	38.7	44%	0.435	20%	0.204	S	C	.	.			trans	-90.8	111.6	176.3	-69.8	177.7	176	168.1	0	109.8	G288 P289 Q290 N602	G288-K292 WeakPolarHBondContact CA-O 3.32Å; P289-K292 WeakPolarHBondContact O-CB 3.49Å; P289-K292 PolarHBondContact O-N 3.35Å; Q290-K292 HydrophobicContact CB-CD 4.33Å; Q290-K292 HydrophobicContact CB-CG 4.31Å; Q290-K292 PolarHBondContact O-N 2.9Å; K292-N602 WeakPolarHBondContact CB-ND2 3.42Å; K292-N602 WeakPolarHBondContact CG-ND2 3Å
293	G	91.3	Very high	87.9	Confident	18 Å²	18	44.1 Å²	44.1	19%	0.186	23%	0.228	C	C	.	.			trans	72	-176	179.4	0	0	0	0	0	114.2	G288 T597	G288-G293 PolarHBondContact N-O 3.06Å; G293-T597 CarbonylContact C-O 3.47Å; G293-T597 WeakPolarHBondContact CA-O 3.48Å
294	S	94.5	Very high	86	Confident	21 Å²	21	48.8 Å²	48.8	15%	0.147	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	160.7	177.2	66.4	0	0	0	0	111	V286 T597	V286-S294 CarbonylContact O-C 3.6Å; V286-S294 WeakPolarHBondContact O-CA 3.19Å; V286-S294 WeakPolarHBondContact O-CB 3.5Å; S294-T597 PolarHBondContact N-O 3.44Å; S294-T597 PolarHBondContact O-N 2.81Å; S294-T597 WeakPolarHBondContact OG-CG2 3.43Å
295	A	95.5	Very high	83.6	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	152.2	171.8	0	0	0	0	0	109.6	F226 R285 V286 F595 I596	F226-A295 HydrophobicContact CE1-CB 4.19Å; F226-A295 HydrophobicContact CZ-CB 3.95Å; R285-A295 CarbonylContact C-O 3.59Å; R285-A295 WeakPolarHBondContact CA-O 3.49Å; V286-A295 HydrophobicContact CG2-CB 3.93Å; V286-A295 WeakPolarHBondContact CG2-O 3.33Å; V286-A295 PolarHBondContact N-O 2.89Å; V286-A295 PolarHBondContact O-N 3.29Å; A295-F595 WeakPolarHBondContact CA-O 3.34Å; A295-I596 HydrophobicContact CB-CG1 4.11Å
296	E	94.6	Very high	80.8	Confident	19 Å²	19	55.1 Å²	55.1	9%	0.089	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	136.2	171.7	-174.8	-180	95	0	0	110	F283 M284 R285 P593 T594 F595	F283-E296 HydrophobicContact CB-CG 4.05Å; F283-E296 HydrophobicContact CD1-CG 4.42Å; M284-E296 CarbonylContact O-C 3.37Å; M284-E296 WeakPolarHBondContact O-CA 3.45Å; R285-E296 IonicContact CZ-OE2 3.85Å; R285-E296 IonicContact NE-OE2 3.24Å; R285-E296 IonicContact NH2-OE2 3.84Å; R285-E296 PolarHBondContact NH2-OE2 3.44Å; E296-P593 CarbonylContact O-C 3.56Å; E296-P593 WeakPolarHBondContact O-CA 3.46Å; E296-T594 VanDerWaalsContact CB-OG1 3.3Å; E296-T594 WeakPolarHBondContact CB-OG1 3.29Å; E296-T594 WeakPolarHBondContact CG-OG1 3.44Å; E296-T594 PolarHBondContact O-N 3.18Å; E296-T594 PolarHBondContact O-OG1 3.06Å; E296-T594 PolarHBondContact OE1-OG1 3.16Å; E296-F595 HydrophobicContact CB-CD1 3.8Å; E296-F595 HydrophobicContact CB-CE1 3.32Å; E296-F595 HydrophobicContact CB-CE2 4.1Å; E296-F595 HydrophobicContact CB-CG 4.38Å; E296-F595 HydrophobicContact CB-CZ 3.45Å; E296-F595 VanDerWaalsContact CB-CZ 3.45Å; E296-F595 HydrophobicContact CG-CE1 3.95Å; E296-F595 HydrophobicContact CG-CZ 4.35Å; E296-F595 PolarHBondContact N-O 3.44Å; E296-F595 WeakPolarHBondContact OE1-CE1 3.47Å; E296-F595 WeakPolarHBondContact OE2-CE1 3.29Å
297	I	95.2	Very high	77.9	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	117.9	-176.4	-56.8	176.6	0	0	0	107.7	V230 M284 V286 I299 A591	V230-I297 HydrophobicContact CG2-CD1 4.19Å; M284-I297 HydrophobicContact CE-CD1 4.28Å; M284-I297 PolarHBondContact N-O 3.22Å; M284-I297 PolarHBondContact O-N 3.05Å; V286-I297 HydrophobicContact CG2-CD1 4.4Å; I297-I299 HydrophobicContact CG2-CG1 4.13Å; I297-A591 HydrophobicContact CG2-CB 3.82Å
298	A	93.9	Very high	75	Confident	3 Å²	3	70.6 Å²	70.6	3%	0.025	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	123.8	167.8	0	0	0	0	0	109.5	Y193 T281 R282 F283 A591 S592 T594	Y193-A298 HydrophobicContact CD2-CB 3.97Å; Y193-A298 HydrophobicContact CE2-CB 3.57Å; T281-A298 HydrophobicContact CG2-CB 3.78Å; R282-A298 CarbonylContact O-C 3.54Å; F283-A298 HydrophobicContact CD1-CB 4.03Å; F283-A298 HydrophobicContact CE1-CB 3.85Å; A298-A591 WeakPolarHBondContact O-CA 3.35Å; A298-S592 PolarHBondContact N-O 3.44Å; A298-S592 PolarHBondContact O-N 2.96Å; A298-T594 HydrophobicContact CB-CG2 3.58Å
299	I	93.8	Very high	72.3	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	125.4	-177.4	-56.9	162	0	0	0	108.7	I235 F238 Y239 T281 R282 M284 I297 L589 I590	I235-I299 HydrophobicContact CG2-CD1 3.74Å; I235-I299 HydrophobicContact CG2-CG1 3.96Å; I235-I299 HydrophobicContact CG2-CG2 3.83Å; F238-I299 HydrophobicContact CD1-CD1 3.61Å; F238-I299 HydrophobicContact CE1-CD1 4.07Å; Y239-I299 HydrophobicContact CD2-CB 4.48Å; Y239-I299 HydrophobicContact CD2-CG2 3.71Å; Y239-I299 HydrophobicContact CE2-CG2 4.49Å; Y239-I299 HydrophobicContact CG-CG2 4.31Å; T281-I299 WeakPolarHBondContact CA-O 3.11Å; R282-I299 PolarHBondContact N-O 3.02Å; R282-I299 PolarHBondContact O-N 3.45Å; M284-I299 HydrophobicContact CB-CD1 3.53Å; M284-I299 HydrophobicContact CB-CG1 4.5Å; M284-I299 HydrophobicContact CE-CD1 4.07Å; M284-I299 HydrophobicContact CG-CD1 4.39Å; M284-I299 HydrophobicContact SD-CD1 4.08Å; I297-I299 HydrophobicContact CG2-CG1 4.13Å; I299-L589 HydrophobicContact CG2-CB 4.38Å; I299-L589 HydrophobicContact CG2-CD1 4.39Å; I299-L589 HydrophobicContact CG2-CD2 4.43Å; I299-I590 VanDerWaalsContact CA-O 3.31Å; I299-I590 WeakPolarHBondContact CA-O 3.35Å
300	K	90.6	Very high	69.9	Low	77 Å²	77	81.4 Å²	81.4	34%	0.335	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	136.4	177.5	-175.2	176.9	178.6	178.8	0	109.7	M302 L589 I590	K300-M302 PolarHBondContact O-N 3.1Å; K300-L589 CarbonylContact O-C 3.49Å; K300-L589 WeakPolarHBondContact O-CA 3.47Å; K300-I590 HydrophobicContact CB-CB 4.48Å; K300-I590 PolarHBondContact N-O 3.04Å; K300-I590 PolarHBondContact O-N 3.13Å
301	S	89.7	Confident	67.6	Low	29 Å²	29	79.6 Å²	79.6	20%	0.203	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	133.7	167.8	-178.3	0	0	0	0	109.1	Y239 K303	Y239-S301 VanDerWaalsContact OH-CB 3.3Å; Y239-S301 WeakPolarHBondContact OH-CB 3.3Å; S301-K303 PolarHBondContact O-N 3.46Å
302	M	81.9	Confident	65.3	Low	69 Å²	69	82.8 Å²	82.8	34%	0.34	43%	0.434	S	S	.	.			trans	-57.8	128.9	164.4	-73.4	-90.6	-87.1	0	0	108.4	V201 K300 N304 S588 I590	V201-M302 HydrophobicContact CG1-CG 4.36Å; V201-M302 HydrophobicContact CG2-CE 4.05Å; V201-M302 HydrophobicContact CG2-CG 4.39Å; V201-M302 HydrophobicContact CG2-SD 4Å; K300-M302 PolarHBondContact O-N 3.1Å; M302-N304 PolarHBondContact O-N 2.96Å; M302-S588 PolarHBondContact N-O 2.74Å; M302-I590 HydrophobicContact CG-CD1 4.11Å; M302-I590 HydrophobicContact CG-CG1 3.9Å; M302-I590 HydrophobicContact SD-CD1 3.68Å; M302-I590 HydrophobicContact SD-CG1 3.83Å
303	K	69.6	Low	62.6	Low	146 Å²	146	87.8 Å²	87.8	64%	0.635	46%	0.456	S	S	*	.			trans	-80.1	107.8	162.1	-67.2	-177.1	-178.7	-179.7	0	104.8	S301 V305	S301-K303 PolarHBondContact O-N 3.46Å; K303-V305 PolarHBondContact O-N 3.22Å
304	N	52.6	Low	59.5	Low	120 Å²	120	91.3 Å²	91.3	64%	0.642	48%	0.477	S	S	*	.			trans	-59.5	107	170.6	-70.3	-11.3	0	0	0	107.1	M302 T306	M302-N304 PolarHBondContact O-N 2.96Å; N304-T306 PolarHBondContact O-N 2.79Å
305	V	41	Very low	56.3	Low	137 Å²	137	99.5 Å²	99.5	83%	0.83	51%	0.513	S	S	*	.	S	Bend	trans	-73.8	57.7	164.4	-174	0	0	0	0	107.2	K303	K303-V305 PolarHBondContact O-N 3.22Å
306	T	35.7	Very low	53.2	Low	78 Å²	78	105.9 Å²	105.9	48%	0.479	55%	0.553	S	S	.	*			trans	-166.1	56.7	174.4	-10	0	0	0	0	110.3	N304 L311	N304-T306 PolarHBondContact O-N 2.79Å; T306-L311 HydrophobicContact CG2-CD1 3.82Å
307	Q	32.8	Very low	50.2	Low	189 Å²	189	114.1 Å²	114.1	88%	0.883	59%	0.591	S	S	*	*	S	Bend	trans	-132.5	10.9	147.9	-89.1	-171.6	5.5	0	0	112.6
308	Q	28.5	Very low	47.1	Very low	200 Å²	200	123.1 Å²	123.1	94%	0.935	63%	0.633	S	S	*	*	S	Bend	trans	-112.8	3.8	166.6	-91.3	174.9	-28.5	0	0	114.1
309	Q	27.7	Very low	43.9	Very low	137 Å²	137	131.5 Å²	131.5	64%	0.64	67%	0.674	S	S	*	*	S	Bend	trans	-124.5	99.6	161.5	-78.8	174.9	-11.7	0	0	107.2	L311	Q309-L311 VanDerWaalsContact C-N 3.26Å; Q309-L311 HydrophobicContact CB-CG 4.44Å; Q309-L311 PolarHBondContact O-N 3.47Å
310	S	26.6	Very low	40.7	Very low	125 Å²	125	139.3 Å²	139.3	87%	0.874	72%	0.716	S	S	*	*			trans	-53.2	96.1	153.8	47.6	0	0	0	0	107.4	D312	S310-D312 PolarHBondContact O-N 3Å
311	L	27.7	Very low	37.7	Very low	121 Å²	121	146.7 Å²	146.7	63%	0.634	74%	0.742	S	S	*	*			trans	-85.4	110.1	175.1	-86.3	156.1	0	0	0	108.1	T306 Q309	T306-L311 HydrophobicContact CG2-CD1 3.82Å; Q309-L311 VanDerWaalsContact C-N 3.26Å; Q309-L311 HydrophobicContact CB-CG 4.44Å; Q309-L311 PolarHBondContact O-N 3.47Å
312	D	24.7	Very low	34.8	Very low	150 Å²	150	150.4 Å²	150.4	80%	0.802	76%	0.763	S	S	*	*			trans	-51.7	127.9	162	-123.1	-26.6	0	0	0	109.1	S310 S314	S310-D312 PolarHBondContact O-N 3Å; D312-S314 VanDerWaalsContact C-N 3.33Å; D312-S314 PolarHBondContact O-N 3.11Å
313	F	26.6	Very low	32.2	Very low	205 Å²	205	153.9 Å²	153.9	90%	0.899	78%	0.783	S	S	*	*	S	Bend	trans	-79.7	79.3	178.7	-77.9	-87.3	0	0	0	109.9
314	S	26.6	Very low	30.4	Very low	91 Å²	91	154.7 Å²	154.7	64%	0.636	79%	0.787	S	S	*	*			trans	-159.1	72	165	63.4	0	0	0	0	111.6	D312	D312-S314 VanDerWaalsContact C-N 3.33Å; D312-S314 PolarHBondContact O-N 3.11Å
315	E	27.9	Very low	29.2	Very low	193 Å²	193	156.7 Å²	156.7	90%	0.902	80%	0.797	S	S	*	*			trans	-174.8	58.4	155.5	-106.8	165.6	-162.3	0	0	109.8	E317	E315-E317 PolarHBondContact O-N 3.31Å
316	T	28.7	Very low	28.8	Very low	134 Å²	134	155.4 Å²	155.4	82%	0.822	79%	0.79	S	S	*	*			trans	-94.3	66.3	169.4	49.5	0	0	0	0	109.9
317	E	31.6	Very low	28.5	Very low	192 Å²	192	161.2 Å²	161.2	90%	0.897	81%	0.808	S	S	*	*	S	Bend	trans	-140.8	-4.8	164.2	-79.9	-153.7	157.8	0	0	116.5	E315	E315-E317 PolarHBondContact O-N 3.31Å
318	E	30.2	Very low	28.2	Very low	189 Å²	189	156.2 Å²	156.2	88%	0.883	79%	0.793	S	S	*	*	S	Bend	trans	-110.3	2	-176.6	-87.4	-167	151.9	0	0	117.9	N320	E318-N320 PolarHBondContact O-N 3.41Å
319	M	27.3	Very low	28.3	Very low	179 Å²	179	151 Å²	151	88%	0.882	78%	0.777	S	S	*	*	S	Bend	trans	-92.3	19	-178.8	-76.1	-169.8	80.4	0	0	116.2
320	N	26.6	Very low	28.3	Very low	165 Å²	165	150.6 Å²	150.6	88%	0.882	78%	0.776	S	S	*	*	S	Bend	trans	-104.9	24	178.3	-87.1	-12.8	0	0	0	115	E318	E318-N320 PolarHBondContact O-N 3.41Å
321	R	27.7	Very low	28.4	Very low	232 Å²	232	149.2 Å²	149.2	88%	0.875	76%	0.764	S	S	*	*			trans	-129.2	2.8	180	-85.1	-161.4	-179.9	-166	3	118.9	N323	R321-N323 PolarHBondContact O-N 2.94Å
322	T	29.2	Very low	28.3	Very low	106 Å²	106	149.3 Å²	149.3	65%	0.65	77%	0.769	S	S	*	*			trans	-95.9	89.2	172.9	54.2	0	0	0	0	110.3	F324	T322-F324 WeakPolarHBondContact O-CD2 3.09Å; T322-F324 PolarHBondContact O-N 3.15Å
323	N	27.3	Very low	28.3	Very low	143 Å²	143	146.8 Å²	146.8	77%	0.765	76%	0.762	S	S	*	*			trans	-55.7	103.2	162.9	-72.8	-25.9	0	0	0	108.7	R321 L325	R321-N323 PolarHBondContact O-N 2.94Å; N323-L325 PolarHBondContact O-N 2.97Å
324	F	31.4	Very low	28.2	Very low	163 Å²	163	143 Å²	143	72%	0.715	76%	0.758	S	S	*	*			trans	-71.1	96.5	169.9	-86.4	-93.6	0	0	0	108.2	T322 T326	T322-F324 WeakPolarHBondContact O-CD2 3.09Å; T322-F324 PolarHBondContact O-N 3.15Å; F324-T326 PolarHBondContact O-N 3.18Å; F324-T326 VanDerWaalsContact O-N 3.11Å
325	L	28	Very low	28.1	Very low	161 Å²	161	142.8 Å²	142.8	84%	0.843	76%	0.756	S	S	*	*			trans	-64.3	102.8	167.1	-86.7	149.1	0	0	0	109	N323 K327	N323-L325 PolarHBondContact O-N 2.97Å; L325-K327 PolarHBondContact O-N 3.01Å; L325-K327 VanDerWaalsContact O-N 3.16Å
326	T	33.1	Very low	28.1	Very low	111 Å²	111	143.2 Å²	143.2	68%	0.681	76%	0.759	S	S	*	*			trans	-65	106.8	170.7	-15.9	0	0	0	0	108.8	F324 C328	F324-T326 PolarHBondContact O-N 3.18Å; F324-T326 VanDerWaalsContact O-N 3.11Å; T326-C328 VanDerWaalsContact C-N 3.29Å; T326-C328 PolarHBondContact O-N 2.7Å
327	K	27.7	Very low	28	Very low	199 Å²	199	141.6 Å²	141.6	87%	0.865	75%	0.753	S	S	*	*			trans	-67.4	89.9	166.4	-81.6	-175.3	175.7	-178	0	108.5	L325 C329	L325-K327 PolarHBondContact O-N 3.01Å; L325-K327 VanDerWaalsContact O-N 3.16Å; K327-C329 PolarHBondContact O-N 3.02Å
328	C	28.1	Very low	27.8	Very low	85 Å²	85	141.5 Å²	141.5	57%	0.574	75%	0.752	S	S	*	*			trans	-71.6	104.2	162.6	-68.4	0	0	0	0	106.9	T326 Q330	T326-C328 VanDerWaalsContact C-N 3.29Å; T326-C328 PolarHBondContact O-N 2.7Å; C328-Q330 VanDerWaalsContact C-N 3.29Å; C328-Q330 PolarHBondContact O-N 3.34Å
329	C	28.8	Very low	27.5	Very low	89 Å²	89	140.5 Å²	140.5	60%	0.601	75%	0.75	S	S	*	*			trans	-63.8	92.3	171.2	-62.3	0	0	0	0	108.6	K327	K327-C329 PolarHBondContact O-N 3.02Å
330	Q	28.1	Very low	27.3	Very low	129 Å²	129	139.7 Å²	139.7	60%	0.603	74%	0.744	S	S	*	*			trans	-63.8	146.9	156.8	-69.2	-114.3	-56.3	0	0	107.9	C328 V332	C328-Q330 VanDerWaalsContact C-N 3.29Å; C328-Q330 PolarHBondContact O-N 3.34Å; Q330-V332 PolarHBondContact O-N 3.4Å
331	P	28.3	Very low	27.2	Very low	96 Å²	96	141.7 Å²	141.7	62%	0.623	74%	0.74	S	S	*	*			trans	-63.1	99.7	175.4	25	-31	0	0	0	108.9	C333	P331-C333 PolarHBondContact O-N 2.85Å
332	V	26.3	Very low	27.1	Very low	123 Å²	123	139.5 Å²	139.5	75%	0.745	74%	0.737	S	S	*	*			trans	-76	109.2	171.7	179.2	0	0	0	0	106.6	Q330 P334	Q330-V332 PolarHBondContact O-N 3.4Å; V332-P334 WeakPolarHBondContact O-CD 3.46Å
333	C	24.5	Very low	26.9	Very low	98 Å²	98	139.2 Å²	139.2	66%	0.662	74%	0.74	S	S	*	*			trans	-59.9	122.5	161.9	-62.2	0	0	0	0	107.4	P331 S335	P331-C333 PolarHBondContact O-N 2.85Å; C333-S335 PolarHBondContact O-N 3.37Å
334	P	25.1	Very low	26.8	Very low	124 Å²	124	137.1 Å²	137.1	81%	0.805	74%	0.736	S	S	*	*			trans	-64.8	110.8	178.9	-15.2	28.2	0	0	0	108.9	V332	V332-P334 WeakPolarHBondContact O-CD 3.46Å
335	S	24.3	Very low	26.6	Very low	87 Å²	87	137 Å²	137	61%	0.608	74%	0.743	S	S	*	*			trans	-68.9	136.9	168.6	51	0	0	0	0	109.5	C333 S337	C333-S335 PolarHBondContact O-N 3.37Å; S335-S337 PolarHBondContact O-N 3.34Å
336	E	27.8	Very low	26.5	Very low	203 Å²	203	138.9 Å²	138.9	95%	0.949	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	21	-171.7	-66.9	-178.3	141.3	0	0	117.1
337	S	26.6	Very low	26.2	Very low	100 Å²	100	143.2 Å²	143.2	70%	0.699	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.6	3.9	-173.9	57	0	0	0	0	116.5	S335	S335-S337 PolarHBondContact O-N 3.34Å
338	E	27.2	Very low	26	Very low	190 Å²	190	141.5 Å²	141.5	89%	0.888	75%	0.745	S	S	*	*			trans	-100.5	18.5	175.2	-70.7	-168.4	164.7	0	0	114.5	E340	E338-E340 PolarHBondContact O-N 3.29Å
339	M	23.6	Very low	25.6	Very low	167 Å²	167	147.5 Å²	147.5	82%	0.823	76%	0.756	S	S	*	*			trans	-98.2	65.9	174.7	-155.3	179.2	-73.9	0	0	111.1	Y341	M339-Y341 HydrophobicContact CG-CD2 4.41Å
340	E	24.4	Very low	25.4	Very low	162 Å²	162	150.1 Å²	150.1	76%	0.757	76%	0.764	S	S	*	*			trans	-110.2	92.4	162.5	-156.5	179.7	176.2	0	0	109.8	E338 K342	E338-E340 PolarHBondContact O-N 3.29Å; E340-K342 PolarHBondContact O-N 3.04Å
341	Y	24	Very low	25.2	Very low	208 Å²	208	150.9 Å²	150.9	82%	0.816	77%	0.772	S	S	*	*			trans	-57.2	102.5	170	-101.7	-97.2	0	0	0	110.3	M339	M339-Y341 HydrophobicContact CG-CD2 4.41Å
342	K	25.2	Very low	25	Very low	186 Å²	186	154.7 Å²	154.7	81%	0.809	79%	0.786	S	S	*	*			trans	-96.1	93.4	155.2	-74.5	-164.4	176.7	177.1	0	109.9	E340	E340-K342 PolarHBondContact O-N 3.04Å
343	S	25	Very low	24.9	Very low	100 Å²	100	153.8 Å²	153.8	70%	0.699	79%	0.785	S	S	*	*			trans	-50	141	160.6	177.3	0	0	0	0	111
344	S	24.9	Very low	24.8	Very low	99 Å²	99	160.4 Å²	160.4	69%	0.692	80%	0.796	S	S	*	*			trans	81.2	88.4	167.1	-51.5	0	0	0	0	116.5
345	D	28.2	Very low	24.7	Very low	161 Å²	161	162.1 Å²	162.1	86%	0.861	80%	0.797	S	S	*	*			trans	-143	115	133.1	-92.8	-33.5	0	0	0	112.2	W347	D345-W347 PolarHBondContact O-N 3.15Å
346	K	24.2	Very low	24.6	Very low	200 Å²	200	165.1 Å²	165.1	87%	0.87	81%	0.806	S	S	*	*			trans	-87.8	79.5	-172.4	-163.6	-179.7	-169.1	178.4	0	107.7	M348	K346-M348 PolarHBondContact O-N 2.79Å
347	W	26.8	Very low	24.4	Very low	201 Å²	201	164.6 Å²	164.6	76%	0.761	80%	0.8	S	S	*	*			trans	-80.3	90.2	174.9	58.8	-83.2	0	0	0	109.9	D345 W349	D345-W347 PolarHBondContact O-N 3.15Å; W347-W349 HydrophobicContact CZ3-CZ2 4.41Å; W347-W349 PolarHBondContact O-N 3.07Å
348	M	24	Very low	24.2	Very low	164 Å²	164	167 Å²	167	81%	0.808	81%	0.811	S	S	*	*			trans	-61.5	131.3	161.3	-71.7	-171.4	-44.2	0	0	109.6	K346 N350	K346-M348 PolarHBondContact O-N 2.79Å; M348-N350 PolarHBondContact O-N 2.84Å
349	W	20.4	Very low	24	Very low	210 Å²	210	163.6 Å²	163.6	80%	0.795	80%	0.803	S	S	*	*			trans	-45.1	116	159.9	-62.1	79.5	0	0	0	111.4	W347	W347-W349 HydrophobicContact CZ3-CZ2 4.41Å; W347-W349 PolarHBondContact O-N 3.07Å
350	N	24.4	Very low	23.8	Very low	145 Å²	145	166.7 Å²	166.7	78%	0.775	81%	0.806	S	S	*	*			trans	168.7	100.9	141.6	-84.5	-25.3	0	0	0	109.8	M348	M348-N350 PolarHBondContact O-N 2.84Å
351	N	24.8	Very low	23.6	Very low	144 Å²	144	164.6 Å²	164.6	77%	0.77	81%	0.809	S	S	*	*				172.9	97.2	121.1	-86	-32.4	0	0	0	111.5	S353	N351-S353 PolarHBondContact O-N 2.48Å
352	I	22.8	Very low	23.6	Very low	177 Å²	177	163.1 Å²	163.1	91%	0.908	81%	0.809	S	S	*	*			trans	-63.5	106.5	154.2	-64.1	160.9	0	0	0	107
353	S	24.2	Very low	23.5	Very low	103 Å²	103	160.5 Å²	160.5	72%	0.72	81%	0.808	S	S	*	*			trans	179.3	75.6	162.9	167.3	0	0	0	0	111.2	N351	N351-S353 PolarHBondContact O-N 2.48Å
354	W	22.9	Very low	23.6	Very low	237 Å²	237	163.1 Å²	163.1	90%	0.898	81%	0.813	S	S	*	*			trans	-148	30.6	163.2	35	-63.4	0	0	0	112.7
355	I	22.5	Very low	23.5	Very low	161 Å²	161	163.9 Å²	163.9	83%	0.826	81%	0.813	S	S	*	*	S	Bend	trans	-83.5	-12.2	169.9	-72.1	177.5	0	0	0	113.2
356	N	23	Very low	23.3	Very low	150 Å²	150	165.1 Å²	165.1	80%	0.802	81%	0.814	S	S	*	*			trans	-134.7	88	-179.2	-74.2	-30.9	0	0	0	112.8
357	K	24.3	Very low	23.2	Very low	191 Å²	191	164.5 Å²	164.5	83%	0.83	81%	0.814	S	S	*	*			trans	-155.2	92.2	148.1	-112	174.8	-174	-178	0	110.5	V359	K357-V359 HydrophobicContact CB-CG2 4.34Å; K357-V359 HydrophobicContact CG-CG2 4.27Å; K357-V359 PolarHBondContact O-N 3.18Å; K357-V359 VanDerWaalsContact O-N 3.09Å
358	T	21.7	Very low	23.1	Very low	150 Å²	150	160.9 Å²	160.9	92%	0.92	82%	0.817	S	S	*	*			trans	-55.7	102	153.2	-46.7	0	0	0	0	108
359	V	22.6	Very low	23.2	Very low	119 Å²	119	160.8 Å²	160.8	72%	0.721	82%	0.818	S	S	*	*			trans	-135	128.9	166.8	-178.8	0	0	0	0	107.9	K357	K357-V359 HydrophobicContact CB-CG2 4.34Å; K357-V359 HydrophobicContact CG-CG2 4.27Å; K357-V359 PolarHBondContact O-N 3.18Å; K357-V359 VanDerWaalsContact O-N 3.09Å
360	R	20.2	Very low	23.2	Very low	233 Å²	233	158.2 Å²	158.2	88%	0.879	82%	0.818	S	S	*	*			trans	-44.9	149.2	-173.7	-89.9	172.6	164.8	166.3	-5.9	115.3	E362	R360-E362 PolarHBondContact O-N 3.02Å
361	S	20.2	Very low	23.2	Very low	117 Å²	117	160.3 Å²	160.3	82%	0.818	82%	0.823	S	S	*	*			trans	-37.7	120.7	154	-40.1	0	0	0	0	112.5
362	E	24.3	Very low	23.1	Very low	178 Å²	178	157.9 Å²	157.9	83%	0.832	82%	0.823	S	S	*	*			trans	-133.5	122.6	153.1	-99.6	168.1	-165.4	0	0	108.2	R360	R360-E362 PolarHBondContact O-N 3.02Å
363	V	21.5	Very low	23.2	Very low	130 Å²	130	155.8 Å²	155.8	79%	0.788	82%	0.823	S	S	*	*			trans	-70.9	118.3	178.1	172.6	0	0	0	0	107.7	T365	V363-T365 HydrophobicContact CG1-CG2 4.43Å
364	I	27.5	Very low	23.2	Very low	156 Å²	156	160.1 Å²	160.1	80%	0.8	83%	0.828	S	S	*	*			trans	-120.8	98	165	-57.6	178.5	0	0	0	107.2
365	T	22.3	Very low	23.3	Very low	114 Å²	114	155 Å²	155	70%	0.699	83%	0.826	S	S	*	*			trans	-63	121	159.5	39.2	0	0	0	0	109.3	V363	V363-T365 HydrophobicContact CG1-CG2 4.43Å
366	E	25.2	Very low	23.5	Very low	187 Å²	187	154.1 Å²	154.1	87%	0.874	83%	0.828	S	S	*	*			trans	-172.9	113.3	142.2	-102.7	167.1	-146.5	0	0	109.4
367	Q	21.4	Very low	23.5	Very low	188 Å²	188	153.4 Å²	153.4	88%	0.879	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-79	132.8	173.6	-76	176	-30.2	0	0	109.7
368	P	25.4	Very low	23.7	Very low	125 Å²	125	152.6 Å²	152.6	81%	0.812	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-74.4	137.5	169.1	28.3	-29.5	0	0	0	111
369	I	24.4	Very low	23.8	Very low	162 Å²	162	151.9 Å²	151.9	83%	0.831	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-69.5	139.4	-174.1	-68.1	162.2	0	0	0	111.3
370	I	22.3	Very low	23.9	Very low	155 Å²	155	155.2 Å²	155.2	80%	0.795	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-68.6	125.6	171.9	-62.7	162.3	0	0	0	109.6
371	E	24.2	Very low	24.2	Very low	190 Å²	190	154.3 Å²	154.3	89%	0.888	82%	0.818	S	S	*	*			trans	-105.7	123.3	154.6	-87.8	-171.6	164.8	0	0	110.1
372	A	23	Very low	24.3	Very low	92 Å²	92	155.2 Å²	155.2	76%	0.76	81%	0.813	S	S	*	*			trans	-86.6	109.1	-174.9	0	0	0	0	0	111.1
373	C	23.7	Very low	24.6	Very low	134 Å²	134	155.5 Å²	155.5	91%	0.905	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-85.1	123.3	163.7	-86	0	0	0	0	110.1
374	K	24.8	Very low	24.8	Very low	193 Å²	193	156.6 Å²	156.6	84%	0.839	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-67.7	141.9	-174.8	-64.1	177.2	178.2	177.2	0	111.8
375	P	24.4	Very low	24.5	Very low	130 Å²	130	154.9 Å²	154.9	84%	0.844	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-80.8	122.2	179.8	31	-30.7	0	0	0	110.9
376	T	27.4	Very low	24.5	Very low	143 Å²	143	159.4 Å²	159.4	88%	0.877	81%	0.814	S	S	*	*			trans	-82.2	114.8	166.5	6.8	0	0	0	0	109.3	L378	T376-L378 PolarHBondContact O-N 2.96Å
377	N	23.4	Very low	24.6	Very low	135 Å²	135	157.1 Å²	157.1	72%	0.722	81%	0.813	S	S	*	*			trans	-46.3	123.1	166.4	-93	-34	0	0	0	111.8
378	L	28	Very low	24.6	Very low	174 Å²	174	154.4 Å²	154.4	91%	0.911	80%	0.8	S	S	*	*			trans	-141.3	78.1	148.8	-154.6	72.3	0	0	0	109	T376 Y380	T376-L378 PolarHBondContact O-N 2.96Å; L378-Y380 PolarHBondContact O-N 2.86Å
379	D	22.7	Very low	24.6	Very low	134 Å²	134	156.4 Å²	156.4	72%	0.717	80%	0.803	S	S	*	*			trans	-65.6	113.4	161.1	-68.5	-46	0	0	0	109.4
380	Y	24.9	Very low	24.5	Very low	189 Å²	189	155.6 Å²	155.6	74%	0.741	80%	0.8	S	S	*	*			trans	-179.5	102.7	135.9	-130.7	-108.6	0	0	0	110.5	L378	L378-Y380 PolarHBondContact O-N 2.86Å
381	Y	27.3	Very low	24.5	Very low	214 Å²	214	157.9 Å²	157.9	84%	0.839	80%	0.799	S	S	*	*			trans	-166.3	98.3	130.2	-100.4	-70.5	0	0	0	107.9	F383	Y381-F383 PolarHBondContact O-N 3.41Å
382	N	22	Very low	24.4	Very low	136 Å²	136	155.6 Å²	155.6	73%	0.727	80%	0.798	S	S	*	*			trans	-67.4	114.5	170.8	-77.3	-49.5	0	0	0	110
383	F	30.1	Very low	24.7	Very low	184 Å²	184	156.4 Å²	156.4	81%	0.807	79%	0.789	S	S	*	*			trans	-108.8	104.2	150.8	-93.5	-83.9	0	0	0	109.3	Y381	Y381-F383 PolarHBondContact O-N 3.41Å
384	L	26.1	Very low	24.8	Very low	153 Å²	153	155.1 Å²	155.1	80%	0.801	78%	0.779	S	S	*	*			trans	53	109	147.5	-63	167.9	0	0	0	120.1
385	T	22.2	Very low	24.9	Very low	120 Å²	120	153.1 Å²	153.1	74%	0.736	78%	0.777	S	S	*	*			trans	-46.8	137.4	157.2	40.5	0	0	0	0	116.5
386	W	22.3	Very low	25.3	Very low	210 Å²	210	154.6 Å²	154.6	80%	0.795	78%	0.778	S	S	*	*			trans	73.6	97.7	141.6	-74.8	48.5	0	0	0	118.9
387	T	26	Very low	25.3	Very low	138 Å²	138	153.7 Å²	153.7	85%	0.847	76%	0.764	S	S	*	*				-138.6	123.2	116.1	44.3	0	0	0	0	110.3	L389	T387-L389 PolarHBondContact O-N 3.42Å; T387-L389 VanDerWaalsContact O-N 3.14Å
388	H	23	Very low	25.7	Very low	132 Å²	132	156.6 Å²	156.6	61%	0.611	77%	0.773	S	S	*	*			trans	-55.4	109.3	169	-93.2	-96.5	0	0	0	110.8
389	L	24.1	Very low	26	Very low	166 Å²	166	153.2 Å²	153.2	87%	0.869	76%	0.764	S	S	*	*			trans	-123.3	86.1	146.7	-77.2	174.9	0	0	0	107.6	T387 R391	T387-L389 PolarHBondContact O-N 3.42Å; T387-L389 VanDerWaalsContact O-N 3.14Å; L389-R391 PolarHBondContact O-N 3.13Å
390	N	21.9	Very low	26.5	Very low	145 Å²	145	153.5 Å²	153.5	78%	0.775	76%	0.761	S	S	*	*			trans	-58.5	88	156.5	-82	-18	0	0	0	107.9
391	R	23.1	Very low	27	Very low	204 Å²	204	151.2 Å²	151.2	77%	0.77	76%	0.761	S	S	*	*			trans	-116.4	94.2	148.9	-161.6	-176.5	-63	-126.9	3.3	105.5	L389 I393	L389-R391 PolarHBondContact O-N 3.13Å; R391-I393 HydrophobicContact CB-CG1 4.36Å; R391-I393 HydrophobicContact CG-CD1 4.46Å; R391-I393 HydrophobicContact CG-CG1 3.88Å; R391-I393 PolarHBondContact O-N 2.79Å
392	T	21.9	Very low	27.9	Very low	141 Å²	141	144.3 Å²	144.3	87%	0.865	74%	0.738	S	S	*	*			trans	-55.6	93.6	161.5	-1.1	0	0	0	0	106.7
393	I	28.8	Very low	29.8	Very low	109 Å²	109	142.1 Å²	142.1	56%	0.559	72%	0.723	S	S	*	*			trans	-91.4	117	167.8	-60.2	-178.9	0	0	0	105.4	R391	R391-I393 HydrophobicContact CB-CG1 4.36Å; R391-I393 HydrophobicContact CG-CD1 4.46Å; R391-I393 HydrophobicContact CG-CG1 3.88Å; R391-I393 PolarHBondContact O-N 2.79Å
394	P	26.3	Very low	31.2	Very low	108 Å²	108	137.7 Å²	137.7	70%	0.701	71%	0.708	S	S	*	*			trans	-63.6	138.3	-179.8	-13.5	26.9	0	0	0	110.1	N396	P394-N396 PolarHBondContact O-N 2.68Å
395	N	27.9	Very low	33.2	Very low	150 Å²	150	131 Å²	131	80%	0.802	67%	0.673	S	S	*	*	S	Bend	trans	-42.3	124.1	169.4	-64.9	-20.6	0	0	0	110.5
396	N	32.4	Very low	35.3	Very low	161 Å²	161	129.6 Å²	129.6	86%	0.861	66%	0.658	S	S	*	*			trans	121.2	28.1	170.9	-59.8	-18.1	0	0	0	117.9	P394	P394-N396 PolarHBondContact O-N 2.68Å
397	Q	27.8	Very low	37.1	Very low	125 Å²	125	120.8 Å²	120.8	58%	0.584	63%	0.626	S	S	*	*			trans	-128.5	62.6	165.7	-72.3	-168.1	-29.5	0	0	112.6	E400	Q397-E400 PolarHBondContact NE2-OE2 2.76Å; Q397-E400 VanDerWaalsContact NE2-OE2 3.12Å
398	E	31.9	Very low	38.7	Very low	196 Å²	196	119.6 Å²	119.6	92%	0.916	62%	0.615	S	S	*	*	S	Bend	trans	-93.6	-1.9	165.5	-88.5	-170.7	156.3	0	0	113.7
399	S	33.3	Very low	40.9	Very low	102 Å²	102	116 Å²	116	71%	0.713	61%	0.607	S	S	*	*	S	Bend	trans	-97.9	1.6	175.8	-70.6	0	0	0	0	115.8
400	E	32.7	Very low	43.4	Very low	140 Å²	140	108.5 Å²	108.5	65%	0.654	57%	0.568	S	S	*	*	S	Bend	trans	-112.3	-1.1	-174	-82.3	-172.2	159	0	0	116.5	Q397 L402	Q397-E400 PolarHBondContact NE2-OE2 2.76Å; Q397-E400 VanDerWaalsContact NE2-OE2 3.12Å; E400-L402 PolarHBondContact O-N 3.18Å
401	L	36.3	Very low	46.3	Very low	142 Å²	142	103.9 Å²	103.9	74%	0.743	55%	0.546	S	S	*	.			trans	-98	46.1	-179.6	-129.5	130.1	0	0	0	113.2	Q403	L401-Q403 HydrophobicContact CD2-CG 4.08Å; L401-Q403 PolarHBondContact O-N 3.36Å
402	L	46.8	Very low	49.2	Very low	68 Å²	68	98 Å²	98	36%	0.356	53%	0.533	S	S	.	.			trans	-76.3	103.4	160.2	-68	171.7	0	0	0	107.7	I155 L156 E400	I155-L402 HydrophobicContact CB-CB 4.26Å; I155-L402 HydrophobicContact CB-CD2 4.22Å; I155-L402 HydrophobicContact CG2-CD2 4.05Å; I155-L402 WeakPolarHBondContact O-CB 3.19Å; I155-L402 WeakPolarHBondContact O-CD1 3.35Å; I155-L402 WeakPolarHBondContact O-CG 3.24Å; L156-L402 WeakPolarHBondContact O-CD1 3.44Å; E400-L402 PolarHBondContact O-N 3.18Å
403	Q	60.8	Low	52.2	Low	90 Å²	90	91.4 Å²	91.4	42%	0.421	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-62.2	153	-172.7	-67	176.3	-2.3	0	0	112.8	L401	L401-Q403 HydrophobicContact CD2-CG 4.08Å; L401-Q403 PolarHBondContact O-N 3.36Å
404	N	60.7	Low	54.7	Low	92 Å²	92	92.1 Å²	92.1	49%	0.492	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	122.2	168.1	-74.7	-23.5	0	0	0	109.5	W153	W153-N404 CarbonylContact O-C 3.51Å; W153-N404 VanDerWaalsContact O-CA 3.28Å; W153-N404 WeakPolarHBondContact O-CA 3.14Å
405	I	66.9	Low	57.2	Low	13 Å²	13	89.4 Å²	89.4	7%	0.067	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	140.1	170	-54	165.5	0	0	0	108.9	W153 I155 I410 I615 L616	W153-I405 PolarHBondContact N-O 2.78Å; W153-I405 PolarHBondContact O-N 3.47Å; I155-I405 HydrophobicContact CD1-CD1 3.63Å; I155-I405 HydrophobicContact CD1-CG1 4.16Å; I155-I405 HydrophobicContact CG1-CD1 3.49Å; I155-I405 VanDerWaalsContact CG1-CD1 3.49Å; I155-I405 HydrophobicContact CG1-CG1 4.1Å; I405-I410 HydrophobicContact CG2-CD1 4.11Å; I405-I615 HydrophobicContact CG2-CG2 3.86Å; I405-L616 HydrophobicContact CD1-CD2 3.61Å
406	H	67.1	Low	59.5	Low	90 Å²	90	82.9 Å²	82.9	42%	0.417	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	112.9	169.7	-167.6	-93.1	0	0	0	110.2	Q151 D408 A409	Q151-H406 PolarHBondContact OE1-NE2 3.28Å; H406-D408 VanDerWaalsContact C-N 3.3Å; H406-D408 IonicContact CE1-OD2 2.75Å; H406-D408 PolarHBondContact CE1-OD2 3.15Å; H406-D408 IonicContact NE2-OD2 3.97Å; H406-D408 PolarHBondContact O-N 2.68Å; H406-A409 PolarHBondContact O-N 2.93Å
407	M	60.3	Low	60.8	Low	24 Å²	24	80.6 Å²	80.6	12%	0.118	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-72.9	-13.3	-170.1	-92.9	-68.1	-146.7	0	0	115.4	Q151 W153 C207 N209 T229 A409 I410	Q151-M407 PolarHBondContact O-N 3.26Å; W153-M407 HydrophobicContact CB-CG 4.15Å; W153-M407 HydrophobicContact CD2-CE 3.93Å; W153-M407 HydrophobicContact CD2-CG 3.82Å; W153-M407 HydrophobicContact CE3-CE 4.15Å; W153-M407 HydrophobicContact CG-CB 4.38Å; W153-M407 HydrophobicContact CG-CE 4.22Å; W153-M407 HydrophobicContact CG-CG 3.4Å; W153-M407 VanDerWaalsContact CG-CG 3.4Å; C207-M407 WeakPolarHBondContact SG-CE 3.42Å; N209-M407 WeakPolarHBondContact OD1-CE 3.19Å; T229-M407 HydrophobicContact CG2-CE 4.24Å; T229-M407 HydrophobicContact CG2-SD 4.46Å; T229-M407 WeakPolarHBondContact OG1-CE 3.17Å; M407-A409 PolarHBondContact O-N 3.47Å; M407-I410 PolarHBondContact O-N 2.68Å; M407-I410 HydrophobicContact SD-CB 3.74Å; M407-I410 HydrophobicContact SD-CD1 3.92Å; M407-I410 HydrophobicContact SD-CG1 4.11Å; M407-I410 HydrophobicContact SD-CG2 4.4Å
408	D	59.6	Low	62	Low	114 Å²	114	84.4 Å²	84.4	61%	0.61	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-61.7	-16.7	175.9	-64	-10.9	0	0	0	111	Q151 H406	Q151-D408 PolarHBondContact NE2-OD1 2.9Å; Q151-D408 PolarHBondContact NE2-OD2 3.39Å; H406-D408 VanDerWaalsContact C-N 3.3Å; H406-D408 IonicContact CE1-OD2 2.75Å; H406-D408 PolarHBondContact CE1-OD2 3.15Å; H406-D408 IonicContact NE2-OD2 3.97Å; H406-D408 PolarHBondContact O-N 2.68Å
409	A	67.5	Low	62.9	Low	56 Å²	56	75.7 Å²	75.7	46%	0.463	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-81.8	-19.5	173.7	0	0	0	0	0	114.9	H406 M407 I615	H406-A409 PolarHBondContact O-N 2.93Å; M407-A409 PolarHBondContact O-N 3.47Å; A409-I615 HydrophobicContact CB-CD1 4.04Å
410	I	78.1	Confident	63.4	Low	8 Å²	8	74.6 Å²	74.6	4%	0.041	39%	0.394	C	S	.	.	S	Bend	trans	-107.3	111.1	-175.2	-52.4	-174.8	0	0	0	110.9	L227 T229 I405 M407	L227-I410 HydrophobicContact CD1-CG1 4.44Å; L227-I410 HydrophobicContact CD1-CG2 4.15Å; L227-I410 HydrophobicContact CD2-CG1 4.27Å; L227-I410 HydrophobicContact CG-CG2 4.08Å; T229-I410 HydrophobicContact CG2-CG2 4.17Å; I405-I410 HydrophobicContact CG2-CD1 4.11Å; M407-I410 PolarHBondContact O-N 2.68Å; M407-I410 HydrophobicContact SD-CB 3.74Å; M407-I410 HydrophobicContact SD-CD1 3.92Å; M407-I410 HydrophobicContact SD-CG1 4.11Å; M407-I410 HydrophobicContact SD-CG2 4.4Å
411	P	82.3	Confident	63.7	Low	48 Å²	48	75 Å²	75	31%	0.312	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-66.5	139.9	178.9	26.8	-35.8	0	0	0	112.6	L227 G228 T229 P289	L227-P411 VanDerWaalsContact O-CG 3.3Å; L227-P411 WeakPolarHBondContact O-CG 3.49Å; G228-P411 CarbonylContact C-O 3.56Å; G228-P411 WeakPolarHBondContact CA-O 3.45Å; T229-P411 PolarHBondContact N-O 3.4Å; P289-P411 HydrophobicContact CB-CB 3.72Å; P289-P411 HydrophobicContact CB-CG 3.5Å; P289-P411 VanDerWaalsContact CB-CG 3.5Å; P289-P411 HydrophobicContact CG-CB 3.86Å; P289-P411 HydrophobicContact CG-CG 3.2Å
412	T	84.8	Confident	63.7	Low	82 Å²	82	70.9 Å²	70.9	50%	0.503	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-74.4	129.5	174.1	-57.2	0	0	0	0	110.9
413	L	83.7	Confident	63.2	Low	1 Å²	1	69.1 Å²	69.1	1%	0.005	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-88.5	136.1	175.7	-55.1	173.8	0	0	0	109.9	F226 T229 V230 V286 I287 P289	F226-L413 HydrophobicContact CE1-CD1 3.96Å; F226-L413 HydrophobicContact CE1-CD2 4.27Å; F226-L413 HydrophobicContact CZ-CD1 4.02Å; F226-L413 HydrophobicContact CZ-CD2 3.8Å; T229-L413 PolarHBondContact O-N 2.95Å; V230-L413 HydrophobicContact CG2-CB 3.83Å; V230-L413 HydrophobicContact CG2-CD1 4.11Å; V230-L413 HydrophobicContact CG2-CG 4.43Å; V286-L413 HydrophobicContact CB-CB 3.97Å; V286-L413 HydrophobicContact CG2-CB 4.03Å; V286-L413 HydrophobicContact CG2-CD1 3.84Å; I287-L413 VanDerWaalsContact O-CD2 3.24Å; I287-L413 WeakPolarHBondContact O-CD2 3.16Å; P289-L413 HydrophobicContact CG-CD2 4.36Å
414	H	81.6	Confident	61.8	Low	125 Å²	125	68.7 Å²	68.7	58%	0.579	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	137.6	-178.1	-66.2	-66.5	0	0	0	111.5	V286 I287 S416	V286-H414 CarbonylContact C-O 3.53Å; V286-H414 VanDerWaalsContact CA-O 3.3Å; V286-H414 WeakPolarHBondContact CA-O 3.44Å; I287-H414 PolarHBondContact N-O 2.75Å; H414-S416 PolarHBondContact O-N 2.96Å
415	P	78.7	Confident	60.3	Low	51 Å²	51	67.5 Å²	67.5	33%	0.331	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	132.3	173	-24.6	34.1	0	0	0	111.5	T234 M284	T234-P415 HydrophobicContact CG2-CG 3.4Å; T234-P415 VanDerWaalsContact CG2-CG 3.4Å; M284-P415 HydrophobicContact SD-CG 4.3Å
416	S	75.1	Confident	58.4	Low	13 Å²	13	70.6 Å²	70.6	9%	0.091	42%	0.418	C	S	.	.			trans	-71.3	141.4	174.5	67.2	0	0	0	0	110.4	R285 H414 W418 S419	R285-S416 WeakPolarHBondContact CB-OG 3.38Å; R285-S416 WeakPolarHBondContact O-CB 3.44Å; R285-S416 PolarHBondContact O-N 3.28Å; R285-S416 PolarHBondContact O-OG 3.49Å; H414-S416 PolarHBondContact O-N 2.96Å; S416-W418 PolarHBondContact O-N 3.43Å; S416-W418 VanDerWaalsContact O-N 3.07Å; S416-S419 WeakPolarHBondContact O-CB 3.24Å; S416-S419 PolarHBondContact O-N 3.05Å; S416-S419 PolarHBondContact O-OG 3.2Å; S416-S419 PolarHBondContact OG-N 3.2Å
417	P	61.2	Low	57	Low	112 Å²	112	73.5 Å²	73.5	73%	0.727	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.4	176.6	-23.8	32.6	0	0	0	114
418	W	52.2	Low	55.6	Low	205 Å²	205	80.9 Å²	80.9	78%	0.777	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-3.8	-174.5	-61.9	68.2	0	0	0	113.4	S416 V420	S416-W418 PolarHBondContact O-N 3.43Å; S416-W418 VanDerWaalsContact O-N 3.07Å; W418-V420 PolarHBondContact O-N 2.91Å
419	S	51.1	Low	54.2	Low	13 Å²	13	81.2 Å²	81.2	9%	0.091	48%	0.475	C	S	.	.			trans	-68.6	-13.5	-175.8	57	0	0	0	0	114.8	F238 S416 K421	F238-S419 WeakPolarHBondContact CE2-OG 3.3Å; S416-S419 WeakPolarHBondContact O-CB 3.24Å; S416-S419 PolarHBondContact O-N 3.05Å; S416-S419 PolarHBondContact O-OG 3.2Å; S416-S419 PolarHBondContact OG-N 3.2Å; S419-K421 PolarHBondContact O-N 3.21Å
420	V	43.6	Very low	52.3	Low	79 Å²	79	82.3 Å²	82.3	48%	0.479	48%	0.48	S	S	.	.			trans	-81.1	64.3	177.5	-165.9	0	0	0	0	110.1	W418	W418-V420 PolarHBondContact O-N 2.91Å
421	K	39.8	Very low	49.8	Very low	149 Å²	149	87.9 Å²	87.9	65%	0.648	52%	0.516	S	S	*	.			trans	-114.2	99.2	165.3	-70.8	-177	-178.4	177.9	0	107.6	S419 A423	S419-K421 PolarHBondContact O-N 3.21Å; K421-A423 PolarHBondContact O-N 3.41Å
422	S	36.6	Very low	47.2	Very low	55 Å²	55	91.5 Å²	91.5	39%	0.385	54%	0.538	S	S	.	.			trans	-58.8	124.9	173.1	34.4	0	0	0	0	110	G424 A425	S422-G424 PolarHBondContact O-N 3.07Å; S422-A425 PolarHBondContact O-N 3.49Å
423	A	36.2	Very low	44.4	Very low	32 Å²	32	98.5 Å²	98.5	26%	0.264	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-51.8	112.5	167.9	0	0	0	0	0	108.3	N173 K421	N173-A423 HydrophobicContact CB-CB 4.46Å; K421-A423 PolarHBondContact O-N 3.41Å
424	G	31	Very low	41.6	Very low	81 Å²	81	109.2 Å²	109.2	84%	0.835	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	126.7	-10.7	-177.6	0	0	0	0	0	116.2	S422 S426	S422-G424 PolarHBondContact O-N 3.07Å; G424-S426 PolarHBondContact O-N 3.38Å
425	A	29	Very low	38.9	Very low	67 Å²	67	112.7 Å²	112.7	55%	0.554	61%	0.609	S	S	*	*			trans	-84.9	94.8	171.6	0	0	0	0	0	110.7	S422 L427	S422-A425 PolarHBondContact O-N 3.49Å; A425-L427 PolarHBondContact O-N 2.94Å
426	S	26.3	Very low	36.4	Very low	78 Å²	78	119.8 Å²	119.8	55%	0.545	64%	0.635	S	S	.	*			trans	-59.1	128.3	170.8	178.1	0	0	0	0	110.9	G424 H428	G424-S426 PolarHBondContact O-N 3.38Å; S426-H428 PolarHBondContact O-N 2.84Å
427	L	37.3	Very low	34.1	Very low	151 Å²	151	126 Å²	126	79%	0.791	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-63.2	-16.5	178	-91.7	154.5	0	0	0	113.5	A425	A425-L427 PolarHBondContact O-N 2.94Å
428	H	30.9	Very low	32.6	Very low	179 Å²	179	126.2 Å²	126.2	83%	0.829	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-84.9	-4.8	-175.5	-90.8	-72.8	0	0	0	115.7	S426	S426-H428 PolarHBondContact O-N 2.84Å
429	T	31.8	Very low	31.4	Very low	120 Å²	120	123.2 Å²	123.2	74%	0.736	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-144.6	64.7	174	62.7	0	0	0	0	111.7
430	S	27.1	Very low	30.3	Very low	79 Å²	79	125.9 Å²	125.9	55%	0.552	71%	0.705	S	S	*	*			trans	-123.1	116.6	165.7	-70.2	0	0	0	0	109.3	V432	S430-V432 PolarHBondContact O-N 3.06Å; S430-V432 VanDerWaalsContact O-N 3.1Å
431	P	26.5	Very low	29.4	Very low	125 Å²	125	127 Å²	127	81%	0.812	72%	0.716	S	S	*	*			trans	-67.3	112.7	178.3	-13.8	27.1	0	0	0	109.8	R433	P431-R433 PolarHBondContact O-N 3.13Å
432	V	27.3	Very low	28.6	Very low	125 Å²	125	127.6 Å²	127.6	76%	0.758	72%	0.718	S	S	*	*			trans	-60.7	99.8	168.2	178.1	0	0	0	0	108.1	S430 R434	S430-V432 PolarHBondContact O-N 3.06Å; S430-V432 VanDerWaalsContact O-N 3.1Å; V432-R434 VanDerWaalsContact C-N 3.29Å; V432-R434 HydrophobicContact CG1-CG 4.05Å; V432-R434 PolarHBondContact O-N 2.89Å
433	R	25.3	Very low	28.1	Very low	228 Å²	228	134.7 Å²	134.7	86%	0.86	74%	0.738	S	S	*	*			trans	-71.6	91.3	163.6	-71.8	-170.8	-156.1	-168.8	6	107.6	P431 F435	P431-R433 PolarHBondContact O-N 3.13Å; R433-F435 PolarHBondContact O-N 3.31Å; R433-F435 VanDerWaalsContact O-N 3.1Å
434	R	24.7	Very low	27.5	Very low	226 Å²	226	137.2 Å²	137.2	85%	0.853	76%	0.759	S	S	*	*			trans	-60.7	109.9	160.9	-72.3	-172	177.8	177.5	-0.4	107	V432 K436	V432-R434 VanDerWaalsContact C-N 3.29Å; V432-R434 HydrophobicContact CG1-CG 4.05Å; V432-R434 PolarHBondContact O-N 2.89Å; R434-K436 VanDerWaalsContact C-N 3.34Å; R434-K436 PolarHBondContact O-N 2.86Å
435	F	25.8	Very low	27	Very low	198 Å²	198	140 Å²	140	87%	0.868	76%	0.76	S	S	*	*			trans	-60	103.5	161.1	-86.1	-91.4	0	0	0	106.4	R433	R433-F435 PolarHBondContact O-N 3.31Å; R433-F435 VanDerWaalsContact O-N 3.1Å
436	K	25.5	Very low	26.8	Very low	201 Å²	201	142.9 Å²	142.9	87%	0.874	77%	0.773	S	S	*	*			trans	-85.7	109	170.6	-164.9	174.5	-176.7	179.4	0	105.4	R434 S438	R434-K436 VanDerWaalsContact C-N 3.34Å; R434-K436 PolarHBondContact O-N 2.86Å; K436-S438 PolarHBondContact O-N 3.4Å
437	D	26	Very low	26.6	Very low	143 Å²	143	147.9 Å²	147.9	77%	0.765	79%	0.788	S	S	*	*			trans	-48.7	112.6	175.2	-65.6	-48.1	0	0	0	109.8	V439	D437-V439 VanDerWaalsContact C-N 3.33Å; D437-V439 PolarHBondContact O-N 3.32Å
438	S	30.2	Very low	25.7	Very low	117 Å²	117	148 Å²	148	82%	0.818	79%	0.789	S	S	*	*			trans	-72	97.7	166.6	57	0	0	0	0	107	K436 G440	K436-S438 PolarHBondContact O-N 3.4Å; S438-G440 VanDerWaalsContact C-N 3.26Å; S438-G440 PolarHBondContact O-N 2.94Å
439	V	27	Very low	25.4	Very low	141 Å²	141	145.3 Å²	145.3	86%	0.855	79%	0.791	S	S	*	*			trans	-56.1	92.3	165.2	177.4	0	0	0	0	107.9	D437 S441	D437-V439 VanDerWaalsContact C-N 3.33Å; D437-V439 PolarHBondContact O-N 3.32Å; V439-S441 PolarHBondContact O-N 3.49Å
440	G	28	Very low	24.8	Very low	70 Å²	70	148 Å²	148	72%	0.722	80%	0.795	S	S	*	*			trans	-72.5	116.2	168.4	0	0	0	0	0	109.1	S438	S438-G440 VanDerWaalsContact C-N 3.26Å; S438-G440 PolarHBondContact O-N 2.94Å
441	S	25.5	Very low	24.6	Very low	101 Å²	101	152.3 Å²	152.3	71%	0.706	81%	0.806	S	S	*	*			trans	-29	132.5	171.8	-178.1	0	0	0	0	116	V439	V439-S441 PolarHBondContact O-N 3.49Å
442	K	23.1	Very low	24.3	Very low	162 Å²	162	154.1 Å²	154.1	70%	0.704	80%	0.803	S	S	*	*			trans	-8.5	128.1	137.1	-60.6	173.5	177.7	177.7	0	113.5
443	Y	25.6	Very low	24.1	Very low	205 Å²	205	158 Å²	158	80%	0.804	81%	0.811	S	S	*	*				176.6	139.5	92.7	-90.2	-76.4	0	0	0	111
444	A	24.5	Very low	23.8	Very low	85 Å²	85	155 Å²	155	70%	0.702	81%	0.811	S	S	*	*			trans	73.9	97.3	148.7	0	0	0	0	0	119.9
445	T	19.8	Very low	23.8	Very low	140 Å²	140	149.3 Å²	149.3	86%	0.859	80%	0.803	S	S	*	*			trans	-48	141.1	132.9	40.9	0	0	0	0	111.7
446	P	24.6	Very low	23.6	Very low	126 Å²	126	146.4 Å²	146.4	82%	0.818	80%	0.795	S	S	*	*				-137.2	164.5	117.8	32.5	-17.2	0	0	0	114.3
447	Q	22	Very low	23.5	Very low	184 Å²	184	147 Å²	147	86%	0.86	80%	0.798	S	S	*	*			trans	-71.7	157.9	-166.6	-62.3	-175.9	-17.3	0	0	116.1
448	N	19.6	Very low	23.3	Very low	153 Å²	153	144.1 Å²	144.1	82%	0.818	79%	0.789	S	S	*	*			trans	8.8	121.2	141.6	-69	-14.1	0	0	0	118.3
449	S	23.2	Very low	23	Very low	123 Å²	123	150.3 Å²	150.3	86%	0.86	80%	0.795	S	S	*	*				179.4	150.9	113.5	40.4	0	0	0	0	111
450	Q	20	Very low	22.7	Very low	175 Å²	175	152.2 Å²	152.2	82%	0.818	79%	0.791	S	S	*	*			trans	-61.5	136.6	-179.8	-60.4	169.1	-25.1	0	0	111.8
451	H	23.7	Very low	22.4	Very low	170 Å²	170	155.5 Å²	155.5	79%	0.787	80%	0.801	S	S	*	*				179.2	141.4	121.9	-105.7	-79.7	0	0	0	111.6
452	E	18.7	Very low	22.2	Very low	163 Å²	163	159.2 Å²	159.2	76%	0.762	81%	0.805	S	S	*	*			trans	-45.7	141.3	170.3	-61.4	164.2	132.3	0	0	113.2
453	F	22.6	Very low	22.1	Very low	208 Å²	208	161.9 Å²	161.9	91%	0.912	82%	0.817	S	S	*	*			trans	-167.9	118.9	132	-101.8	-71.8	0	0	0	110.4
454	L	20	Very low	21.9	Very low	164 Å²	164	163.2 Å²	163.2	86%	0.859	82%	0.821	S	S	*	*			trans	-77.4	147.1	159.8	-77.1	158.4	0	0	0	109.6
455	P	23.6	Very low	21.9	Very low	106 Å²	106	163.9 Å²	163.9	69%	0.688	82%	0.82	S	S	*	*				-143.6	134.9	123.7	32.6	-15.6	0	0	0	115.4
456	I	22	Very low	22.2	Very low	138 Å²	138	164.2 Å²	164.2	71%	0.708	82%	0.822	S	S	*	*				47.2	107.1	125.5	-49	169	0	0	0	118.3
457	F	24.6	Very low	22.1	Very low	213 Å²	213	165.2 Å²	165.2	93%	0.934	82%	0.82	S	S	*	*			trans	-123.5	110	133.2	-100.7	-80.5	0	0	0	110.3
458	S	20.9	Very low	22.2	Very low	82 Å²	82	162 Å²	162	57%	0.573	81%	0.813	S	S	*	*			trans	-92.9	131.2	170.5	54.6	0	0	0	0	110.5
459	R	24.5	Very low	22.4	Very low	248 Å²	248	162.5 Å²	162.5	94%	0.936	81%	0.814	S	S	*	*			trans	-135.3	116	146.6	-78	-167.1	178.6	179.2	0.6	109.5
460	K	20.9	Very low	22.4	Very low	180 Å²	180	163.2 Å²	163.2	78%	0.783	81%	0.808	S	S	*	*			trans	-84.8	137.6	174.9	-68.2	170.1	174.7	167.7	0	108.9
461	C	20.8	Very low	22.5	Very low	139 Å²	139	161.4 Å²	161.4	94%	0.939	80%	0.804	S	S	*	*			trans	-133.7	120.6	144	-83.1	0	0	0	0	107.9
462	K	21.3	Very low	22.6	Very low	179 Å²	179	162.5 Å²	162.5	78%	0.778	80%	0.802	S	S	*	*			trans	-90.3	138.5	176.2	-68.6	174.2	173.6	177.3	0	108.3
463	F	21.8	Very low	22.8	Very low	218 Å²	218	163.7 Å²	163.7	96%	0.956	81%	0.808	S	S	*	*			trans	-141.6	133.5	142.8	-99.8	-81.4	0	0	0	109.4
464	R	21.8	Very low	23.1	Very low	234 Å²	234	162.7 Å²	162.7	88%	0.883	81%	0.806	S	S	*	*			trans	-88	138.6	-179.4	-99.4	-179.7	170.1	-176.5	-4.1	109.8
465	S	23.2	Very low	23.7	Very low	99 Å²	99	160.3 Å²	160.3	69%	0.692	80%	0.803	S	S	*	*			trans	19.4	126.9	147.3	63.1	0	0	0	0	120.3
466	V	26.5	Very low	24.3	Very low	147 Å²	147	164.4 Å²	164.4	89%	0.891	81%	0.81	S	S	*	*			trans	-137.3	134	137.2	-176.8	0	0	0	0	108.4
467	N	23.6	Very low	25	Very low	146 Å²	146	161.7 Å²	161.7	78%	0.781	80%	0.802	S	S	*	*			trans	-71	147.5	-178.8	-75.1	-25.6	0	0	0	112.9
468	T	22.4	Very low	25.8	Very low	117 Å²	117	155.2 Å²	155.2	72%	0.718	78%	0.782	S	S	*	*			trans	-1	130.3	148.9	-23.2	0	0	0	0	117.7
469	I	24.2	Very low	26.9	Very low	163 Å²	163	159.1 Å²	159.1	84%	0.836	79%	0.789	S	S	*	*				-149.5	129.2	118.5	-54.9	-170.1	0	0	0	107.3
470	N	24.1	Very low	27.7	Very low	138 Å²	138	152 Å²	152	74%	0.738	77%	0.773	S	S	*	*			trans	-50.2	154.4	170.2	-76.7	-44.3	0	0	0	111.6
471	L	22.4	Very low	28.6	Very low	138 Å²	138	145 Å²	145	72%	0.723	75%	0.746	S	S	*	*			trans	175.5	121.9	135.4	-90.3	158.7	0	0	0	108.7
472	Y	24.3	Very low	29.7	Very low	193 Å²	193	144 Å²	144	76%	0.757	73%	0.728	S	S	*	*			trans	74.9	100.7	164	-59.6	-72.2	0	0	0	120.1
473	Q	24.2	Very low	30.8	Very low	187 Å²	187	140.3 Å²	140.3	87%	0.874	72%	0.716	S	S	*	*				34	92.2	126.8	-74.7	174.8	-17.5	0	0	117.7
474	E	27.2	Very low	32	Very low	187 Å²	187	134.6 Å²	134.6	87%	0.874	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-90.7	127.8	140.5	-75.8	-177.6	164.4	0	0	108	K476	E474-K476 PolarHBondContact O-N 2.74Å; E474-K476 VanDerWaalsContact O-N 3.15Å
475	S	32.5	Very low	33	Very low	115 Å²	115	127.7 Å²	127.7	80%	0.804	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-54.4	117.1	-179.9	50.1	0	0	0	0	110.7
476	K	36.8	Very low	33.8	Very low	191 Å²	191	125.4 Å²	125.4	83%	0.83	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-57.5	128.9	167.9	-72.8	-175.5	177.4	-177.8	0	108.2	E474	E474-K476 PolarHBondContact O-N 2.74Å; E474-K476 VanDerWaalsContact O-N 3.15Å
477	P	37.5	Very low	34.2	Very low	82 Å²	82	126 Å²	126	53%	0.532	66%	0.659	S	S	.	*	P	Polyproline II helix	trans	-58.4	146.5	171.2	31.6	-36.8	0	0	0	108.1	S481	P477-S481 WeakPolarHBondContact CB-OG 3.23Å
478	S	40.1	Very low	34.9	Very low	76 Å²	76	123.4 Å²	123.4	53%	0.531	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-58.3	147.1	-170.4	75.9	0	0	0	0	110.5	V480 S481 E482	S478-V480 PolarHBondContact O-N 3.08Å; S478-S481 PolarHBondContact N-OG 2.71Å; S478-S481 WeakPolarHBondContact O-CA 3.25Å; S478-S481 WeakPolarHBondContact O-CB 3.3Å; S478-S481 PolarHBondContact O-N 3.17Å; S478-S481 PolarHBondContact O-OG 3.11Å; S478-E482 PolarHBondContact O-N 2.91Å
479	K	44.7	Very low	35.5	Very low	165 Å²	165	120.7 Å²	120.7	72%	0.717	64%	0.643	S	S	*	*	H	α-helix	trans	-57.4	-23.2	-176.5	-156.2	158.9	-175.4	176.5	0	113.4	I483	K479-I483 WeakPolarHBondContact O-CG1 3.42Å; K479-I483 PolarHBondContact O-N 3.34Å
480	V	41.9	Very low	35.7	Very low	98 Å²	98	117.4 Å²	117.4	59%	0.594	63%	0.631	S	S	*	*	H	α-helix	trans	-64.8	-40.1	171.9	180	0	0	0	0	111.6	S478 I483 L484	S478-V480 PolarHBondContact O-N 3.08Å; V480-I483 PolarHBondContact O-N 2.62Å; V480-L484 HydrophobicContact CG1-CD1 3.77Å; V480-L484 HydrophobicContact CG1-CG 4.46Å; V480-L484 WeakPolarHBondContact O-CB 3.31Å; V480-L484 WeakPolarHBondContact O-CD1 3.33Å; V480-L484 VanDerWaalsContact O-CG 3.25Å; V480-L484 WeakPolarHBondContact O-CG 3.47Å; V480-L484 PolarHBondContact O-N 3.14Å; V480-L484 VanDerWaalsContact O-N 3.09Å
481	S	39.6	Very low	36.1	Very low	32 Å²	32	117.8 Å²	117.8	22%	0.224	63%	0.63	C	S	.	*	H	α-helix	trans	-69.6	-34.5	179.3	71.2	0	0	0	0	113.6	P477 S478 N485	P477-S481 WeakPolarHBondContact CB-OG 3.23Å; S478-S481 PolarHBondContact N-OG 2.71Å; S478-S481 WeakPolarHBondContact O-CA 3.25Å; S478-S481 WeakPolarHBondContact O-CB 3.3Å; S478-S481 PolarHBondContact O-N 3.17Å; S478-S481 PolarHBondContact O-OG 3.11Å; S481-N485 PolarHBondContact O-N 2.92Å; S481-N485 PolarHBondContact O-ND2 2.92Å
482	E	44.3	Very low	36.6	Very low	120 Å²	120	117.1 Å²	117.1	56%	0.561	63%	0.631	S	S	*	*	H	α-helix	trans	-66.7	-41.2	174.7	-82.8	-175.6	153.1	0	0	111.9	S478 G486	S478-E482 PolarHBondContact O-N 2.91Å; E482-G486 PolarHBondContact O-N 3.42Å
483	I	43.9	Very low	37	Very low	100 Å²	100	118.2 Å²	118.2	51%	0.513	64%	0.64	S	S	.	*	H	α-helix	trans	-69.3	-39.6	179.7	-64	168.9	0	0	0	110.7	K479 V480 N485 G486 F487	K479-I483 WeakPolarHBondContact O-CG1 3.42Å; K479-I483 PolarHBondContact O-N 3.34Å; V480-I483 PolarHBondContact O-N 2.62Å; I483-N485 PolarHBondContact O-N 3.1Å; I483-G486 PolarHBondContact O-N 2.91Å; I483-G486 VanDerWaalsContact O-N 3.14Å; I483-F487 HydrophobicContact CG2-CD2 4.12Å; I483-F487 HydrophobicContact CG2-CE2 4.05Å; I483-F487 PolarHBondContact O-N 3.36Å
484	L	45.9	Very low	37.3	Very low	99 Å²	99	118.4 Å²	118.4	52%	0.518	64%	0.641	S	S	.	*	H	α-helix	trans	-65.9	-34.9	178.7	-75.4	166.6	0	0	0	113.4	V480 G486 F487 T488	V480-L484 HydrophobicContact CG1-CD1 3.77Å; V480-L484 HydrophobicContact CG1-CG 4.46Å; V480-L484 WeakPolarHBondContact O-CB 3.31Å; V480-L484 WeakPolarHBondContact O-CD1 3.33Å; V480-L484 VanDerWaalsContact O-CG 3.25Å; V480-L484 WeakPolarHBondContact O-CG 3.47Å; V480-L484 PolarHBondContact O-N 3.14Å; V480-L484 VanDerWaalsContact O-N 3.09Å; L484-G486 PolarHBondContact O-N 2.77Å; L484-F487 PolarHBondContact O-N 2.99Å; L484-T488 PolarHBondContact O-N 3.42Å; L484-T488 PolarHBondContact O-OG1 2.93Å
485	N	42.8	Very low	37.3	Very low	88 Å²	88	113.7 Å²	113.7	47%	0.471	63%	0.629	S	S	.	*	H	α-helix	trans	-66.6	-27.7	174.4	-68.8	-20.2	0	0	0	112	S481 I483 V490	S481-N485 PolarHBondContact O-N 2.92Å; S481-N485 PolarHBondContact O-ND2 2.92Å; I483-N485 PolarHBondContact O-N 3.1Å; N485-V490 PolarHBondContact O-N 3Å
486	G	40.1	Very low	37	Very low	52 Å²	52	116.3 Å²	116.3	54%	0.536	63%	0.633	S	S	.	*	H	α-helix	trans	-70.5	-40	174.1	0	0	0	0	0	114.1	E482 I483 L484	E482-G486 PolarHBondContact O-N 3.42Å; I483-G486 PolarHBondContact O-N 2.91Å; I483-G486 VanDerWaalsContact O-N 3.14Å; L484-G486 PolarHBondContact O-N 2.77Å
487	F	35.4	Very low	36.3	Very low	160 Å²	160	112.3 Å²	112.3	70%	0.702	63%	0.629	S	S	*	*	H	α-helix	trans	-81.2	-23.5	-176.9	-84.2	-78.1	0	0	0	114.6	I483 L484	I483-F487 HydrophobicContact CG2-CD2 4.12Å; I483-F487 HydrophobicContact CG2-CE2 4.05Å; I483-F487 PolarHBondContact O-N 3.36Å; L484-F487 PolarHBondContact O-N 2.99Å
488	T	39.3	Very low	35.8	Very low	90 Å²	90	115.7 Å²	115.7	55%	0.552	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	1.9	179.7	53.4	0	0	0	0	113.6	L484 V490	L484-T488 PolarHBondContact O-N 3.42Å; L484-T488 PolarHBondContact O-OG1 2.93Å; T488-V490 PolarHBondContact O-N 3.44Å
489	G	34.1	Very low	35	Very low	60 Å²	60	117.7 Å²	117.7	62%	0.619	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.5	14.5	177.8	0	0	0	0	0	114.6	M491	G489-M491 VanDerWaalsContact C-N 3.34Å; G489-M491 PolarHBondContact O-N 3.28Å; G489-M491 VanDerWaalsContact O-N 3.09Å
490	V	28.2	Very low	34.1	Very low	95 Å²	95	118.1 Å²	118.1	58%	0.576	66%	0.656	S	S	*	*			trans	-85.8	78.3	177.2	-170.8	0	0	0	0	108.9	N485 T488	N485-V490 PolarHBondContact O-N 3Å; T488-V490 PolarHBondContact O-N 3.44Å
491	M	33.2	Very low	33.2	Very low	145 Å²	145	125 Å²	125	71%	0.714	67%	0.671	S	S	*	*			trans	-79.8	125.9	172.6	-73.8	-89.1	178	0	0	110.8	G489	G489-M491 VanDerWaalsContact C-N 3.34Å; G489-M491 PolarHBondContact O-N 3.28Å; G489-M491 VanDerWaalsContact O-N 3.09Å
492	T	32.3	Very low	32.3	Very low	124 Å²	124	129.1 Å²	129.1	76%	0.761	70%	0.695	S	S	*	*			trans	-72.3	124.6	164.2	45.9	0	0	0	0	110	Q494	T492-Q494 PolarHBondContact O-N 2.95Å
493	K	32.7	Very low	31.3	Very low	216 Å²	216	133.2 Å²	133.2	94%	0.939	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	27.9	-169.9	-92.6	-176.6	176.2	178.8	0	118.9
494	Q	30.2	Very low	30.2	Very low	192 Å²	192	138.6 Å²	138.6	90%	0.897	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.9	5.1	-179.8	-77.5	-171.9	-2.7	0	0	117	T492 L496	T492-Q494 PolarHBondContact O-N 2.95Å; Q494-L496 PolarHBondContact O-N 3.45Å
495	S	27.8	Very low	29.1	Very low	87 Å²	87	141.9 Å²	141.9	61%	0.608	74%	0.742	S	S	*	*			trans	-98.4	43.6	176.1	61.6	0	0	0	0	114.1
496	L	25.7	Very low	28.1	Very low	171 Å²	171	142 Å²	142	90%	0.895	75%	0.75	S	S	*	*			trans	-146.8	79.6	164.3	-110.7	115	0	0	0	110.6	Q494	Q494-L496 PolarHBondContact O-N 3.45Å
497	S	23.7	Very low	27.3	Very low	106 Å²	106	146.6 Å²	146.6	74%	0.741	76%	0.761	S	S	*	*	S	Bend	trans	-172.5	125.4	136.1	43.6	0	0	0	0	112.5
498	N	25.3	Very low	26.7	Very low	153 Å²	153	146.3 Å²	146.3	82%	0.818	77%	0.767	S	S	*	*			trans	80.4	78.2	146.9	-60.7	-8.3	0	0	0	119.7
499	V	24.4	Very low	26.7	Very low	119 Å²	119	147.2 Å²	147.2	72%	0.721	77%	0.774	S	S	*	*				-41.1	144.9	123.8	173.1	0	0	0	0	112.5
500	H	24.4	Very low	26.2	Very low	174 Å²	174	152.5 Å²	152.5	81%	0.806	79%	0.786	S	S	*	*			trans	86.3	109.5	178	-60.8	-26.2	0	0	0	115.4
501	R	23.5	Very low	25.8	Very low	242 Å²	242	154.9 Å²	154.9	91%	0.913	80%	0.796	S	S	*	*				-174.5	142.1	71.1	-154.8	173.1	-162.7	166.1	4.3	110.6
502	T	21.6	Very low	25.3	Very low	118 Å²	118	152.8 Å²	152.8	72%	0.724	80%	0.796	S	S	*	*			trans	-54.2	144.1	170.5	36.3	0	0	0	0	115.1
503	K	23.9	Very low	24.7	Very low	207 Å²	207	152.3 Å²	152.3	90%	0.9	79%	0.793	S	S	*	*				-169.8	125.5	126.4	-105.6	175.8	-176.4	-174.5	0	112.4
504	Y	20.3	Very low	24.4	Very low	212 Å²	212	149.7 Å²	149.7	83%	0.831	79%	0.789	S	S	*	*			trans	-54.3	148.5	162.3	-80.3	-105.6	0	0	0	112
505	I	23	Very low	24	Very low	168 Å²	168	149.8 Å²	149.8	86%	0.862	79%	0.786	S	S	*	*				-171.6	132.9	118	-87.4	151.7	0	0	0	109
506	S	20.8	Very low	24.4	Very low	91 Å²	91	151 Å²	151	64%	0.636	79%	0.792	S	S	*	*			trans	-78.9	159.7	173.7	44.4	0	0	0	0	113.8
507	I	22.6	Very low	24.2	Very low	148 Å²	148	147.7 Å²	147.7	76%	0.759	78%	0.783	S	S	*	*				151.7	113.1	128.7	-75	160.1	0	0	0	112.1
508	N	23.1	Very low	24.3	Very low	154 Å²	154	150 Å²	150	82%	0.824	78%	0.782	S	S	*	*			trans	58.9	153.3	137.2	-68.3	-4.1	0	0	0	126.7
509	P	39.2	Very low	24.2	Very low	109 Å²	109	150.4 Å²	150.4	71%	0.708	78%	0.777	S	S	*	*			trans	-117.4	153	-163	39.8	-24.6	0	0	0	114
510	I	24.1	Very low	24.1	Very low	171 Å²	171	151.6 Å²	151.6	88%	0.877	78%	0.779	S	S	*	*			trans	-149	139	154.6	-63.8	-171.6	0	0	0	111.2
511	N	20.1	Very low	24.2	Very low	146 Å²	146	148.5 Å²	148.5	78%	0.781	78%	0.777	S	S	*	*			trans	-50.7	163	174.8	-65.5	-38.9	0	0	0	118
512	S	22.4	Very low	24.1	Very low	101 Å²	101	142.9 Å²	142.9	71%	0.706	77%	0.769	S	S	*	*				127	116.3	123.7	75.4	0	0	0	0	116.9
513	T	20	Very low	24.3	Very low	114 Å²	114	144.4 Å²	144.4	70%	0.699	77%	0.773	S	S	*	*			trans	42.2	116.9	132.7	59.1	0	0	0	0	120.4
514	N	26.9	Very low	24.2	Very low	161 Å²	161	141.2 Å²	141.2	86%	0.861	76%	0.764	S	S	*	*				177.8	146.4	110.5	-91.7	-30.2	0	0	0	113.6
515	K	21.5	Very low	24.3	Very low	194 Å²	194	137.7 Å²	137.7	84%	0.843	76%	0.759	S	S	*	*			trans	-60.1	-167.9	168.9	-69	174.8	165.8	174.5	0	112.6
516	P	36.9	Very low	24.3	Very low	111 Å²	111	138.7 Å²	138.7	72%	0.721	76%	0.762	S	S	*	*				-125.7	178.8	-66.4	37	-20.9	0	0	0	110.7
517	S	21.6	Very low	24.5	Very low	103 Å²	103	139.7 Å²	139.7	72%	0.72	77%	0.769	S	S	*	*				156.1	134.8	127.1	58.7	0	0	0	0	115.3
518	H	24.8	Very low	24.5	Very low	153 Å²	153	139.9 Å²	139.9	71%	0.708	77%	0.771	S	S	*	*			trans	72.9	113.9	141.7	-75.5	-50.3	0	0	0	123.7
519	K	23.6	Very low	24.6	Very low	163 Å²	163	138.4 Å²	138.4	71%	0.709	77%	0.77	S	S	*	*				94.9	113.2	119.4	-77.2	175.7	-178.1	-178.8	0	119.6
520	N	21.5	Very low	23.8	Very low	143 Å²	143	139.4 Å²	139.4	77%	0.765	77%	0.774	S	S	*	*				71.3	110.6	127.7	-65.9	2.9	0	0	0	119.7
521	S	26.1	Very low	23.6	Very low	109 Å²	109	139.3 Å²	139.3	76%	0.762	77%	0.772	S	S	*	*				170.8	99.8	114.9	34.3	0	0	0	0	108.8
522	T	21.6	Very low	23.8	Very low	124 Å²	124	141.1 Å²	141.1	76%	0.761	78%	0.775	S	S	*	*				51.1	103.6	104.1	50.4	0	0	0	0	115.7
523	N	26.2	Very low	23.7	Very low	151 Å²	151	139.1 Å²	139.1	81%	0.807	77%	0.77	S	S	*	*			trans	178.6	92.8	133.7	-85.4	-20	0	0	0	107.1
524	I	22.7	Very low	23.9	Very low	139 Å²	139	140.8 Å²	140.8	71%	0.713	78%	0.775	S	S	*	*				69.2	96.5	93.6	-63.5	175.1	0	0	0	113
525	I	21.9	Very low	23.7	Very low	139 Å²	139	139.9 Å²	139.9	71%	0.713	77%	0.77	S	S	*	*				56.7	113.6	129.3	-51.1	173.1	0	0	0	118.1
526	M	23.7	Very low	24	Very low	188 Å²	188	139.6 Å²	139.6	93%	0.926	77%	0.772	S	S	*	*				-167	88.8	114.9	-91.5	-93.4	-95.7	0	0	107.3
527	S	24.7	Very low	23.3	Very low	113 Å²	113	139.6 Å²	139.6	79%	0.79	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-79.6	134.6	178.5	33	0	0	0	0	111.6
528	L	21.8	Very low	23.4	Very low	152 Å²	152	142.2 Å²	142.2	80%	0.796	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-55.1	149	171.2	-165.3	68.4	0	0	0	112	T530	L528-T530 PolarHBondContact O-N 3.22Å
529	P	24.7	Very low	23.3	Very low	123 Å²	123	141.5 Å²	141.5	80%	0.799	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-65.4	119.5	179.4	-16.2	29.8	0	0	0	111.3
530	T	22.5	Very low	23.5	Very low	130 Å²	130	141.2 Å²	141.2	80%	0.798	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-82.1	133.5	173.8	-42.1	0	0	0	0	110	L528 H532	L528-T530 PolarHBondContact O-N 3.22Å; T530-H532 PolarHBondContact O-N 3.02Å
531	M	19.6	Very low	23.6	Very low	169 Å²	169	142.7 Å²	142.7	83%	0.833	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-48.2	120.6	164.3	-69.1	-78.2	-59.8	0	0	112.1
532	H	24.6	Very low	23.8	Very low	183 Å²	183	148 Å²	148	85%	0.847	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-90.3	135.3	143.4	-96.3	24.7	0	0	0	105.6	T530	T530-H532 PolarHBondContact O-N 3.02Å
533	G	20.6	Very low	23.8	Very low	59 Å²	59	145.3 Å²	145.3	61%	0.608	80%	0.796	S	S	*	*			cis	113.3	126.3	39.7	0	0	0	0	0	106.3
534	D	25.3	Very low	23.6	Very low	150 Å²	150	144.1 Å²	144.1	80%	0.802	79%	0.789	S	S	*	*			trans	89.9	92.5	166.3	-51.3	-22.5	0	0	0	117.8
535	D	22.3	Very low	23.9	Very low	142 Å²	142	147.7 Å²	147.7	76%	0.759	80%	0.8	S	S	*	*				21.9	111.1	114.4	-64.4	-22.7	0	0	0	116.1
536	H	27.9	Very low	24.1	Very low	188 Å²	188	145.6 Å²	145.6	87%	0.87	79%	0.79	S	S	*	*				-163.4	116	129.4	-87.2	-50.3	0	0	0	110
537	C	21.6	Very low	24.5	Very low	110 Å²	110	145.3 Å²	145.3	74%	0.743	79%	0.792	S	S	*	*			trans	-55.6	134.3	160.5	32.3	0	0	0	0	111.5
538	N	24.5	Very low	24.4	Very low	159 Å²	159	149.1 Å²	149.1	85%	0.85	79%	0.79	S	S	*	*			trans	-163.4	136.7	134.3	-96.7	-33.1	0	0	0	111.5
539	N	23.1	Very low	24.7	Very low	138 Å²	138	151.6 Å²	151.6	74%	0.738	80%	0.795	S	S	*	*			trans	-50.6	146.5	165.4	-62.3	-52	0	0	0	110.4
540	D	27.1	Very low	24.6	Very low	156 Å²	156	149 Å²	149	83%	0.834	79%	0.79	S	S	*	*				-173.6	146.2	109.9	-89	-25	0	0	0	112.9
541	Q	23.9	Very low	24.8	Very low	174 Å²	174	150.8 Å²	150.8	81%	0.813	79%	0.794	S	S	*	*			trans	-64.2	129.5	179.6	-60.9	159.8	-13.2	0	0	111.3
542	F	29.1	Very low	25	Very low	220 Å²	220	149.8 Å²	149.8	97%	0.965	79%	0.792	S	S	*	*			trans	-163.4	117.4	143.9	-89.8	-76.9	0	0	0	104
543	G	22.9	Very low	24.9	Very low	69 Å²	69	148.4 Å²	148.4	71%	0.711	80%	0.796	S	S	*	*			cis	123.7	84.6	48	0	0	0	0	0	106.2
544	N	21.9	Very low	25.1	Very low	125 Å²	125	148.8 Å²	148.8	67%	0.668	80%	0.8	S	S	*	*			trans	39.5	109.7	141.2	-136.2	24.2	0	0	0	118.6
545	F	29.4	Very low	25	Very low	215 Å²	215	149.4 Å²	149.4	94%	0.943	80%	0.798	S	S	*	*			trans	-142.3	108.5	138.7	-109.9	-82.3	0	0	0	109.6
546	D	24.8	Very low	25	Very low	94 Å²	94	150.3 Å²	150.3	50%	0.503	80%	0.802	S	S	.	*			trans	-59.3	130	177.8	-69.5	-66.4	0	0	0	112.7
547	L	32.4	Very low	24.9	Very low	183 Å²	183	151.4 Å²	151.4	96%	0.958	80%	0.8	S	S	*	*			trans	-129.1	76.9	136.8	-137	96.4	0	0	0	108.6
548	Y	22.9	Very low	25	Very low	193 Å²	193	154.7 Å²	154.7	76%	0.757	80%	0.804	S	S	*	*			trans	-70	154.3	164	-105.1	-85.3	0	0	0	111.2
549	K	26.9	Very low	25	Very low	204 Å²	204	154.8 Å²	154.8	89%	0.887	81%	0.805	S	S	*	*			trans	93.5	103.7	166.3	-59.1	178.2	179.1	177.2	0	113.5
550	G	22.8	Very low	25.3	Very low	69 Å²	69	153.3 Å²	153.3	71%	0.711	80%	0.803	S	S	*	*			cis	132.2	113.3	17.4	0	0	0	0	0	107.9
551	L	28.4	Very low	25.2	Very low	166 Å²	166	153.2 Å²	153.2	87%	0.869	80%	0.801	S	S	*	*			trans	-161.3	96	153.1	-106.1	140.9	0	0	0	109.1
552	N	23.6	Very low	25.2	Very low	148 Å²	148	152.1 Å²	152.1	79%	0.791	80%	0.8	S	S	*	*			trans	49.4	101.5	149.4	-68.1	-24.3	0	0	0	119.9	G554	N552-G554 PolarHBondContact O-N 3.41Å
553	V	22	Very low	25.1	Very low	155 Å²	155	149.6 Å²	149.6	94%	0.939	79%	0.794	S	S	*	*			trans	-51.4	117.9	137.5	179.2	0	0	0	0	108.8
554	G	24.3	Very low	25.1	Very low	67 Å²	67	149.6 Å²	149.6	69%	0.691	78%	0.784	S	S	*	*			trans	-154	86.4	177	0	0	0	0	0	110.2	N552	N552-G554 PolarHBondContact O-N 3.41Å
555	H	24	Very low	25.8	Very low	162 Å²	162	150.9 Å²	150.9	75%	0.75	79%	0.791	S	S	*	*			trans	40.1	111.6	151.9	-105.3	-87.8	0	0	0	119.6	Y557	H555-Y557 PolarHBondContact O-N 2.66Å; H555-Y557 VanDerWaalsContact O-N 3.13Å
556	L	21.1	Very low	25.7	Very low	162 Å²	162	151.2 Å²	151.2	85%	0.848	79%	0.785	S	S	*	*			trans	-20	108.6	132.1	-73.6	153.4	0	0	0	112.4
557	Y	26.3	Very low	26.4	Very low	211 Å²	211	152.3 Å²	152.3	83%	0.827	79%	0.792	S	S	*	*			trans	-151.8	128.5	136	-93.3	-72.7	0	0	0	109.1	H555 N559	H555-Y557 PolarHBondContact O-N 2.66Å; H555-Y557 VanDerWaalsContact O-N 3.13Å; Y557-N559 PolarHBondContact O-N 2.91Å
558	E	23	Very low	26.5	Very low	179 Å²	179	149.9 Å²	149.9	84%	0.836	78%	0.78	S	S	*	*			trans	-50.4	127.2	171.4	-61	176.2	145	0	0	110.7
559	N	24.5	Very low	27.4	Very low	160 Å²	160	144.2 Å²	144.2	86%	0.856	77%	0.768	S	S	*	*			trans	-145.6	105.9	148.2	-102	-31.9	0	0	0	108.3	Y557	Y557-N559 PolarHBondContact O-N 2.91Å
560	P	29.4	Very low	28.8	Very low	108 Å²	108	137.3 Å²	137.3	70%	0.701	75%	0.746	S	S	*	*			trans	-73.4	150.8	170.6	32.2	-29.9	0	0	0	108.6
561	L	26.1	Very low	30.4	Very low	153 Å²	153	139.9 Å²	139.9	80%	0.801	74%	0.737	S	S	*	*			trans	84.9	65.2	171.5	-48.1	170.8	0	0	0	116.6
562	I	24.1	Very low	32.2	Very low	152 Å²	152	133.4 Å²	133.4	78%	0.779	71%	0.711	S	S	*	*			trans	-132.8	81.1	137.5	-56.2	-177.1	0	0	0	107.3	S564	I562-S564 VanDerWaalsContact C-N 3.34Å; I562-S564 WeakPolarHBondContact CG2-OG 3.33Å; I562-S564 PolarHBondContact O-N 2.88Å
563	I	26	Very low	34.5	Very low	166 Å²	166	132.9 Å²	132.9	85%	0.851	70%	0.704	S	S	*	*			trans	-84.9	87.3	158.5	-60.1	172.4	0	0	0	104.4
564	S	24.3	Very low	36.7	Very low	70 Å²	70	128.2 Å²	128.2	49%	0.49	68%	0.681	S	S	.	*			trans	-138.4	119.9	169.3	61.8	0	0	0	0	110.3	I562 R566	I562-S564 VanDerWaalsContact C-N 3.34Å; I562-S564 WeakPolarHBondContact CG2-OG 3.33Å; I562-S564 PolarHBondContact O-N 2.88Å; S564-R566 PolarHBondContact O-N 3.36Å
565	D	34.9	Very low	38.8	Very low	152 Å²	152	131.2 Å²	131.2	81%	0.813	67%	0.672	S	S	*	*	S	Bend	trans	72.4	24.1	146.2	-53.3	-15.7	0	0	0	120.6
566	R	28.3	Very low	41	Very low	221 Å²	221	126.5 Å²	126.5	83%	0.834	66%	0.657	S	S	*	*	S	Bend	trans	-107.9	-0.8	169.8	-113.1	-174.5	-175.4	-166.7	2.1	116.8	S564	S564-R566 PolarHBondContact O-N 3.36Å
567	N	38.4	Very low	43.4	Very low	118 Å²	118	126.8 Å²	126.8	63%	0.631	65%	0.647	S	S	*	*	S	Bend	trans	-106.5	-15.6	-172.8	-74.5	-11.3	0	0	0	115.7	S570 F571	N567-S570 PolarHBondContact O-N 3.25Å; N567-S570 PolarHBondContact O-OG 3.1Å; N567-F571 WeakPolarHBondContact O-CB 3.33Å; N567-F571 PolarHBondContact O-N 3.48Å
568	D	35	Very low	45.6	Very low	132 Å²	132	120.3 Å²	120.3	71%	0.706	62%	0.623	S	S	*	*	H	α-helix	trans	-74.3	-34.4	179.6	-69.9	-13.1	0	0	0	111.8	S570 G572	D568-S570 VanDerWaalsContact C-N 3.34Å; D568-S570 PolarHBondContact O-N 3.18Å; D568-G572 PolarHBondContact O-N 3.17Å
569	S	42.9	Very low	48	Very low	74 Å²	74	114.6 Å²	114.6	52%	0.517	60%	0.596	S	S	.	*	H	α-helix	trans	-65.5	-37.2	173.6	61.5	0	0	0	0	111.9	Q573	S569-Q573 VanDerWaalsContact O-CB 3.3Å; S569-Q573 WeakPolarHBondContact O-CB 3.45Å; S569-Q573 WeakPolarHBondContact O-CG 3.39Å; S569-Q573 PolarHBondContact O-N 3.34Å; S569-Q573 VanDerWaalsContact O-N 3.11Å
570	S	55.7	Low	50.3	Low	59 Å²	59	111 Å²	111	41%	0.413	57%	0.574	S	S	.	*	H	α-helix	trans	-76.1	-37.3	178.2	69.4	0	0	0	0	112.7	N567 D568 A574	N567-S570 PolarHBondContact O-N 3.25Å; N567-S570 PolarHBondContact O-OG 3.1Å; D568-S570 VanDerWaalsContact C-N 3.34Å; D568-S570 PolarHBondContact O-N 3.18Å; S570-A574 VanDerWaalsContact O-CB 3.27Å; S570-A574 WeakPolarHBondContact O-CB 3.31Å; S570-A574 PolarHBondContact O-N 2.52Å
571	F	57.1	Low	52.4	Low	122 Å²	122	112.9 Å²	112.9	54%	0.535	57%	0.567	S	S	.	*	H	α-helix	trans	-66	-47.8	174	177.7	-97.4	0	0	0	111.8	N567 Q573 A574 W575	N567-F571 WeakPolarHBondContact O-CB 3.33Å; N567-F571 PolarHBondContact O-N 3.48Å; F571-Q573 VanDerWaalsContact C-N 3.27Å; F571-Q573 PolarHBondContact O-N 2.89Å; F571-A574 PolarHBondContact O-N 3.33Å; F571-W575 VanDerWaalsContact O-CB 3.25Å; F571-W575 WeakPolarHBondContact O-CB 3.39Å; F571-W575 PolarHBondContact O-N 2.92Å
572	G	65	Low	54.6	Low	31 Å²	31	111.5 Å²	111.5	32%	0.32	55%	0.551	S	S	.	*	H	α-helix	trans	-59.7	-39.9	176.9	0	0	0	0	0	111.8	D568 S576	D568-G572 PolarHBondContact O-N 3.17Å; G572-S576 VanDerWaalsContact O-CB 3.25Å; G572-S576 WeakPolarHBondContact O-CB 3.14Å; G572-S576 PolarHBondContact O-N 3.38Å; G572-S576 PolarHBondContact O-OG 2.83Å
573	Q	71.6	Confident	56.8	Low	137 Å²	137	107.5 Å²	107.5	64%	0.64	53%	0.526	S	S	*	.	H	α-helix	trans	-66.3	-48.2	173.8	-76.2	172.9	20.3	0	0	112.4	S569 F571 W575 S576 W577	S569-Q573 VanDerWaalsContact O-CB 3.3Å; S569-Q573 WeakPolarHBondContact O-CB 3.45Å; S569-Q573 WeakPolarHBondContact O-CG 3.39Å; S569-Q573 PolarHBondContact O-N 3.34Å; S569-Q573 VanDerWaalsContact O-N 3.11Å; F571-Q573 VanDerWaalsContact C-N 3.27Å; F571-Q573 PolarHBondContact O-N 2.89Å; Q573-W575 VanDerWaalsContact C-N 3.33Å; Q573-W575 PolarHBondContact O-N 3.01Å; Q573-S576 PolarHBondContact O-N 2.65Å; Q573-W577 WeakPolarHBondContact O-CB 3.48Å; Q573-W577 PolarHBondContact O-N 3.01Å
574	A	68.8	Low	59	Low	57 Å²	57	104 Å²	104	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-63	-39.7	179	0	0	0	0	0	112.1	S570 F571 F578	S570-A574 VanDerWaalsContact O-CB 3.27Å; S570-A574 WeakPolarHBondContact O-CB 3.31Å; S570-A574 PolarHBondContact O-N 2.52Å; F571-A574 PolarHBondContact O-N 3.33Å; A574-F578 WeakPolarHBondContact O-CB 3.46Å; A574-F578 PolarHBondContact O-N 2.95Å
575	W	68.7	Low	61.6	Low	130 Å²	130	105.6 Å²	105.6	49%	0.492	52%	0.519	S	S	.	.	H	α-helix	trans	-66.4	-43.5	175.1	-177.5	-115.9	0	0	0	111.9	F571 Q573 F578 K579	F571-W575 VanDerWaalsContact O-CB 3.25Å; F571-W575 WeakPolarHBondContact O-CB 3.39Å; F571-W575 PolarHBondContact O-N 2.92Å; Q573-W575 VanDerWaalsContact C-N 3.33Å; Q573-W575 PolarHBondContact O-N 3.01Å; W575-F578 AromaticContact CE3-CD1 3.99Å; W575-F578 HydrophobicContact CE3-CD1 3.99Å; W575-F578 HydrophobicContact CH2-CD1 4.36Å; W575-F578 HydrophobicContact CH2-CE1 4.31Å; W575-F578 AromaticContact CZ3-CD1 3.75Å; W575-F578 HydrophobicContact CZ3-CD1 3.75Å; W575-F578 AromaticContact CZ3-CE1 3.91Å; W575-F578 HydrophobicContact CZ3-CE1 3.91Å; W575-F578 PolarHBondContact O-N 2.97Å; W575-K579 HydrophobicContact CZ2-CG 4.44Å; W575-K579 WeakPolarHBondContact O-CG 3.23Å; W575-K579 PolarHBondContact O-N 2.95Å
576	S	69.8	Low	63.9	Low	63 Å²	63	99.3 Å²	99.3	44%	0.441	49%	0.487	S	S	.	.	H	α-helix	trans	-63.9	-43	175.9	-59.6	0	0	0	0	111.5	G572 Q573 F578 K579 E580	G572-S576 VanDerWaalsContact O-CB 3.25Å; G572-S576 WeakPolarHBondContact O-CB 3.14Å; G572-S576 PolarHBondContact O-N 3.38Å; G572-S576 PolarHBondContact O-OG 2.83Å; Q573-S576 PolarHBondContact O-N 2.65Å; S576-F578 VanDerWaalsContact C-N 3.34Å; S576-F578 PolarHBondContact O-N 2.99Å; S576-K579 PolarHBondContact O-N 2.99Å; S576-E580 WeakPolarHBondContact O-CB 3.36Å; S576-E580 PolarHBondContact O-N 3.37Å
577	W	70.7	Confident	66.6	Low	167 Å²	167	91.6 Å²	91.6	63%	0.633	47%	0.465	S	S	*	.	H	α-helix	trans	-60.9	-42	173.7	179.2	84.4	0	0	0	112.2	Q573 E580 R581	Q573-W577 WeakPolarHBondContact O-CB 3.48Å; Q573-W577 PolarHBondContact O-N 3.01Å; W577-E580 PolarHBondContact O-N 2.82Å; W577-R581 WeakPolarHBondContact O-CB 3.4Å; W577-R581 PolarHBondContact O-N 3.01Å
578	F	73.5	Confident	69.1	Low	75 Å²	75	86.3 Å²	86.3	33%	0.329	44%	0.437	S	S	.	.	H	α-helix	trans	-63.6	-46.9	176.5	172.9	-101.6	0	0	0	112.4	A574 W575 S576 E580 R581 R582	A574-F578 WeakPolarHBondContact O-CB 3.46Å; A574-F578 PolarHBondContact O-N 2.95Å; W575-F578 AromaticContact CE3-CD1 3.99Å; W575-F578 HydrophobicContact CE3-CD1 3.99Å; W575-F578 HydrophobicContact CH2-CD1 4.36Å; W575-F578 HydrophobicContact CH2-CE1 4.31Å; W575-F578 AromaticContact CZ3-CD1 3.75Å; W575-F578 HydrophobicContact CZ3-CD1 3.75Å; W575-F578 AromaticContact CZ3-CE1 3.91Å; W575-F578 HydrophobicContact CZ3-CE1 3.91Å; W575-F578 PolarHBondContact O-N 2.97Å; S576-F578 VanDerWaalsContact C-N 3.34Å; S576-F578 PolarHBondContact O-N 2.99Å; F578-E580 VanDerWaalsContact C-N 3.34Å; F578-R581 PolarHBondContact O-N 2.9Å; F578-R582 HydrophobicContact CZ-CG 4.43Å; F578-R582 PolarHBondContact O-N 3.25Å
579	K	72.8	Confident	72	Confident	60 Å²	60	80 Å²	80	26%	0.261	40%	0.403	S	S	.	.	H	α-helix	trans	-58.8	-46.8	174.8	-73.9	-169.1	-62.1	167.3	0	111	W575 S576 R581 R582 R583	W575-K579 HydrophobicContact CZ2-CG 4.44Å; W575-K579 WeakPolarHBondContact O-CG 3.23Å; W575-K579 PolarHBondContact O-N 2.95Å; S576-K579 PolarHBondContact O-N 2.99Å; K579-R581 VanDerWaalsContact C-N 3.35Å; K579-R581 PolarHBondContact O-N 2.93Å; K579-R582 WeakPolarHBondContact O-CB 3.3Å; K579-R582 PolarHBondContact O-N 3.21Å; K579-R583 WeakPolarHBondContact O-CB 3.5Å; K579-R583 PolarHBondContact O-N 2.79Å
580	E	72.8	Confident	74.4	Confident	83 Å²	83	77.8 Å²	77.8	39%	0.388	39%	0.385	S	S	.	.	H	α-helix	trans	-64.6	-40.4	-179.6	-173.7	56.9	-158.3	0	0	111.7	S576 W577 F578 R582 R583 V584	S576-E580 WeakPolarHBondContact O-CB 3.36Å; S576-E580 PolarHBondContact O-N 3.37Å; W577-E580 PolarHBondContact O-N 2.82Å; F578-E580 VanDerWaalsContact C-N 3.34Å; E580-R582 VanDerWaalsContact C-N 3.32Å; E580-R582 PolarHBondContact O-N 2.82Å; E580-R583 WeakPolarHBondContact O-CB 3.47Å; E580-R583 PolarHBondContact O-N 3.01Å; E580-R583 IonicContact OE1-CZ 3.71Å; E580-R583 IonicContact OE1-NE 3.9Å; E580-R583 PolarHBondContact OE1-NE 3.5Å; E580-R583 IonicContact OE1-NH2 3.23Å; E580-R583 PolarHBondContact OE1-NH2 2.88Å; E580-R583 IonicContact OE2-CZ 3.39Å; E580-R583 IonicContact OE2-NE 3.21Å; E580-R583 PolarHBondContact OE2-NE 3.27Å; E580-R583 IonicContact OE2-NH2 3.55Å; E580-V584 HydrophobicContact CG-CG2 4.47Å; E580-V584 WeakPolarHBondContact O-CG2 3.34Å; E580-V584 PolarHBondContact O-N 3.32Å
581	R	73.7	Confident	76.3	Confident	149 Å²	149	75 Å²	75	56%	0.562	37%	0.366	S	S	*	.	H	α-helix	trans	-62.6	-39.4	174.7	-172	167.1	178.4	103.1	-1.4	111.8	W577 F578 K579 T585	W577-R581 WeakPolarHBondContact O-CB 3.4Å; W577-R581 PolarHBondContact O-N 3.01Å; F578-R581 PolarHBondContact O-N 2.9Å; K579-R581 VanDerWaalsContact C-N 3.35Å; K579-R581 PolarHBondContact O-N 2.93Å; R581-T585 WeakPolarHBondContact O-CB 3.44Å; R581-T585 VanDerWaalsContact O-CG2 3.31Å; R581-T585 WeakPolarHBondContact O-CG2 3.47Å; R581-T585 PolarHBondContact O-N 2.8Å; R581-T585 PolarHBondContact O-OG1 3.02Å
582	R	73.5	Confident	78.1	Confident	124 Å²	124	69.5 Å²	69.5	47%	0.468	34%	0.342	S	S	.	.	H	α-helix	trans	-64	-44.5	172.2	-76.1	-169	165.8	-173.1	-1.6	111.7	D204 F578 K579 E580 V584 T585 S586	D204-R582 HydrophobicContact CB-CB 4.32Å; D204-R582 VanDerWaalsContact OD2-CB 3.29Å; D204-R582 WeakPolarHBondContact OD2-CB 3.49Å; F578-R582 HydrophobicContact CZ-CG 4.43Å; F578-R582 PolarHBondContact O-N 3.25Å; K579-R582 WeakPolarHBondContact O-CB 3.3Å; K579-R582 PolarHBondContact O-N 3.21Å; E580-R582 VanDerWaalsContact C-N 3.32Å; E580-R582 PolarHBondContact O-N 2.82Å; R582-V584 PolarHBondContact O-N 3.48Å; R582-T585 PolarHBondContact O-N 3.36Å; R582-T585 PolarHBondContact O-OG1 3.27Å; R582-S586 WeakPolarHBondContact O-CA 3.34Å; R582-S586 WeakPolarHBondContact O-CB 3.42Å; R582-S586 PolarHBondContact O-N 3.07Å
583	R	70	Confident	79.5	Confident	67 Å²	67	68 Å²	68	25%	0.253	33%	0.327	S	S	.	.	H	α-helix	trans	-58.1	-46	177.1	-163.1	-176.3	77.1	87.7	5.9	112.5	R203 D204 E206 K579 E580 S586	R203-R583 HydrophobicContact CB-CG 3.48Å; R203-R583 VanDerWaalsContact CB-CG 3.48Å; R203-R583 HydrophobicContact CG-CG 4.34Å; D204-R583 WeakPolarHBondContact O-CG 3.09Å; E206-R583 WeakPolarHBondContact OE1-CD 3.35Å; E206-R583 IonicContact OE1-NH1 2.71Å; E206-R583 PolarHBondContact OE1-NH1 3.04Å; E206-R583 VanDerWaalsContact OE1-NH1 3.13Å; K579-R583 WeakPolarHBondContact O-CB 3.5Å; K579-R583 PolarHBondContact O-N 2.79Å; E580-R583 WeakPolarHBondContact O-CB 3.47Å; E580-R583 PolarHBondContact O-N 3.01Å; E580-R583 IonicContact OE1-CZ 3.71Å; E580-R583 IonicContact OE1-NE 3.9Å; E580-R583 PolarHBondContact OE1-NE 3.5Å; E580-R583 IonicContact OE1-NH2 3.23Å; E580-R583 PolarHBondContact OE1-NH2 2.88Å; E580-R583 IonicContact OE2-CZ 3.39Å; E580-R583 IonicContact OE2-NE 3.21Å; E580-R583 PolarHBondContact OE2-NE 3.27Å; E580-R583 IonicContact OE2-NH2 3.55Å; R583-S586 PolarHBondContact O-N 3.36Å; R583-S586 PolarHBondContact O-OG 2.94Å
584	V	72.1	Confident	80.6	Confident	93 Å²	93	61.5 Å²	61.5	56%	0.564	30%	0.296	S	S	*	.	H	α-helix	trans	-68.2	-39	178.6	173.4	0	0	0	0	112.1	E580 R582	E580-V584 HydrophobicContact CG-CG2 4.47Å; E580-V584 WeakPolarHBondContact O-CG2 3.34Å; E580-V584 PolarHBondContact O-N 3.32Å; R582-V584 PolarHBondContact O-N 3.48Å
585	T	77.8	Confident	81.8	Confident	104 Å²	104	58.8 Å²	58.8	64%	0.638	27%	0.274	S	S	*	.	H	α-helix	trans	-85.1	-10.6	-179.6	56.6	0	0	0	0	113.9	R581 R582	R581-T585 WeakPolarHBondContact O-CB 3.44Å; R581-T585 VanDerWaalsContact O-CG2 3.31Å; R581-T585 WeakPolarHBondContact O-CG2 3.47Å; R581-T585 PolarHBondContact O-N 2.8Å; R581-T585 PolarHBondContact O-OG1 3.02Å; R582-T585 PolarHBondContact O-N 3.36Å; R582-T585 PolarHBondContact O-OG1 3.27Å
586	S	83.3	Confident	83.1	Confident	20 Å²	20	52.6 Å²	52.6	14%	0.14	25%	0.251	C	S	.	.	S	Bend	trans	-70.1	151	179.5	69.8	0	0	0	0	112.6	D204 R582 R583 S588	D204-S586 PolarHBondContact N-OG 2.71Å; R582-S586 WeakPolarHBondContact O-CA 3.34Å; R582-S586 WeakPolarHBondContact O-CB 3.42Å; R582-S586 PolarHBondContact O-N 3.07Å; R583-S586 PolarHBondContact O-N 3.36Å; R583-S586 PolarHBondContact O-OG 2.94Å; S586-S588 PolarHBondContact O-N 2.78Å
587	V	86	Confident	84.4	Confident	59 Å²	59	49.9 Å²	49.9	36%	0.358	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-66.9	121.2	172.9	179.1	0	0	0	0	108.3	Y232 L589	Y232-V587 WeakPolarHBondContact CE2-O 3.37Å; Y232-V587 PolarHBondContact OH-O 2.74Å; Y232-V587 VanDerWaalsContact OH-O 3.08Å; V587-L589 HydrophobicContact CG1-CD2 3.97Å; V587-L589 PolarHBondContact O-N 3.05Å
588	S	91.6	Very high	85.6	Confident	7 Å²	7	42 Å²	42	5%	0.049	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-75.1	123	175.9	-51.6	0	0	0	0	110.2	R203 M302 S586	R203-S588 PolarHBondContact NH1-OG 2.85Å; R203-S588 PolarHBondContact NH2-OG 3.5Å; M302-S588 PolarHBondContact N-O 2.74Å; S586-S588 PolarHBondContact O-N 2.78Å
589	L	94	Very high	86.6	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	122.9	179.2	-62.1	179.6	0	0	0	109.3	V201 L202 Y232 I235 K236 Y239 I299 K300 V587	V201-L589 WeakPolarHBondContact CA-O 3.36Å; L202-L589 PolarHBondContact N-O 2.81Å; L202-L589 PolarHBondContact O-N 2.89Å; Y232-L589 HydrophobicContact CE2-CD1 4.01Å; Y232-L589 HydrophobicContact CE2-CG 4.2Å; I235-L589 HydrophobicContact CG2-CD1 3.75Å; K236-L589 HydrophobicContact CB-CD1 4.17Å; K236-L589 HydrophobicContact CD-CD1 4.03Å; Y239-L589 HydrophobicContact CD1-CD2 4.12Å; Y239-L589 HydrophobicContact CD2-CD2 4.43Å; Y239-L589 HydrophobicContact CE1-CD2 4.32Å; Y239-L589 HydrophobicContact CG-CD2 4.18Å; I299-L589 HydrophobicContact CG2-CB 4.38Å; I299-L589 HydrophobicContact CG2-CD1 4.39Å; I299-L589 HydrophobicContact CG2-CD2 4.43Å; K300-L589 CarbonylContact O-C 3.49Å; K300-L589 WeakPolarHBondContact O-CA 3.47Å; V587-L589 HydrophobicContact CG1-CD2 3.97Å; V587-L589 PolarHBondContact O-N 3.05Å
590	I	94	Very high	87.6	Confident	27 Å²	27	37.5 Å²	37.5	14%	0.138	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	127.7	166.3	-61.2	161.4	0	0	0	107	C200 V201 I299 K300 M302	C200-I590 WeakPolarHBondContact O-CA 3.44Å; V201-I590 HydrophobicContact CG2-CG1 4.03Å; I299-I590 VanDerWaalsContact CA-O 3.31Å; I299-I590 WeakPolarHBondContact CA-O 3.35Å; K300-I590 HydrophobicContact CB-CB 4.48Å; K300-I590 PolarHBondContact N-O 3.04Å; K300-I590 PolarHBondContact O-N 3.13Å; M302-I590 HydrophobicContact CG-CD1 4.11Å; M302-I590 HydrophobicContact CG-CG1 3.9Å; M302-I590 HydrophobicContact SD-CD1 3.68Å; M302-I590 HydrophobicContact SD-CG1 3.83Å
591	A	94.9	Very high	88.6	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	112.2	176.3	0	0	0	0	0	110	C200 L202 I208 I235 I297 A298	C200-A591 WeakPolarHBondContact CB-O 3.46Å; C200-A591 PolarHBondContact O-N 2.85Å; C200-A591 PolarHBondContact SG-O 3.23Å; L202-A591 HydrophobicContact CD1-CB 3.4Å; L202-A591 VanDerWaalsContact CD1-CB 3.4Å; I208-A591 HydrophobicContact CD1-CB 3.96Å; I235-A591 HydrophobicContact CD1-CB 4.27Å; I297-A591 HydrophobicContact CG2-CB 3.82Å; A298-A591 WeakPolarHBondContact O-CA 3.35Å
592	S	95	Very high	89.6	Confident	6 Å²	6	32.3 Å²	32.3	4%	0.042	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	114.3	-173.2	-53.2	0	0	0	0	109.3	F197 A298 T594	F197-S592 PolarHBondContact O-OG 2.98Å; A298-S592 PolarHBondContact N-O 3.44Å; A298-S592 PolarHBondContact O-N 2.96Å; S592-T594 PolarHBondContact O-N 3.2Å
593	P	95.3	Very high	90.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	132.9	171.9	-27.5	38.5	0	0	0	111.1	V142 I190 Y193 F197 V210 E296	V142-P593 HydrophobicContact CG2-CG 3.64Å; I190-P593 HydrophobicContact CD1-CB 4.17Å; Y193-P593 WeakPolarHBondContact CB-O 3.49Å; F197-P593 HydrophobicContact CE2-CB 4.37Å; V210-P593 HydrophobicContact CG1-CG 4.38Å; V210-P593 HydrophobicContact CG2-CG 3.93Å; E296-P593 CarbonylContact O-C 3.56Å; E296-P593 WeakPolarHBondContact O-CA 3.46Å
594	T	94.1	Very high	91.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-35.8	-179.4	57	0	0	0	0	111.7	I190 Y193 F283 E296 A298 S592	I190-T594 PolarHBondContact N-O 3.37Å; Y193-T594 HydrophobicContact CD1-CG2 4.15Å; Y193-T594 HydrophobicContact CD2-CG2 3.97Å; Y193-T594 HydrophobicContact CE1-CG2 4.37Å; Y193-T594 HydrophobicContact CE2-CG2 4.18Å; Y193-T594 HydrophobicContact CG-CG2 3.94Å; F283-T594 HydrophobicContact CD1-CG2 4.06Å; F283-T594 HydrophobicContact CE1-CG2 3.94Å; E296-T594 VanDerWaalsContact CB-OG1 3.3Å; E296-T594 WeakPolarHBondContact CB-OG1 3.29Å; E296-T594 WeakPolarHBondContact CG-OG1 3.44Å; E296-T594 PolarHBondContact O-N 3.18Å; E296-T594 PolarHBondContact O-OG1 3.06Å; E296-T594 PolarHBondContact OE1-OG1 3.16Å; A298-T594 HydrophobicContact CB-CG2 3.58Å; S592-T594 PolarHBondContact O-N 3.2Å
595	F	95.3	Very high	92.9	Very high	1 Å²	1	20.9 Å²	20.9	0%	0.004	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	161	167.1	68.1	-97.9	0	0	0	111.4	Y187 F188 T189 A295 E296 T597	Y187-F595 HydrophobicContact CD1-CB 4.44Å; Y187-F595 AromaticContact CD1-CD2 3.64Å; Y187-F595 HydrophobicContact CD1-CD2 3.64Å; Y187-F595 HydrophobicContact CD1-CE2 4.07Å; Y187-F595 HydrophobicContact CD1-CG 4.02Å; Y187-F595 AromaticContact CE1-CD2 3.64Å; Y187-F595 HydrophobicContact CE1-CD2 3.64Å; Y187-F595 AromaticContact CE1-CE2 3.56Å; Y187-F595 HydrophobicContact CE1-CE2 3.56Å; Y187-F595 HydrophobicContact CE1-CG 4.25Å; Y187-F595 HydrophobicContact CE1-CZ 4.06Å; F188-F595 WeakPolarHBondContact O-CA 3.45Å; T189-F595 HydrophobicContact CG2-CB 4.14Å; A295-F595 WeakPolarHBondContact CA-O 3.34Å; E296-F595 HydrophobicContact CB-CD1 3.8Å; E296-F595 HydrophobicContact CB-CE1 3.32Å; E296-F595 HydrophobicContact CB-CE2 4.1Å; E296-F595 HydrophobicContact CB-CG 4.38Å; E296-F595 HydrophobicContact CB-CZ 3.45Å; E296-F595 VanDerWaalsContact CB-CZ 3.45Å; E296-F595 HydrophobicContact CG-CE1 3.95Å; E296-F595 HydrophobicContact CG-CZ 4.35Å; E296-F595 PolarHBondContact N-O 3.44Å; E296-F595 WeakPolarHBondContact OE1-CE1 3.47Å; E296-F595 WeakPolarHBondContact OE2-CE1 3.29Å; F595-T597 HydrophobicContact CD2-CG2 4.27Å; F595-T597 HydrophobicContact CE2-CG2 3.86Å
596	I	96.3	Very high	93.6	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	142.7	164.2	-59	173.2	0	0	0	107.3	V140 F188 V210 L212 F226 A295 L598	V140-I596 HydrophobicContact CG1-CD1 4.04Å; V140-I596 HydrophobicContact CG2-CD1 3.86Å; F188-I596 HydrophobicContact CB-CB 4.41Å; F188-I596 WeakPolarHBondContact CD2-O 3.1Å; F188-I596 PolarHBondContact N-O 3.43Å; F188-I596 PolarHBondContact O-N 2.96Å; F188-I596 VanDerWaalsContact O-N 3.17Å; V210-I596 HydrophobicContact CG1-CD1 3.61Å; V210-I596 HydrophobicContact CG1-CG1 4.34Å; L212-I596 HydrophobicContact CB-CD1 3.92Å; L212-I596 HydrophobicContact CD2-CG2 4.12Å; F226-I596 HydrophobicContact CB-CG2 3.95Å; F226-I596 HydrophobicContact CD1-CD1 4.33Å; F226-I596 HydrophobicContact CD1-CG2 4.13Å; F226-I596 HydrophobicContact CD2-CG2 3.9Å; F226-I596 HydrophobicContact CE2-CG2 4.41Å; F226-I596 HydrophobicContact CG-CG2 3.74Å; A295-I596 HydrophobicContact CB-CG1 4.11Å; I596-L598 HydrophobicContact CG2-CD2 4.06Å
597	T	95.8	Very high	94.1	Very high	5 Å²	5	15.6 Å²	15.6	3%	0.031	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	141.2	175.6	-178.7	0	0	0	0	111.5	L186 Y187 G293 S294 F595	L186-T597 WeakPolarHBondContact O-CA 3.49Å; L186-T597 WeakPolarHBondContact O-CB 3.33Å; L186-T597 PolarHBondContact O-OG1 2.78Å; Y187-T597 VanDerWaalsContact CD2-OG1 3.3Å; Y187-T597 WeakPolarHBondContact CD2-OG1 3.12Å; Y187-T597 HydrophobicContact CE1-CG2 4.06Å; Y187-T597 HydrophobicContact CE2-CG2 4.3Å; Y187-T597 WeakPolarHBondContact CE2-OG1 2.93Å; G293-T597 CarbonylContact C-O 3.47Å; G293-T597 WeakPolarHBondContact CA-O 3.48Å; S294-T597 PolarHBondContact N-O 3.44Å; S294-T597 PolarHBondContact O-N 2.81Å; S294-T597 WeakPolarHBondContact OG-CG2 3.43Å; F595-T597 HydrophobicContact CD2-CG2 4.27Å; F595-T597 HydrophobicContact CE2-CG2 3.86Å
598	L	95.8	Very high	94.5	Very high	3 Å²	3	13.2 Å²	13.2	2%	0.016	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	156.1	177.4	59.7	164.5	0	0	0	110.7	L186 F188 L212 C225 I596 I603	L186-L598 PolarHBondContact N-O 2.84Å; L186-L598 PolarHBondContact O-N 3.28Å; F188-L598 HydrophobicContact CD2-CD2 3.93Å; F188-L598 HydrophobicContact CE2-CD2 3.54Å; L212-L598 HydrophobicContact CD2-CD2 3.79Å; C225-L598 HydrophobicContact CB-CD1 4.03Å; C225-L598 VanDerWaalsContact O-CD1 3.24Å; C225-L598 WeakPolarHBondContact O-CD1 3.18Å; I596-L598 HydrophobicContact CG2-CD2 4.06Å; L598-I603 HydrophobicContact CD1-CD1 4.25Å; L598-I603 HydrophobicContact CD1-CG1 3.56Å; L598-I603 HydrophobicContact CD2-CD1 4.27Å; L598-I603 HydrophobicContact CD2-CG1 4.41Å; L598-I603 HydrophobicContact CG-CD1 3.91Å; L598-I603 HydrophobicContact CG-CG1 3.76Å
599	P	94.9	Very high	94.5	Very high	36 Å²	36	18.7 Å²	18.7	23%	0.234	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	139.7	177.6	-24.3	32.5	0	0	0	112.8	D185 Q601 N602 I603	D185-P599 WeakPolarHBondContact OD1-CA 3.47Å; D185-P599 WeakPolarHBondContact OD1-CG 3.39Å; P599-Q601 PolarHBondContact O-N 2.82Å; P599-N602 WeakPolarHBondContact O-CB 3.44Å; P599-N602 PolarHBondContact O-N 2.97Å; P599-I603 PolarHBondContact O-N 3.44Å
600	C	94.6	Very high	94.3	Very high	3 Å²	3	21.7 Å²	21.7	2%	0.02	12%	0.115	C	C	.	.	H	α-helix	trans	-46.9	-47.1	173.3	177	0	0	0	0	111.8	L132 Y183 P184 L186 N602 I603 L604	L132-C600 HydrophobicContact CD1-CB 4.4Å; L132-C600 WeakPolarHBondContact CD1-SG 3.12Å; Y183-C600 HydrophobicContact CE2-CB 4.27Å; P184-C600 VanDerWaalsContact O-CB 3.31Å; P184-C600 WeakPolarHBondContact O-CB 3.41Å; P184-C600 PolarHBondContact O-N 2.8Å; L186-C600 HydrophobicContact CG-CB 4.47Å; C600-N602 VanDerWaalsContact C-N 3.26Å; C600-N602 PolarHBondContact O-N 2.77Å; C600-I603 WeakPolarHBondContact O-CB 3.47Å; C600-I603 PolarHBondContact O-N 3.06Å; C600-I603 VanDerWaalsContact O-N 3.1Å; C600-L604 PolarHBondContact O-N 3.26Å
601	Q	93.3	Very high	94.1	Very high	77 Å²	77	24.9 Å²	24.9	36%	0.36	13%	0.125	S	C	.	.	H	α-helix	trans	-60.3	-32.8	-179.6	-173.9	59.5	21.7	0	0	113.6	P599 L604 V605	P599-Q601 PolarHBondContact O-N 2.82Å; Q601-L604 PolarHBondContact O-N 3.43Å; Q601-V605 VanDerWaalsContact O-CG2 3.31Å; Q601-V605 WeakPolarHBondContact O-CG2 3.16Å; Q601-V605 PolarHBondContact O-N 2.84Å
602	N	93.5	Very high	93.9	Very high	47 Å²	47	31.1 Å²	31.1	25%	0.251	15%	0.149	S	C	.	.	H	α-helix	trans	-70	-38.1	179	-68	10.3	0	0	0	111.2	K292 P599 C600 E606	K292-N602 WeakPolarHBondContact CB-ND2 3.42Å; K292-N602 WeakPolarHBondContact CG-ND2 3Å; P599-N602 WeakPolarHBondContact O-CB 3.44Å; P599-N602 PolarHBondContact O-N 2.97Å; C600-N602 VanDerWaalsContact C-N 3.26Å; C600-N602 PolarHBondContact O-N 2.77Å; N602-E606 PolarHBondContact O-N 3.42Å; N602-E606 VanDerWaalsContact O-N 3.13Å
603	I	95.7	Very high	93.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.5	-43.9	176.2	-58.2	162.9	0	0	0	109.6	L132 Y138 L186 F188 C225 L598 P599 C600 V605 E606 L607	L132-I603 HydrophobicContact CD1-CB 3.95Å; L132-I603 HydrophobicContact CD1-CD1 4.32Å; L132-I603 HydrophobicContact CD1-CG2 3.97Å; L132-I603 HydrophobicContact CD2-CB 4.38Å; L132-I603 HydrophobicContact CD2-CG2 3.62Å; L132-I603 HydrophobicContact CG-CG2 4.43Å; Y138-I603 HydrophobicContact CE1-CG2 4.32Å; L186-I603 HydrophobicContact CB-CD1 4.19Å; L186-I603 HydrophobicContact CD1-CD1 3.88Å; L186-I603 HydrophobicContact CG-CD1 4.4Å; F188-I603 HydrophobicContact CE2-CD1 3.95Å; F188-I603 HydrophobicContact CZ-CD1 3.84Å; C225-I603 HydrophobicContact CB-CG1 4.4Å; L598-I603 HydrophobicContact CD1-CD1 4.25Å; L598-I603 HydrophobicContact CD1-CG1 3.56Å; L598-I603 HydrophobicContact CD2-CD1 4.27Å; L598-I603 HydrophobicContact CD2-CG1 4.41Å; L598-I603 HydrophobicContact CG-CD1 3.91Å; L598-I603 HydrophobicContact CG-CG1 3.76Å; P599-I603 PolarHBondContact O-N 3.44Å; C600-I603 WeakPolarHBondContact O-CB 3.47Å; C600-I603 PolarHBondContact O-N 3.06Å; C600-I603 VanDerWaalsContact O-N 3.1Å; I603-V605 PolarHBondContact O-N 3.33Å; I603-E606 WeakPolarHBondContact O-CB 3.2Å; I603-E606 PolarHBondContact O-N 3.23Å; I603-L607 HydrophobicContact CG2-CD1 3.81Å; I603-L607 WeakPolarHBondContact O-CG 3.33Å; I603-L607 PolarHBondContact O-N 2.98Å
604	L	95.1	Very high	93.3	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-60	-47	177.3	-70.4	168.1	0	0	0	112.6	Y128 L131 L132 C600 Q601 E606 L607 L608	Y128-L604 HydrophobicContact CD1-CD1 3.79Å; Y128-L604 HydrophobicContact CD1-CD2 4.09Å; Y128-L604 HydrophobicContact CD2-CD1 3.73Å; Y128-L604 HydrophobicContact CE1-CD1 4.42Å; Y128-L604 HydrophobicContact CE2-CD1 4.38Å; Y128-L604 HydrophobicContact CG-CD1 3.43Å; Y128-L604 VanDerWaalsContact CG-CD1 3.43Å; Y128-L604 HydrophobicContact CG-CD2 4.35Å; L131-L604 HydrophobicContact CD2-CD2 4.39Å; L132-L604 HydrophobicContact CD1-CD2 4.25Å; L132-L604 HydrophobicContact CD1-CG 4.13Å; L132-L604 HydrophobicContact CD2-CD2 3.84Å; L132-L604 HydrophobicContact CD2-CG 4.38Å; L132-L604 HydrophobicContact CG-CD2 3.93Å; L132-L604 HydrophobicContact CG-CG 4.36Å; C600-L604 PolarHBondContact O-N 3.26Å; Q601-L604 PolarHBondContact O-N 3.43Å; L604-E606 VanDerWaalsContact C-N 3.27Å; L604-E606 PolarHBondContact O-N 2.85Å; L604-L607 PolarHBondContact O-N 3.01Å; L604-L608 HydrophobicContact CB-CD1 4.31Å; L604-L608 HydrophobicContact CD2-CD1 4.43Å; L604-L608 VanDerWaalsContact O-CB 3.27Å; L604-L608 WeakPolarHBondContact O-CB 3.48Å; L604-L608 VanDerWaalsContact O-CG 3.32Å; L604-L608 WeakPolarHBondContact O-CG 3.3Å; L604-L608 PolarHBondContact O-N 3.04Å
605	V	93.8	Very high	92.8	Very high	42 Å²	42	40.7 Å²	40.7	26%	0.255	20%	0.196	S	C	.	.	H	α-helix	trans	-60.1	-42.1	177.6	168.6	0	0	0	0	110.3	Q601 I603 L607 E609 V610	Q601-V605 VanDerWaalsContact O-CG2 3.31Å; Q601-V605 WeakPolarHBondContact O-CG2 3.16Å; Q601-V605 PolarHBondContact O-N 2.84Å; I603-V605 PolarHBondContact O-N 3.33Å; V605-L607 VanDerWaalsContact C-N 3.33Å; V605-L607 PolarHBondContact O-N 3.22Å; V605-E609 WeakPolarHBondContact O-CB 3.45Å; V605-E609 PolarHBondContact O-N 3.31Å; V605-V610 HydrophobicContact CG1-CG2 4.07Å; V605-V610 PolarHBondContact O-N 3.15Å; V605-V610 VanDerWaalsContact O-N 3.16Å
606	E	93.5	Very high	92.2	Very high	10 Å²	10	40.7 Å²	40.7	5%	0.047	20%	0.195	C	C	.	.	I	π-helix	trans	-61.8	-39.9	177.5	-169.1	62.9	-139.5	0	0	112.1	V224 N602 I603 L604 R611 R612	V224-E606 VanDerWaalsContact O-CD 3.3Å; V224-E606 WeakPolarHBondContact O-CG 3.18Å; N602-E606 PolarHBondContact O-N 3.42Å; N602-E606 VanDerWaalsContact O-N 3.13Å; I603-E606 WeakPolarHBondContact O-CB 3.2Å; I603-E606 PolarHBondContact O-N 3.23Å; L604-E606 VanDerWaalsContact C-N 3.27Å; L604-E606 PolarHBondContact O-N 2.85Å; E606-R611 WeakPolarHBondContact O-CA 3.27Å; E606-R611 PolarHBondContact O-N 2.87Å; E606-R612 WeakPolarHBondContact OE1-CB 3.49Å; E606-R612 WeakPolarHBondContact OE1-CG 3.49Å; E606-R612 PolarHBondContact OE1-N 3.29Å; E606-R612 IonicContact OE1-NH1 2.68Å; E606-R612 IonicContact OE2-CZ 2.69Å; E606-R612 VanDerWaalsContact OE2-CZ 3.23Å; E606-R612 IonicContact OE2-NE 3.12Å; E606-R612 IonicContact OE2-NH1 3.62Å; E606-R612 PolarHBondContact OE2-NH1 3.02Å; E606-R612 IonicContact OE2-NH2 3.9Å
607	L	94.4	Very high	91	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.01	20%	0.2	C	C	.	.	I	π-helix	trans	-83.4	-36.4	-177.5	-67.9	168	0	0	0	114.1	M32 L132 F136 A214 I603 L604 V605 R611	M32-L607 HydrophobicContact CE-CB 4.45Å; M32-L607 WeakPolarHBondContact CE-O 3.46Å; L132-L607 HydrophobicContact CD2-CD1 3.73Å; F136-L607 HydrophobicContact CD1-CD1 4Å; F136-L607 HydrophobicContact CD1-CD2 4.09Å; F136-L607 HydrophobicContact CD2-CD1 4.01Å; F136-L607 HydrophobicContact CE1-CD1 3.86Å; F136-L607 HydrophobicContact CE1-CD2 3.71Å; F136-L607 HydrophobicContact CE1-CG 4.28Å; F136-L607 HydrophobicContact CE2-CD1 3.86Å; F136-L607 HydrophobicContact CG-CD1 4.08Å; F136-L607 HydrophobicContact CZ-CB 4.38Å; F136-L607 HydrophobicContact CZ-CD1 3.79Å; F136-L607 HydrophobicContact CZ-CD2 4.25Å; F136-L607 HydrophobicContact CZ-CG 4.37Å; A214-L607 HydrophobicContact CB-CD1 4.22Å; A214-L607 HydrophobicContact CB-CD2 3.94Å; I603-L607 HydrophobicContact CG2-CD1 3.81Å; I603-L607 WeakPolarHBondContact O-CG 3.33Å; I603-L607 PolarHBondContact O-N 2.98Å; L604-L607 PolarHBondContact O-N 3.01Å; V605-L607 VanDerWaalsContact C-N 3.33Å; V605-L607 PolarHBondContact O-N 3.22Å; L607-R611 WeakPolarHBondContact O-CG 3.29Å; L607-R611 PolarHBondContact O-NE 2.99Å
608	L	94	Very high	89.4	Confident	9 Å²	9	45.4 Å²	45.4	5%	0.047	22%	0.217	C	C	.	.	I	π-helix	trans	-85	-35	-176.3	-64.3	171.9	0	0	0	112.4	M32 I35 I36 L604	M32-L608 HydrophobicContact CB-CD2 3.83Å; M32-L608 HydrophobicContact CE-CD2 3.76Å; M32-L608 HydrophobicContact CG-CD2 3.87Å; I35-L608 HydrophobicContact CG2-CD1 3.72Å; I35-L608 HydrophobicContact CG2-CD2 4.5Å; I36-L608 HydrophobicContact CD1-CB 4.44Å; I36-L608 HydrophobicContact CD1-CD2 4.46Å; I36-L608 HydrophobicContact CG1-CB 4.26Å; I36-L608 HydrophobicContact CG1-CD2 4.31Å; L604-L608 HydrophobicContact CB-CD1 4.31Å; L604-L608 HydrophobicContact CD2-CD1 4.43Å; L604-L608 VanDerWaalsContact O-CB 3.27Å; L604-L608 WeakPolarHBondContact O-CB 3.48Å; L604-L608 VanDerWaalsContact O-CG 3.32Å; L604-L608 WeakPolarHBondContact O-CG 3.3Å; L604-L608 PolarHBondContact O-N 3.04Å
609	E	91.1	Very high	87.1	Confident	123 Å²	123	49 Å²	49	58%	0.575	24%	0.239	S	C	*	.	I	π-helix	trans	-118.1	-46	-167.1	-59.3	169.5	-153.1	0	0	113.2	R39 V605	R39-E609 IonicContact NH1-OE1 2.62Å; V605-E609 WeakPolarHBondContact O-CB 3.45Å; V605-E609 PolarHBondContact O-N 3.31Å
610	V	90.1	Very high	84.3	Confident	63 Å²	63	54.5 Å²	54.5	38%	0.382	27%	0.266	S	S	.	.	I	π-helix	trans	-91.9	-49.3	-168.5	-168.3	0	0	0	0	113.2	V605 R612	V605-V610 HydrophobicContact CG1-CG2 4.07Å; V605-V610 PolarHBondContact O-N 3.15Å; V605-V610 VanDerWaalsContact O-N 3.16Å; V610-R612 HydrophobicContact CG1-CG 3.6Å; V610-R612 PolarHBondContact O-N 3.45Å
611	R	90.2	Very high	81.3	Confident	93 Å²	93	66.3 Å²	66.3	35%	0.351	32%	0.321	S	S	.	.			trans	47.9	53.8	-178.6	-58.4	-178	-174.2	170	7.6	113.3	E606 L607	E606-R611 WeakPolarHBondContact O-CA 3.27Å; E606-R611 PolarHBondContact O-N 2.87Å; L607-R611 WeakPolarHBondContact O-CG 3.29Å; L607-R611 PolarHBondContact O-NE 2.99Å
612	R	90.2	Very high	80.7	Confident	131 Å²	131	65.8 Å²	65.8	49%	0.494	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-63.5	139.4	177.6	-67.7	-177.1	-162.4	110.5	13.9	111.2	V224 E606 V610	V224-R612 HydrophobicContact CB-CB 4.22Å; V224-R612 HydrophobicContact CG2-CB 4.36Å; V224-R612 PolarHBondContact N-O 3.32Å; E606-R612 WeakPolarHBondContact OE1-CB 3.49Å; E606-R612 WeakPolarHBondContact OE1-CG 3.49Å; E606-R612 PolarHBondContact OE1-N 3.29Å; E606-R612 IonicContact OE1-NH1 2.68Å; E606-R612 IonicContact OE2-CZ 2.69Å; E606-R612 VanDerWaalsContact OE2-CZ 3.23Å; E606-R612 IonicContact OE2-NE 3.12Å; E606-R612 IonicContact OE2-NH1 3.62Å; E606-R612 PolarHBondContact OE2-NH1 3.02Å; E606-R612 IonicContact OE2-NH2 3.9Å; V610-R612 HydrophobicContact CG1-CG 3.6Å; V610-R612 PolarHBondContact O-N 3.45Å
613	E	89.2	Confident	80	Confident	149 Å²	149	66.7 Å²	66.7	70%	0.696	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-70.8	141.5	171.5	-65.3	-174.4	167.5	0	0	111	V224	V224-E613 WeakPolarHBondContact CG2-O 3.01Å
614	P	87.5	Confident	79.2	Confident	17 Å²	17	70.4 Å²	70.4	11%	0.11	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-63.7	140.5	175	26.2	-34.1	0	0	0	112.3	T213 V224 N617	T213-P614 HydrophobicContact CG2-CB 4.32Å; V224-P614 VanDerWaalsContact CG2-CA 3.5Å; V224-P614 HydrophobicContact CG2-CB 4.25Å; P614-N617 HydrophobicContact CB-CB 3.84Å; P614-N617 WeakPolarHBondContact CB-O 3.37Å; P614-N617 HydrophobicContact CG-CB 4.36Å; P614-N617 WeakPolarHBondContact CG-O 3.21Å
615	I	84.5	Confident	78.2	Confident	42 Å²	42	74.5 Å²	74.5	22%	0.215	36%	0.36	C	S	.	.	S	Bend	trans	-98.6	-32.1	179.5	-55.7	-176.8	0	0	0	110.7	E211 L227 I405 A409 F618	E211-I615 PolarHBondContact OE2-N 2.99Å; L227-I615 HydrophobicContact CD2-CD1 3.62Å; L227-I615 HydrophobicContact CD2-CG1 4.47Å; I405-I615 HydrophobicContact CG2-CG2 3.86Å; A409-I615 HydrophobicContact CB-CD1 4.04Å; I615-F618 WeakPolarHBondContact O-CE2 3.04Å; I615-F618 WeakPolarHBondContact O-CZ 3.43Å
616	L	82.1	Confident	77.3	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	37%	0.367	C	S	.	.	S	Bend	trans	-97.9	-34.5	179	-55.2	-176.7	0	0	0	111.9	T141 A143 K158 N209 E211 I405 F618	T141-L616 HydrophobicContact CG2-CB 3.67Å; T141-L616 HydrophobicContact CG2-CD1 4.44Å; A143-L616 HydrophobicContact CB-CD1 3.93Å; A143-L616 HydrophobicContact CB-CD2 3.89Å; A143-L616 HydrophobicContact CB-CG 4.44Å; K158-L616 WeakPolarHBondContact CD-O 3.34Å; K158-L616 PolarHBondContact NZ-O 3.19Å; N209-L616 HydrophobicContact CB-CD1 3.79Å; N209-L616 HydrophobicContact CB-CD2 4.44Å; E211-L616 HydrophobicContact CB-CB 4.39Å; E211-L616 HydrophobicContact CB-CD1 3.76Å; E211-L616 HydrophobicContact CB-CG 4.18Å; E211-L616 PolarHBondContact OE2-N 3.06Å; I405-L616 HydrophobicContact CD1-CD2 3.61Å; L616-F618 PolarHBondContact O-N 3.48Å
617	N	71.7	Confident	76.2	Confident	17 Å²	17	80.9 Å²	80.9	9%	0.091	39%	0.388	C	S	.	.			trans	-90.9	76.2	173.3	-75.7	-38	0	0	0	112.3	T141 S160 E211 Y215 P614 T619	T141-N617 WeakPolarHBondContact CB-ND2 3.22Å; T141-N617 WeakPolarHBondContact CG2-OD1 3.29Å; T141-N617 PolarHBondContact OG1-ND2 3.41Å; T141-N617 PolarHBondContact OG1-OD1 3.2Å; S160-N617 PolarHBondContact OG-OD1 3.27Å; E211-N617 PolarHBondContact OE1-N 2.97Å; E211-N617 PolarHBondContact OE1-ND2 3.03Å; Y215-N617 VanDerWaalsContact OH-CB 3.23Å; Y215-N617 WeakPolarHBondContact OH-CB 3.4Å; Y215-N617 PolarHBondContact OH-ND2 3.47Å; P614-N617 HydrophobicContact CB-CB 3.84Å; P614-N617 WeakPolarHBondContact CB-O 3.37Å; P614-N617 HydrophobicContact CG-CB 4.36Å; P614-N617 WeakPolarHBondContact CG-O 3.21Å; N617-T619 PolarHBondContact O-N 3.31Å; N617-T619 VanDerWaalsContact O-N 3.13Å
618	F	62.9	Low	74.9	Confident	87 Å²	87	86.6 Å²	86.6	38%	0.382	42%	0.415	S	S	.	.			trans	-69	110.2	159.7	-51.2	-72	0	0	0	108.1	I615 L616 N620	I615-F618 WeakPolarHBondContact O-CE2 3.04Å; I615-F618 WeakPolarHBondContact O-CZ 3.43Å; L616-F618 PolarHBondContact O-N 3.48Å; F618-N620 PolarHBondContact O-N 3.04Å
619	T	46.7	Very low	73.4	Confident	80 Å²	80	92.5 Å²	92.5	49%	0.491	44%	0.443	S	S	.	.			trans	-63.6	115.4	150.7	41.1	0	0	0	0	104.8	N617 Q621	N617-T619 PolarHBondContact O-N 3.31Å; N617-T619 VanDerWaalsContact O-N 3.13Å; T619-Q621 VanDerWaalsContact C-N 3.31Å; T619-Q621 PolarHBondContact O-N 2.69Å
620	N	37	Very low	71.9	Confident	151 Å²	151	90 Å²	90	81%	0.807	43%	0.432	S	S	*	.			trans	-56.4	106	166.3	-75.7	-18.7	0	0	0	105.6	F618	F618-N620 PolarHBondContact O-N 3.04Å
621	Q	31.1	Very low	70.3	Confident	250 Å²	250	92.5 Å²	92.5	100%	1.168	44%	0.437	S	S	*	.			trans	-65.8	0	168.6	-73.9	-173.9	-4.9	0	0	109.5	T619	T619-Q621 VanDerWaalsContact C-N 3.31Å; T619-Q621 PolarHBondContact O-N 2.69Å

Retrieved 621 of 621 residues in 234.2 ms (Link to these results)

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