G4VN60_SCHMA Loading...

Putative nadh-ubiquinone oxidoreductase 42 kD subunit

AlphaFold DB , UniProt , Accession G4VN60, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 418 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	32.6	Very low	28.6	Very low	248 Å²	248	156.3 Å²	156.3	100%	1.222	84%	0.844	S	S	*	*				0	112	0	-74.4	178.3	-164.7	0	0	107.7
2	T	26.3	Very low	28.5	Very low	136 Å²	136	155.5 Å²	155.5	83%	0.834	84%	0.839	S	S	*	*			trans	-97.2	115.2	-164.3	40.6	0	0	0	0	110.7
3	C	31.2	Very low	28.3	Very low	129 Å²	129	152.9 Å²	152.9	87%	0.872	84%	0.84	S	S	*	*			trans	-94.3	98.7	162.5	-81.5	0	0	0	0	109.2
4	R	25.5	Very low	28.3	Very low	234 Å²	234	155.1 Å²	155.1	88%	0.883	84%	0.837	S	S	*	*			trans	-68.1	124.2	158.4	-87	177.8	168.3	171.7	-3.9	108.2
5	V	33.7	Very low	28.5	Very low	146 Å²	146	152.9 Å²	152.9	89%	0.885	83%	0.83	S	S	*	*			trans	-120.4	79.9	157.1	-173.6	0	0	0	0	107.3
6	S	28	Very low	28.6	Very low	101 Å²	101	151.8 Å²	151.8	71%	0.706	82%	0.823	S	S	*	*			trans	-90.5	125.3	165.5	50.7	0	0	0	0	109.1
7	G	26.2	Very low	28.8	Very low	68 Å²	68	155.6 Å²	155.6	70%	0.701	83%	0.83	S	S	*	*			trans	84.1	102.3	154.2	0	0	0	0	0	115.7
8	L	27	Very low	28.9	Very low	162 Å²	162	149.9 Å²	149.9	85%	0.848	81%	0.814	S	S	*	*			trans	-176.3	122.2	136.9	-98.5	150.4	0	0	0	109.2
9	L	29.2	Very low	29.1	Very low	125 Å²	125	143.4 Å²	143.4	65%	0.654	78%	0.78	S	S	*	*			trans	91	65.7	157.3	-51.5	164.8	0	0	0	118.2	K11	L9-K11 HydrophobicContact CD2-CB 3.98Å; L9-K11 HydrophobicContact CD2-CD 3.89Å; L9-K11 HydrophobicContact CD2-CG 4.41Å; L9-K11 PolarHBondContact O-N 3.5Å
10	Q	27.8	Very low	30.1	Very low	207 Å²	207	141.2 Å²	141.2	97%	0.967	76%	0.761	S	S	*	*				-64.1	92.8	124.1	-97	179.7	-16.3	0	0	107.4
11	K	27	Very low	31	Very low	163 Å²	163	140.2 Å²	140.2	71%	0.709	75%	0.747	S	S	*	*			trans	-151.3	117.5	167.1	-110.8	177.7	-177.6	178.6	0	109.4	L9	L9-K11 HydrophobicContact CD2-CB 3.98Å; L9-K11 HydrophobicContact CD2-CD 3.89Å; L9-K11 HydrophobicContact CD2-CG 4.41Å; L9-K11 PolarHBondContact O-N 3.5Å
12	N	27.4	Very low	32.3	Very low	147 Å²	147	128.9 Å²	128.9	79%	0.786	69%	0.694	S	S	*	*			trans	74.6	87.8	171.8	-60.6	-17.3	0	0	0	117.2	K14	N12-K14 PolarHBondContact O-N 3.27Å
13	S	26.3	Very low	34.5	Very low	122 Å²	122	125.2 Å²	125.2	85%	0.853	67%	0.671	S	S	*	*			trans	-64	49	156.1	49.7	0	0	0	0	113.1	V15	S13-V15 PolarHBondContact O-N 2.92Å
14	K	28.1	Very low	37.1	Very low	183 Å²	183	119.2 Å²	119.2	80%	0.796	63%	0.63	S	S	*	*			trans	-82.5	83.7	156.7	-83.1	-173.1	177.5	179.2	0	106.7	N12 L16	N12-K14 PolarHBondContact O-N 3.27Å; K14-L16 PolarHBondContact O-N 3.44Å
15	V	31.3	Very low	40	Very low	122 Å²	122	113 Å²	113	74%	0.739	61%	0.61	S	S	*	*			trans	-48.8	111.2	158.7	179.2	0	0	0	0	105.5	S13 K17	S13-V15 PolarHBondContact O-N 2.92Å; V15-K17 PolarHBondContact O-N 3.49Å
16	L	30	Very low	42.5	Very low	135 Å²	135	106.3 Å²	106.3	71%	0.707	57%	0.569	S	S	*	*			trans	-59.4	106.1	-178.1	-80	158.8	0	0	0	107.3	K14 G18	K14-L16 PolarHBondContact O-N 3.44Å; L16-G18 PolarHBondContact O-N 2.95Å; L16-G18 VanDerWaalsContact O-N 3.08Å
17	K	31.4	Very low	45.2	Very low	218 Å²	218	103.3 Å²	103.3	95%	0.948	55%	0.551	S	S	*	*	S	Bend	trans	-54.3	112.4	169.6	-78.4	-177.4	172.4	-176.5	0	107.7	V15	V15-K17 PolarHBondContact O-N 3.49Å
18	G	31.5	Very low	48	Very low	52 Å²	52	105.2 Å²	105.2	54%	0.536	55%	0.548	S	S	.	.			trans	110.6	61.7	175.3	0	0	0	0	0	114.1	L16	L16-G18 PolarHBondContact O-N 2.95Å; L16-G18 VanDerWaalsContact O-N 3.08Å
19	C	32.4	Very low	50.5	Low	26 Å²	26	103.1 Å²	103.1	18%	0.176	54%	0.538	C	S	.	.			trans	-144.5	125.4	152.8	-86.3	0	0	0	0	106.3	Y21 M60	C19-Y21 HydrophobicContact CB-CE2 4.09Å; C19-Y21 WeakPolarHBondContact O-CD2 3.41Å; C19-Y21 WeakPolarHBondContact O-CE2 3.23Å; C19-Y21 PolarHBondContact O-N 3.4Å; C19-M60 WeakPolarHBondContact SG-CE 3.33Å
20	Y	48.2	Very low	52.4	Low	100 Å²	100	99 Å²	99	39%	0.392	53%	0.526	S	S	.	.			trans	-78.8	100.8	-167.2	-66.5	-96.6	0	0	0	109.3	F63 N64 D65	Y20-F63 WeakPolarHBondContact CD2-O 3.26Å; Y20-F63 WeakPolarHBondContact CE2-O 3.4Å; Y20-N64 HydrophobicContact CD1-CB 4.38Å; Y20-N64 HydrophobicContact CE1-CB 4.39Å; Y20-D65 WeakPolarHBondContact CB-OD1 3.35Å; Y20-D65 WeakPolarHBondContact CD1-OD1 3.24Å
21	Y	50.9	Low	54.3	Low	121 Å²	121	100.7 Å²	100.7	48%	0.475	53%	0.525	S	S	.	.			trans	-96.8	81	167.3	-53.5	-83.1	0	0	0	106.4	C19 D306 E308	C19-Y21 HydrophobicContact CB-CE2 4.09Å; C19-Y21 WeakPolarHBondContact O-CD2 3.41Å; C19-Y21 WeakPolarHBondContact O-CE2 3.23Å; C19-Y21 PolarHBondContact O-N 3.4Å; Y21-D306 WeakPolarHBondContact CA-OD1 3.46Å; Y21-D306 HydrophobicContact CD1-CB 4.24Å; Y21-E308 WeakPolarHBondContact CB-OE1 3.21Å; Y21-E308 HydrophobicContact CD1-CG 3.63Å; Y21-E308 HydrophobicContact CE1-CG 4.33Å; Y21-E308 HydrophobicContact CG-CG 4.02Å
22	G	58.6	Low	56.6	Low	10 Å²	10	94.6 Å²	94.6	10%	0.103	50%	0.5	C	S	.	.			trans	-134.9	140	175.7	0	0	0	0	0	110.6	D306	G22-D306 WeakPolarHBondContact CA-OD2 3.5Å; G22-D306 PolarHBondContact N-OD1 3.12Å; G22-D306 PolarHBondContact N-OD2 3.31Å
23	T	73.5	Confident	58.8	Low	59 Å²	59	96.2 Å²	96.2	36%	0.362	50%	0.5	S	S	.	.			trans	-57.5	159.5	162.8	54.1	0	0	0	0	110.7	K25 T301 D306	T23-K25 PolarHBondContact O-N 3.13Å; T23-T301 VanDerWaalsContact CB-O 3.25Å; T23-T301 WeakPolarHBondContact CB-O 3.37Å; T23-D306 PolarHBondContact N-OD2 3.35Å
24	L	85.1	Confident	61.1	Low	2 Å²	2	95.4 Å²	95.4	1%	0.01	48%	0.478	C	S	.	.			trans	-55.8	139.7	174.5	-69	173.7	0	0	0	109.9	K68 I70 F91 M93 L222 A300 T301 L305	L24-K68 HydrophobicContact CD2-CB 4.08Å; L24-K68 HydrophobicContact CD2-CG 3.62Å; L24-I70 HydrophobicContact CD1-CD1 3.94Å; L24-F91 HydrophobicContact CB-CD1 4.29Å; L24-F91 HydrophobicContact CB-CE1 3.88Å; L24-F91 HydrophobicContact CB-CZ 4.35Å; L24-F91 HydrophobicContact CD1-CE1 4.23Å; L24-F91 HydrophobicContact CD1-CE2 4.13Å; L24-F91 HydrophobicContact CD1-CZ 3.9Å; L24-M93 HydrophobicContact CD2-CE 3.48Å; L24-M93 VanDerWaalsContact CD2-CE 3.48Å; L24-L222 HydrophobicContact CD1-CD2 4.38Å; L24-A300 HydrophobicContact CD1-CB 4.34Å; L24-T301 HydrophobicContact CB-CG2 4.07Å; L24-T301 WeakPolarHBondContact O-CB 3.45Å; L24-T301 WeakPolarHBondContact O-CG2 3.35Å; L24-L305 HydrophobicContact CD1-CD1 3.79Å; L24-L305 HydrophobicContact CD2-CD1 4.32Å; L24-L305 HydrophobicContact CG-CD1 3.79Å
25	K	86.1	Confident	63.3	Low	105 Å²	105	87.9 Å²	87.9	46%	0.457	45%	0.45	S	S	.	.			trans	-110.6	131	174.8	-71.1	177.5	174.5	166	0	109.6	T23 D65 N66	T23-K25 PolarHBondContact O-N 3.13Å; K25-D65 HydrophobicContact CD-CB 4.49Å; K25-D65 WeakPolarHBondContact CE-OD2 3.07Å; K25-D65 IonicContact NZ-OD2 3.97Å; K25-D65 PolarHBondContact NZ-OD2 3.01Å; K25-N66 PolarHBondContact N-OD1 3.03Å; K25-N66 PolarHBondContact O-ND2 3.07Å; K25-N66 PolarHBondContact O-OD1 2.79Å
26	L	87.4	Confident	65.3	Low	4 Å²	4	89.5 Å²	89.5	2%	0.021	45%	0.447	C	S	.	.			trans	-65.7	142.2	169.7	-65.1	168	0	0	0	108.9	V28 D29 H90 F91 Y294 A297 Q298 T301	L26-V28 PolarHBondContact O-N 3.38Å; L26-D29 PolarHBondContact O-N 2.79Å; L26-D29 VanDerWaalsContact O-N 3.15Å; L26-H90 HydrophobicContact CD2-CB 4.24Å; L26-F91 HydrophobicContact CD2-CD1 4.24Å; L26-F91 HydrophobicContact CD2-CE1 3.78Å; L26-F91 HydrophobicContact CD2-CZ 4.5Å; L26-Y294 HydrophobicContact CD1-CE2 3.91Å; L26-A297 HydrophobicContact CD2-CB 3.74Å; L26-Q298 HydrophobicContact CD1-CG 3.95Å; L26-T301 HydrophobicContact CD2-CG2 4.24Å; L26-T301 HydrophobicContact CG-CG2 3.91Å
27	A	84.1	Confident	67.4	Low	39 Å²	39	88.8 Å²	88.8	32%	0.322	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-23.5	174.6	0	0	0	0	0	112.1	H90 D92	A27-H90 VanDerWaalsContact CB-O 3.29Å; A27-H90 WeakPolarHBondContact CB-O 3.26Å; A27-H90 PolarHBondContact N-O 3.43Å; A27-D92 HydrophobicContact CB-CB 3.98Å
28	V	85	Confident	69.5	Low	108 Å²	108	79.6 Å²	79.6	66%	0.655	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-33.8	177.3	-175.8	0	0	0	0	112	L26 G30	L26-V28 PolarHBondContact O-N 3.38Å; V28-G30 VanDerWaalsContact C-N 3.28Å; V28-G30 PolarHBondContact O-N 3.03Å
29	D	79	Confident	71.5	Confident	118 Å²	118	84.2 Å²	84.2	63%	0.631	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-14.6	-174.2	-65	-25.7	0	0	0	113.1	L26	L26-D29 PolarHBondContact O-N 2.79Å; L26-D29 VanDerWaalsContact O-N 3.15Å
30	G	70.1	Confident	73.7	Confident	39 Å²	39	84.9 Å²	84.9	40%	0.402	42%	0.418	S	S	.	.	S	Bend	trans	163	173.8	172.3	0	0	0	0	0	115.3	V28 I32	V28-G30 VanDerWaalsContact C-N 3.28Å; V28-G30 PolarHBondContact O-N 3.03Å; G30-I32 PolarHBondContact O-N 3.14Å
31	Y	67.3	Low	75.4	Confident	242 Å²	242	83.3 Å²	83.3	95%	0.949	42%	0.416	S	S	*	.			trans	-69.4	111.9	178.2	-69	-83.2	0	0	0	111.5	K33	Y31-K33 PolarHBondContact O-N 3.34Å
32	I	75	Confident	76.9	Confident	35 Å²	35	78 Å²	78	18%	0.179	40%	0.395	C	S	.	.			trans	-70.8	110.3	170.8	-60.6	154.1	0	0	0	108.3	G30 R34 N64 N66 D92	G30-I32 PolarHBondContact O-N 3.14Å; I32-R34 PolarHBondContact O-N 3.49Å; I32-N64 VanDerWaalsContact CG2-ND2 3.33Å; I32-N64 WeakPolarHBondContact CG2-ND2 3.45Å; I32-N66 WeakPolarHBondContact CD1-ND2 3.34Å; I32-D92 HydrophobicContact CD1-CB 4.23Å
33	K	73.5	Confident	78.2	Confident	181 Å²	181	80.1 Å²	80.1	79%	0.787	40%	0.402	S	S	*	.			trans	-65.7	111.1	177.2	-171.7	178.9	-178.9	-179	0	109.6	Y31 N64	Y31-K33 PolarHBondContact O-N 3.34Å; K33-N64 PolarHBondContact O-ND2 2.99Å
34	R	74.5	Confident	78.8	Confident	104 Å²	104	78.6 Å²	78.6	39%	0.392	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-92.4	145.2	173.1	-67.7	-179.3	175	175.3	-4.7	110.6	I32 D92	I32-R34 PolarHBondContact O-N 3.49Å; R34-D92 IonicContact CZ-OD1 3.76Å; R34-D92 IonicContact CZ-OD2 2.96Å; R34-D92 IonicContact NE-OD2 2.64Å; R34-D92 IonicContact NH1-OD1 2.83Å; R34-D92 IonicContact NH1-OD2 2.76Å; R34-D92 PolarHBondContact NH2-O 3.12Å; R34-D92 IonicContact NH2-OD1 3.78Å; R34-D92 PolarHBondContact NH2-OD1 3.24Å; R34-D92 IonicContact NH2-OD2 2.72Å; R34-D92 PolarHBondContact NH2-OD2 3.43Å
35	A	74.1	Confident	78.6	Confident	26 Å²	26	82.7 Å²	82.7	22%	0.215	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-65.2	158.7	164.4	0	0	0	0	0	110.3	L37 R62	A35-L37 PolarHBondContact O-N 3.15Å; A35-R62 HydrophobicContact CB-CB 4.15Å; A35-R62 HydrophobicContact CB-CG 4.05Å
36	K	73.3	Confident	78.6	Confident	156 Å²	156	77.8 Å²	77.8	68%	0.678	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-59.3	128.1	172.9	-171.7	178.2	177.9	175.3	0	108.5
37	L	74.9	Confident	78.4	Confident	120 Å²	120	77.6 Å²	77.6	63%	0.628	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-52.8	139.2	172.5	-74.4	168.1	0	0	0	109.1	A35 T172	A35-L37 PolarHBondContact O-N 3.15Å; L37-T172 HydrophobicContact CD2-CG2 3.93Å
38	P	74.4	Confident	78.2	Confident	24 Å²	24	81 Å²	81	16%	0.156	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-70.9	142.6	-178.7	34.9	-38.8	0	0	0	109.3	Y40 Y42	P38-Y40 PolarHBondContact O-N 3.22Å; P38-Y42 HydrophobicContact CB-CD2 4.44Å; P38-Y42 HydrophobicContact CB-CE2 3.42Å; P38-Y42 VanDerWaalsContact CB-CE2 3.42Å; P38-Y42 HydrophobicContact CG-CD2 3.91Å; P38-Y42 HydrophobicContact CG-CE2 3.33Å
39	N	73.8	Confident	77.8	Confident	150 Å²	150	82.7 Å²	82.7	80%	0.802	40%	0.396	S	S	*	.	S	Bend	trans	-72	6.3	-176.3	-68.4	-3.3	0	0	0	113.9
40	Y	78.5	Confident	77.8	Confident	39 Å²	39	82.9 Å²	82.9	15%	0.153	40%	0.396	C	S	.	.	S	Bend	trans	-123.4	141.2	-173.9	175.3	-130.5	0	0	0	111.2	P38 Y42 Y45 G46 R51	P38-Y40 PolarHBondContact O-N 3.22Å; Y40-Y42 AromaticContact CD1-CD1 3.85Å; Y40-Y42 HydrophobicContact CD1-CD1 3.85Å; Y40-Y42 HydrophobicContact CD1-CD2 4.14Å; Y40-Y42 AromaticContact CD1-CE1 3.72Å; Y40-Y42 HydrophobicContact CD1-CE1 3.72Å; Y40-Y42 AromaticContact CD1-CE2 3.96Å; Y40-Y42 HydrophobicContact CD1-CE2 3.96Å; Y40-Y42 HydrophobicContact CD1-CG 4.04Å; Y40-Y42 AromaticContact CD1-CZ 3.76Å; Y40-Y42 HydrophobicContact CE1-CD1 4.27Å; Y40-Y42 HydrophobicContact CE1-CE1 4.39Å; Y40-Y42 HydrophobicContact CG-CE2 4.34Å; Y40-Y42 WeakPolarHBondContact O-CD2 3.35Å; Y40-Y42 WeakPolarHBondContact O-CE2 3.38Å; Y40-Y42 PolarHBondContact O-N 2.96Å; Y40-Y45 AromaticContact CE2-CD2 3.71Å; Y40-Y45 HydrophobicContact CE2-CD2 3.71Å; Y40-Y45 HydrophobicContact CE2-CG 4.12Å; Y40-Y45 WeakPolarHBondContact OH-CB 3.48Å; Y40-G46 WeakPolarHBondContact CE1-O 3.39Å; Y40-G46 PolarHBondContact OH-O 3.18Å; Y40-R51 VanDerWaalsContact CD1-CZ 3.45Å; Y40-R51 VanDerWaalsContact CE2-NH2 3.3Å; Y40-R51 PolarHBondContact OH-NH1 3.49Å
41	D	84.3	Confident	78.3	Confident	67 Å²	67	86 Å²	86	36%	0.358	40%	0.396	S	S	.	.			trans	-82.3	89	173.6	-174.3	1.8	0	0	0	111.4	F43 S44 Y45	D41-F43 PolarHBondContact O-N 3.09Å; D41-F43 WeakPolarHBondContact OD1-CB 3.4Å; D41-F43 PolarHBondContact OD1-N 2.89Å; D41-S44 PolarHBondContact OD1-N 3.41Å; D41-S44 VanDerWaalsContact OD1-N 3.09Å; D41-S44 WeakPolarHBondContact OD2-CB 3.49Å; D41-S44 PolarHBondContact OD2-OG 3.22Å; D41-Y45 HydrophobicContact CB-CD2 4.2Å; D41-Y45 HydrophobicContact CB-CE2 4.4Å; D41-Y45 WeakPolarHBondContact O-CD2 3.49Å; D41-Y45 PolarHBondContact O-N 2.85Å
42	Y	83.5	Confident	78.7	Confident	11 Å²	11	75.4 Å²	75.4	4%	0.043	36%	0.357	C	S	.	.	H	α-helix	trans	-66	-27.5	173.9	-58.6	-95	0	0	0	112	P38 Y40 G46 T47 D55 N171 R334 N406	P38-Y42 HydrophobicContact CB-CD2 4.44Å; P38-Y42 HydrophobicContact CB-CE2 3.42Å; P38-Y42 VanDerWaalsContact CB-CE2 3.42Å; P38-Y42 HydrophobicContact CG-CD2 3.91Å; P38-Y42 HydrophobicContact CG-CE2 3.33Å; Y40-Y42 AromaticContact CD1-CD1 3.85Å; Y40-Y42 HydrophobicContact CD1-CD1 3.85Å; Y40-Y42 HydrophobicContact CD1-CD2 4.14Å; Y40-Y42 AromaticContact CD1-CE1 3.72Å; Y40-Y42 HydrophobicContact CD1-CE1 3.72Å; Y40-Y42 AromaticContact CD1-CE2 3.96Å; Y40-Y42 HydrophobicContact CD1-CE2 3.96Å; Y40-Y42 HydrophobicContact CD1-CG 4.04Å; Y40-Y42 AromaticContact CD1-CZ 3.76Å; Y40-Y42 HydrophobicContact CE1-CD1 4.27Å; Y40-Y42 HydrophobicContact CE1-CE1 4.39Å; Y40-Y42 HydrophobicContact CG-CE2 4.34Å; Y40-Y42 WeakPolarHBondContact O-CD2 3.35Å; Y40-Y42 WeakPolarHBondContact O-CE2 3.38Å; Y40-Y42 PolarHBondContact O-N 2.96Å; Y42-G46 WeakPolarHBondContact O-CA 3.34Å; Y42-G46 PolarHBondContact O-N 3.38Å; Y42-T47 HydrophobicContact CD1-CG2 4.14Å; Y42-T47 HydrophobicContact CE1-CG2 4.44Å; Y42-D55 PolarHBondContact OH-OD2 3.27Å; Y42-N171 WeakPolarHBondContact CD1-OD1 3.5Å; Y42-N171 HydrophobicContact CD2-CB 4.09Å; Y42-N171 HydrophobicContact CG-CB 4.24Å; Y42-R334 PolarHBondContact OH-NH2 3.33Å; Y42-R334 VanDerWaalsContact OH-NH2 3.08Å; Y42-N406 PolarHBondContact O-ND2 3.21Å
43	F	85.4	Confident	78.7	Confident	54 Å²	54	78.9 Å²	78.9	24%	0.237	38%	0.376	C	S	.	.	H	α-helix	trans	-68	-44.7	-178.4	-76.7	-77	0	0	0	111	D41 R164 C167 H168 N406 F407	D41-F43 PolarHBondContact O-N 3.09Å; D41-F43 WeakPolarHBondContact OD1-CB 3.4Å; D41-F43 PolarHBondContact OD1-N 2.89Å; F43-R164 HydrophobicContact CD1-CG 4.17Å; F43-R164 HydrophobicContact CE1-CG 3.71Å; F43-C167 HydrophobicContact CE1-CB 4.42Å; F43-H168 AromaticContact CE2-ND1 3.85Å; F43-H168 HydrophobicContact CZ-CB 3.72Å; F43-H168 AromaticContact CZ-ND1 3.66Å; F43-N406 WeakPolarHBondContact O-CB 3.39Å; F43-N406 PolarHBondContact O-ND2 3.45Å; F43-N406 VanDerWaalsContact O-ND2 3.13Å; F43-F407 HydrophobicContact CD1-CB 4.24Å; F43-F407 AromaticContact CD1-CD2 3.8Å; F43-F407 HydrophobicContact CD1-CD2 3.8Å; F43-F407 HydrophobicContact CD1-CE2 4.47Å; F43-F407 HydrophobicContact CD1-CG 4.23Å; F43-F407 HydrophobicContact CE1-CD2 4.49Å; F43-F407 WeakPolarHBondContact O-CB 3.29Å; F43-F407 PolarHBondContact O-N 3.43Å
44	S	84.7	Confident	78.7	Confident	27 Å²	27	78.2 Å²	78.2	19%	0.189	37%	0.373	C	S	.	.	H	α-helix	trans	-81.7	-30.4	-176.1	-57.4	0	0	0	0	114.1	D41 S405 S408	D41-S44 PolarHBondContact OD1-N 3.41Å; D41-S44 VanDerWaalsContact OD1-N 3.09Å; D41-S44 WeakPolarHBondContact OD2-CB 3.49Å; D41-S44 PolarHBondContact OD2-OG 3.22Å; S44-S405 CarbonylContact O-C 3.59Å; S44-S405 VanDerWaalsContact O-C 3.25Å; S44-S405 PolarHBondContact O-OG 3.2Å; S44-S408 PolarHBondContact O-OG 2.85Å
45	Y	82.8	Confident	78.6	Confident	88 Å²	88	74.7 Å²	74.7	35%	0.345	36%	0.362	S	S	.	.	H	α-helix	trans	-120.4	-6.3	-169	-59.3	-66	0	0	0	115.1	Y40 D41 W401	Y40-Y45 AromaticContact CE2-CD2 3.71Å; Y40-Y45 HydrophobicContact CE2-CD2 3.71Å; Y40-Y45 HydrophobicContact CE2-CG 4.12Å; Y40-Y45 WeakPolarHBondContact OH-CB 3.48Å; D41-Y45 HydrophobicContact CB-CD2 4.2Å; D41-Y45 HydrophobicContact CB-CE2 4.4Å; D41-Y45 WeakPolarHBondContact O-CD2 3.49Å; D41-Y45 PolarHBondContact O-N 2.85Å; Y45-W401 HydrophobicContact CD1-CD2 4.48Å; Y45-W401 AromaticContact CD1-CE3 3.6Å; Y45-W401 HydrophobicContact CD1-CE3 3.6Å; Y45-W401 AromaticContact CD1-CZ3 3.99Å; Y45-W401 HydrophobicContact CD1-CZ3 3.99Å; Y45-W401 HydrophobicContact CE1-CB 3.94Å; Y45-W401 AromaticContact CE1-CD2 3.93Å; Y45-W401 HydrophobicContact CE1-CD2 3.93Å; Y45-W401 AromaticContact CE1-CE3 3.45Å; Y45-W401 HydrophobicContact CE1-CE3 3.45Å; Y45-W401 VanDerWaalsContact CE1-CE3 3.45Å; Y45-W401 HydrophobicContact CE1-CG 4.15Å; Y45-W401 HydrophobicContact CE1-CZ3 4.26Å
46	G	84.8	Confident	78	Confident	1 Å²	1	81.1 Å²	81.1	1%	0.01	39%	0.393	C	S	.	.			trans	65.9	-162.2	-171.2	0	0	0	0	0	111.8	Y40 Y42 S338 N339 N406	Y40-G46 WeakPolarHBondContact CE1-O 3.39Å; Y40-G46 PolarHBondContact OH-O 3.18Å; Y42-G46 WeakPolarHBondContact O-CA 3.34Å; Y42-G46 PolarHBondContact O-N 3.38Å; G46-S338 VanDerWaalsContact CA-O 3.29Å; G46-S338 WeakPolarHBondContact CA-O 3.21Å; G46-N339 WeakPolarHBondContact CA-OD1 3.33Å; G46-N406 WeakPolarHBondContact CA-ND2 3.41Å; G46-N406 PolarHBondContact N-ND2 3Å
47	T	82.7	Confident	77.8	Confident	1 Å²	1	75.5 Å²	75.5	1%	0.006	37%	0.371	C	S	.	.			trans	-150.2	142	174.8	-169.7	0	0	0	0	111.4	Y42 L335 N339	Y42-T47 HydrophobicContact CD1-CG2 4.14Å; Y42-T47 HydrophobicContact CE1-CG2 4.44Å; T47-L335 HydrophobicContact CG2-CD2 3.69Å; T47-N339 PolarHBondContact N-OD1 2.93Å; T47-N339 VanDerWaalsContact O-CG 3.31Å; T47-N339 PolarHBondContact O-ND2 3.25Å; T47-N339 PolarHBondContact O-OD1 3.49Å; T47-N339 VanDerWaalsContact O-OD1 3.05Å
48	N	81.5	Confident	77.7	Confident	110 Å²	110	79 Å²	79	59%	0.588	38%	0.376	S	S	*	.			trans	-108.7	162.2	178.5	-67.4	-15	0	0	0	110.4	L50 R51 S52	N48-L50 VanDerWaalsContact C-N 3.28Å; N48-L50 PolarHBondContact O-N 3.47Å; N48-R51 WeakPolarHBondContact O-CA 3.17Å; N48-R51 WeakPolarHBondContact O-CB 3.4Å; N48-R51 PolarHBondContact O-N 2.86Å; N48-S52 PolarHBondContact O-N 3.26Å
49	Y	76.4	Confident	77.9	Confident	144 Å²	144	77.9 Å²	77.9	57%	0.565	37%	0.369	S	S	*	.	H	α-helix	trans	-52.5	-46.1	-178.6	-174.5	-101.3	0	0	0	112.5	R51 S52 L53 L335	Y49-R51 VanDerWaalsContact C-N 3.29Å; Y49-R51 PolarHBondContact O-N 2.97Å; Y49-S52 WeakPolarHBondContact O-CB 3.35Å; Y49-S52 PolarHBondContact O-N 3.34Å; Y49-S52 VanDerWaalsContact O-N 3.14Å; Y49-L53 HydrophobicContact CD1-CD1 4.02Å; Y49-L53 HydrophobicContact CD1-CG 4.39Å; Y49-L53 HydrophobicContact CE1-CD1 3.64Å; Y49-L53 HydrophobicContact CE1-CD2 4.31Å; Y49-L53 HydrophobicContact CE1-CG 4.07Å; Y49-L53 PolarHBondContact O-N 2.9Å; Y49-L53 VanDerWaalsContact O-N 3.1Å; Y49-L335 HydrophobicContact CD2-CD1 3.9Å
50	L	78.9	Confident	78.1	Confident	122 Å²	122	72.2 Å²	72.2	64%	0.639	34%	0.338	S	S	*	.	H	α-helix	trans	-56	-43.5	176.2	-67.4	176.4	0	0	0	112	N48 L53 F54	N48-L50 VanDerWaalsContact C-N 3.28Å; N48-L50 PolarHBondContact O-N 3.47Å; L50-L53 WeakPolarHBondContact O-CB 3.45Å; L50-L53 PolarHBondContact O-N 3.47Å; L50-F54 WeakPolarHBondContact O-CD2 3.2Å; L50-F54 PolarHBondContact O-N 3.14Å
51	R	80.9	Confident	78.2	Confident	103 Å²	103	74.9 Å²	74.9	39%	0.389	36%	0.355	S	S	.	.	H	α-helix	trans	-69	-37.4	179.8	-168.5	170.7	-165.3	131.7	9.6	112.2	Y40 N48 Y49 L53 F54 D55	Y40-R51 VanDerWaalsContact CD1-CZ 3.45Å; Y40-R51 VanDerWaalsContact CE2-NH2 3.3Å; Y40-R51 PolarHBondContact OH-NH1 3.49Å; N48-R51 WeakPolarHBondContact O-CA 3.17Å; N48-R51 WeakPolarHBondContact O-CB 3.4Å; N48-R51 PolarHBondContact O-N 2.86Å; Y49-R51 VanDerWaalsContact C-N 3.29Å; Y49-R51 PolarHBondContact O-N 2.97Å; R51-L53 PolarHBondContact O-N 2.91Å; R51-F54 PolarHBondContact O-N 3.34Å; R51-D55 PolarHBondContact O-N 3.5Å; R51-D55 VanDerWaalsContact O-N 3.12Å
52	S	75.5	Confident	78.2	Confident	20 Å²	20	71.8 Å²	71.8	14%	0.14	34%	0.338	C	S	.	.	H	α-helix	trans	-65.2	-23.7	174.6	-173.3	0	0	0	0	113.2	N48 Y49	N48-S52 PolarHBondContact O-N 3.26Å; Y49-S52 WeakPolarHBondContact O-CB 3.35Å; Y49-S52 PolarHBondContact O-N 3.34Å; Y49-S52 VanDerWaalsContact O-N 3.14Å
53	L	75.1	Confident	78.3	Confident	109 Å²	109	71.9 Å²	71.9	57%	0.571	34%	0.339	S	S	*	.	H	α-helix	trans	-75.8	-32.5	173.3	-67.8	175	0	0	0	112.6	Y49 L50 R51 D55	Y49-L53 HydrophobicContact CD1-CD1 4.02Å; Y49-L53 HydrophobicContact CD1-CG 4.39Å; Y49-L53 HydrophobicContact CE1-CD1 3.64Å; Y49-L53 HydrophobicContact CE1-CD2 4.31Å; Y49-L53 HydrophobicContact CE1-CG 4.07Å; Y49-L53 PolarHBondContact O-N 2.9Å; Y49-L53 VanDerWaalsContact O-N 3.1Å; L50-L53 WeakPolarHBondContact O-CB 3.45Å; L50-L53 PolarHBondContact O-N 3.47Å; R51-L53 PolarHBondContact O-N 2.91Å; L53-D55 VanDerWaalsContact C-N 3.32Å
54	F	73.3	Confident	78.3	Confident	167 Å²	167	70 Å²	70	73%	0.732	33%	0.332	S	S	*	.	S	Bend	trans	-87.1	-0.7	176.3	-64.7	-66	0	0	0	113.7	L50 R51 N56	L50-F54 WeakPolarHBondContact O-CD2 3.2Å; L50-F54 PolarHBondContact O-N 3.14Å; R51-F54 PolarHBondContact O-N 3.34Å; F54-N56 PolarHBondContact O-N 3.33Å; F54-N56 PolarHBondContact O-OD1 3.03Å
55	D	72.4	Confident	78.3	Confident	30 Å²	30	70 Å²	70	16%	0.16	33%	0.33	C	S	.	.			trans	-77.3	114.8	175.9	-173.6	-1.6	0	0	0	109.8	Y42 R51 L53 T57 R62 R334	Y42-D55 PolarHBondContact OH-OD2 3.27Å; R51-D55 PolarHBondContact O-N 3.5Å; R51-D55 VanDerWaalsContact O-N 3.12Å; L53-D55 VanDerWaalsContact C-N 3.32Å; D55-T57 PolarHBondContact O-N 2.93Å; D55-T57 PolarHBondContact OD1-N 2.59Å; D55-T57 PolarHBondContact OD1-OG1 2.96Å; D55-R62 VanDerWaalsContact CG-NH2 3.26Å; D55-R62 IonicContact OD1-NH2 3.09Å; D55-R62 PolarHBondContact OD1-NH2 2.92Å; D55-R62 IonicContact OD2-CZ 2.75Å; D55-R62 IonicContact OD2-NH2 2.77Å; D55-R62 PolarHBondContact OD2-NH2 2.83Å; D55-R334 IonicContact OD2-CZ 3.81Å; D55-R334 IonicContact OD2-NH1 2.91Å; D55-R334 PolarHBondContact OD2-NH1 3.22Å; D55-R334 IonicContact OD2-NH2 3.93Å; D55-R334 PolarHBondContact OD2-NH2 3.14Å
56	N	62	Low	78.6	Confident	161 Å²	161	66 Å²	66	86%	0.861	31%	0.314	S	S	*	.	S	Bend	trans	-69	-2.9	-172.3	-67	-18.9	0	0	0	114.3	F54	F54-N56 PolarHBondContact O-N 3.33Å; F54-N56 PolarHBondContact O-OD1 3.03Å
57	T	67.4	Low	78.9	Confident	37 Å²	37	66.2 Å²	66.2	23%	0.227	32%	0.315	C	S	.	.	S	Bend	trans	-123.8	123.2	-178.9	45.2	0	0	0	0	110.1	D55 R62	D55-T57 PolarHBondContact O-N 2.93Å; D55-T57 PolarHBondContact OD1-N 2.59Å; D55-T57 PolarHBondContact OD1-OG1 2.96Å; T57-R62 PolarHBondContact O-NH2 3.48Å; T57-R62 PolarHBondContact OG1-NE 3.21Å; T57-R62 PolarHBondContact OG1-NH2 3.42Å
58	R	74.4	Confident	79.4	Confident	193 Å²	193	66.7 Å²	66.7	73%	0.728	32%	0.317	S	S	*	.			trans	-67.8	145.5	174.7	-60	178.1	177.2	179.9	0.3	108.3	M60 D61	R58-M60 PolarHBondContact O-N 2.87Å; R58-M60 VanDerWaalsContact O-N 3.16Å; R58-D61 WeakPolarHBondContact CB-OD2 3.19Å; R58-D61 PolarHBondContact N-OD2 3.44Å; R58-D61 WeakPolarHBondContact O-CB 3.47Å; R58-D61 PolarHBondContact O-N 2.96Å
59	T	77.4	Confident	80.1	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.012	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-53.2	-40.2	178.6	-48.5	0	0	0	0	111.7	D61 R62 F63 F170 L330 R334	T59-D61 VanDerWaalsContact C-N 3.32Å; T59-D61 PolarHBondContact O-N 3.33Å; T59-R62 WeakPolarHBondContact O-CB 3.27Å; T59-R62 PolarHBondContact O-N 3.08Å; T59-F63 HydrophobicContact CG2-CE2 3.94Å; T59-F63 VanDerWaalsContact O-CD2 3.29Å; T59-F63 WeakPolarHBondContact O-CD2 3.44Å; T59-F170 HydrophobicContact CG2-CD1 4.25Å; T59-L330 HydrophobicContact CG2-CD2 3.68Å; T59-L330 HydrophobicContact CG2-CG 3.69Å; T59-R334 HydrophobicContact CG2-CB 4.13Å; T59-R334 HydrophobicContact CG2-CG 4.43Å; T59-R334 VanDerWaalsContact OG1-CD 3.23Å; T59-R334 WeakPolarHBondContact OG1-CD 3.27Å
60	M	78.4	Confident	81.1	Confident	31 Å²	31	54.6 Å²	54.6	15%	0.153	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-62.7	-34.8	178.6	-64.3	-173.6	115.5	0	0	113.8	C19 R58 R62 F63 L324 P327 L330	C19-M60 WeakPolarHBondContact SG-CE 3.33Å; R58-M60 PolarHBondContact O-N 2.87Å; R58-M60 VanDerWaalsContact O-N 3.16Å; M60-R62 PolarHBondContact O-N 2.93Å; M60-R62 VanDerWaalsContact O-N 3.16Å; M60-F63 PolarHBondContact O-N 2.9Å; M60-L324 WeakPolarHBondContact CE-O 2.91Å; M60-P327 HydrophobicContact CE-CB 4.35Å; M60-P327 HydrophobicContact CE-CG 4.03Å; M60-P327 HydrophobicContact CG-CB 4.45Å; M60-P327 HydrophobicContact SD-CB 3.48Å; M60-P327 WeakPolarHBondContact SD-CB 3.38Å; M60-P327 HydrophobicContact SD-CG 3.48Å; M60-P327 WeakPolarHBondContact SD-CG 3.29Å; M60-L330 HydrophobicContact CB-CD2 4.34Å; M60-L330 HydrophobicContact CG-CD2 3.55Å
61	D	80.5	Confident	82	Confident	94 Å²	94	48.8 Å²	48.8	50%	0.503	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-70.8	-11.1	-177.9	-55.8	-26.8	0	0	0	112.1	R58 T59	R58-D61 WeakPolarHBondContact CB-OD2 3.19Å; R58-D61 PolarHBondContact N-OD2 3.44Å; R58-D61 WeakPolarHBondContact O-CB 3.47Å; R58-D61 PolarHBondContact O-N 2.96Å; T59-D61 VanDerWaalsContact C-N 3.32Å; T59-D61 PolarHBondContact O-N 3.33Å
62	R	83.9	Confident	82.8	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.008	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-87.5	-31.7	177.7	-56.6	-159.3	-174.9	98.1	1.5	114.1	A35 D55 T57 T59 M60 N171 G173 R334	A35-R62 HydrophobicContact CB-CB 4.15Å; A35-R62 HydrophobicContact CB-CG 4.05Å; D55-R62 VanDerWaalsContact CG-NH2 3.26Å; D55-R62 IonicContact OD1-NH2 3.09Å; D55-R62 PolarHBondContact OD1-NH2 2.92Å; D55-R62 IonicContact OD2-CZ 2.75Å; D55-R62 IonicContact OD2-NH2 2.77Å; D55-R62 PolarHBondContact OD2-NH2 2.83Å; T57-R62 PolarHBondContact O-NH2 3.48Å; T57-R62 PolarHBondContact OG1-NE 3.21Å; T57-R62 PolarHBondContact OG1-NH2 3.42Å; T59-R62 WeakPolarHBondContact O-CB 3.27Å; T59-R62 PolarHBondContact O-N 3.08Å; M60-R62 PolarHBondContact O-N 2.93Å; M60-R62 VanDerWaalsContact O-N 3.16Å; R62-N171 WeakPolarHBondContact CD-O 3.49Å; R62-N171 PolarHBondContact NE-O 2.57Å; R62-G173 WeakPolarHBondContact O-CA 3.22Å; R62-R334 VanDerWaalsContact NH1-NE 3.2Å
63	F	85.6	Confident	83.8	Confident	14 Å²	14	42.9 Å²	42.9	6%	0.061	21%	0.207	C	C	.	.			trans	-68	146.6	-176.9	-78.8	-112.8	0	0	0	108.9	Y20 T59 M60 S67 L169 F170 L330	Y20-F63 WeakPolarHBondContact CD2-O 3.26Å; Y20-F63 WeakPolarHBondContact CE2-O 3.4Å; T59-F63 HydrophobicContact CG2-CE2 3.94Å; T59-F63 VanDerWaalsContact O-CD2 3.29Å; T59-F63 WeakPolarHBondContact O-CD2 3.44Å; M60-F63 PolarHBondContact O-N 2.9Å; F63-S67 VanDerWaalsContact CA-OG 3.27Å; F63-S67 WeakPolarHBondContact CA-OG 3.39Å; F63-S67 VanDerWaalsContact CD1-CB 3.5Å; F63-L169 HydrophobicContact CE1-CG 4.36Å; F63-L169 HydrophobicContact CZ-CG 4.43Å; F63-F170 HydrophobicContact CE2-CD1 4.38Å; F63-F170 HydrophobicContact CZ-CD1 4.04Å; F63-F170 HydrophobicContact CZ-CD2 4.34Å; F63-F170 HydrophobicContact CZ-CE1 4.29Å; F63-F170 HydrophobicContact CZ-CG 4.12Å; F63-L330 HydrophobicContact CD2-CD2 4.37Å; F63-L330 HydrophobicContact CE2-CD1 4.47Å; F63-L330 HydrophobicContact CE2-CD2 4.21Å; F63-L330 HydrophobicContact CZ-CD1 4.29Å
64	N	85.2	Confident	84.8	Confident	14 Å²	14	37.7 Å²	37.7	8%	0.075	18%	0.179	C	C	.	.			trans	-139.4	-177	173	62.5	28.3	0	0	0	108.8	Y20 I32 K33 N66 S67	Y20-N64 HydrophobicContact CD1-CB 4.38Å; Y20-N64 HydrophobicContact CE1-CB 4.39Å; I32-N64 VanDerWaalsContact CG2-ND2 3.33Å; I32-N64 WeakPolarHBondContact CG2-ND2 3.45Å; K33-N64 PolarHBondContact O-ND2 2.99Å; N64-N66 PolarHBondContact O-N 3.02Å; N64-N66 WeakPolarHBondContact OD1-CA 3.42Å; N64-N66 PolarHBondContact OD1-N 3.2Å; N64-N66 VanDerWaalsContact OD1-N 3.09Å; N64-S67 PolarHBondContact N-OG 3.38Å; N64-S67 WeakPolarHBondContact O-CB 3.44Å; N64-S67 PolarHBondContact O-N 2.85Å; N64-S67 PolarHBondContact O-OG 3.45Å; N64-S67 PolarHBondContact OD1-N 3.08Å; N64-S67 VanDerWaalsContact OD1-N 3.08Å; N64-S67 PolarHBondContact OD1-OG 3.28Å; N64-S67 VanDerWaalsContact OD1-OG 3.14Å
65	D	84.5	Confident	85.8	Confident	28 Å²	28	29.9 Å²	29.9	15%	0.15	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-37.5	-178.1	-53.6	-22.7	0	0	0	111.9	Y20 K25 S67 K68	Y20-D65 WeakPolarHBondContact CB-OD1 3.35Å; Y20-D65 WeakPolarHBondContact CD1-OD1 3.24Å; K25-D65 HydrophobicContact CD-CB 4.49Å; K25-D65 WeakPolarHBondContact CE-OD2 3.07Å; K25-D65 IonicContact NZ-OD2 3.97Å; K25-D65 PolarHBondContact NZ-OD2 3.01Å; D65-S67 VanDerWaalsContact C-N 3.33Å; D65-S67 PolarHBondContact O-N 3.1Å; D65-K68 VanDerWaalsContact O-CE 3.32Å; D65-K68 WeakPolarHBondContact O-CE 3.3Å
66	N	90.2	Very high	86.8	Confident	4 Å²	4	29.5 Å²	29.5	2%	0.021	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	5.5	179.5	-76.4	19.7	0	0	0	114	K25 I32 N64 K68 F91 M93 G175	K25-N66 PolarHBondContact N-OD1 3.03Å; K25-N66 PolarHBondContact O-ND2 3.07Å; K25-N66 PolarHBondContact O-OD1 2.79Å; I32-N66 WeakPolarHBondContact CD1-ND2 3.34Å; N64-N66 PolarHBondContact O-N 3.02Å; N64-N66 WeakPolarHBondContact OD1-CA 3.42Å; N64-N66 PolarHBondContact OD1-N 3.2Å; N64-N66 VanDerWaalsContact OD1-N 3.09Å; N66-K68 PolarHBondContact O-N 3.29Å; N66-F91 PolarHBondContact ND2-O 2.99Å; N66-M93 HydrophobicContact CB-CE 4.08Å; N66-M93 VanDerWaalsContact O-CE 3.25Å; N66-M93 WeakPolarHBondContact O-CE 3.32Å; N66-G175 WeakPolarHBondContact O-CA 3.38Å; N66-G175 PolarHBondContact O-N 3.12Å
67	S	91.6	Very high	88.2	Confident	4 Å²	4	22.6 Å²	22.6	3%	0.028	11%	0.108	C	C	.	.			trans	-76	57.2	174.1	-57.8	0	0	0	0	111.8	F63 N64 D65 G173	F63-S67 VanDerWaalsContact CA-OG 3.27Å; F63-S67 WeakPolarHBondContact CA-OG 3.39Å; F63-S67 VanDerWaalsContact CD1-CB 3.5Å; N64-S67 PolarHBondContact N-OG 3.38Å; N64-S67 WeakPolarHBondContact O-CB 3.44Å; N64-S67 PolarHBondContact O-N 2.85Å; N64-S67 PolarHBondContact O-OG 3.45Å; N64-S67 PolarHBondContact OD1-N 3.08Å; N64-S67 VanDerWaalsContact OD1-N 3.08Å; N64-S67 PolarHBondContact OD1-OG 3.28Å; N64-S67 VanDerWaalsContact OD1-OG 3.14Å; D65-S67 VanDerWaalsContact C-N 3.33Å; D65-S67 PolarHBondContact O-N 3.1Å; S67-G173 PolarHBondContact OG-O 3.06Å
68	K	93.2	Very high	89.4	Confident	11 Å²	11	20.9 Å²	20.9	5%	0.048	10%	0.098	C	C	.	.			trans	-113.1	165.4	-179.4	-49.7	-54.6	-158.9	-152.9	0	111	L24 D65 N66 G175 V176 H221 L305 D306	L24-K68 HydrophobicContact CD2-CB 4.08Å; L24-K68 HydrophobicContact CD2-CG 3.62Å; D65-K68 VanDerWaalsContact O-CE 3.32Å; D65-K68 WeakPolarHBondContact O-CE 3.3Å; N66-K68 PolarHBondContact O-N 3.29Å; K68-G175 VanDerWaalsContact O-CA 3.29Å; K68-G175 WeakPolarHBondContact O-CA 3.48Å; K68-V176 PolarHBondContact O-N 2.82Å; K68-H221 HydrophobicContact CB-CB 4.18Å; K68-L305 HydrophobicContact CG-CD1 4.18Å; K68-D306 IonicContact NZ-OD1 3.25Å; K68-D306 PolarHBondContact NZ-OD1 3.06Å
69	V	95.9	Very high	90.2	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	116.3	175	-179.9	0	0	0	0	107	V71 Y162 L166 L169 V176 I178 P220 H221 L222 W320	V69-V71 HydrophobicContact CG1-CG2 4.45Å; V69-Y162 HydrophobicContact CG1-CE2 4.13Å; V69-L166 HydrophobicContact CG2-CD2 4.1Å; V69-L169 HydrophobicContact CG2-CD2 3.58Å; V69-V176 HydrophobicContact CB-CG2 4.14Å; V69-V176 HydrophobicContact CG1-CG2 4Å; V69-V176 HydrophobicContact CG2-CG2 3.8Å; V69-I178 HydrophobicContact CG1-CD1 4.1Å; V69-P220 HydrophobicContact CB-CB 4.42Å; V69-P220 HydrophobicContact CG1-CB 3.98Å; V69-H221 PolarHBondContact N-ND1 3.18Å; V69-H221 PolarHBondContact O-N 3.26Å; V69-L222 PolarHBondContact O-N 3.23Å; V69-W320 HydrophobicContact CB-CZ2 4.33Å; V69-W320 HydrophobicContact CG2-CH2 3.58Å; V69-W320 HydrophobicContact CG2-CZ2 3.62Å
70	I	97.2	Very high	91	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.3	176.7	-53.1	179	0	0	0	107.6	L24 F91 M93 V176 V177 I178 L222 V224	L24-I70 HydrophobicContact CD1-CD1 3.94Å; I70-F91 HydrophobicContact CD1-CD2 3.86Å; I70-F91 HydrophobicContact CD1-CE2 3.91Å; I70-M93 HydrophobicContact CD1-CE 4.06Å; I70-M93 HydrophobicContact CD1-SD 3.94Å; I70-M93 HydrophobicContact CG1-SD 4.38Å; I70-V176 PolarHBondContact N-O 3.38Å; I70-V177 HydrophobicContact CB-CG1 4.41Å; I70-V177 HydrophobicContact CB-CG2 4.22Å; I70-V177 HydrophobicContact CD1-CG2 4.37Å; I70-V177 HydrophobicContact CG2-CG1 4.46Å; I70-V177 CarbonylContact O-C 3.54Å; I70-V177 WeakPolarHBondContact O-CA 3.16Å; I70-I178 PolarHBondContact O-N 3.17Å; I70-L222 WeakPolarHBondContact CA-O 3.43Å; I70-L222 HydrophobicContact CD1-CD2 4.38Å; I70-L222 HydrophobicContact CG1-CB 4.29Å; I70-L222 HydrophobicContact CG1-CD2 4.46Å; I70-L222 HydrophobicContact CG2-CB 4.38Å; I70-L222 HydrophobicContact CG2-CD2 4.24Å; I70-L222 HydrophobicContact CG2-CG 4.34Å; I70-V224 HydrophobicContact CG2-CG2 4.11Å
71	V	97.8	Very high	91.8	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	129.3	174.2	178.4	0	0	0	0	108.4	V69 E73 Y162 I178 G181 P220 L222 I223 V224	V69-V71 HydrophobicContact CG1-CG2 4.45Å; V71-E73 HydrophobicContact CG1-CG 3.94Å; V71-E73 VanDerWaalsContact CG1-OE1 3.26Å; V71-E73 WeakPolarHBondContact CG1-OE1 3.46Å; V71-Y162 HydrophobicContact CG2-CE2 4.02Å; V71-I178 WeakPolarHBondContact CA-O 3.49Å; V71-I178 HydrophobicContact CG2-CB 4.31Å; V71-G181 VanDerWaalsContact CG1-N 3.34Å; V71-P220 HydrophobicContact CB-CB 4.29Å; V71-P220 HydrophobicContact CB-CG 4.31Å; V71-P220 HydrophobicContact CG2-CB 3.62Å; V71-P220 HydrophobicContact CG2-CG 3.88Å; V71-L222 PolarHBondContact N-O 3.46Å; V71-I223 CarbonylContact O-C 3.57Å; V71-I223 VanDerWaalsContact O-CA 3.29Å; V71-I223 WeakPolarHBondContact O-CA 3.27Å; V71-V224 PolarHBondContact O-N 3.43Å
72	V	97.6	Very high	92.5	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	119.8	174	-172.4	0	0	0	0	108.7	K80 V83 A84 L87 V177 I178 R180 V224 I226	V72-K80 HydrophobicContact CG1-CB 3.87Å; V72-V83 HydrophobicContact CG1-CB 4.35Å; V72-V83 HydrophobicContact CG1-CG1 4.48Å; V72-A84 HydrophobicContact CB-CB 3.91Å; V72-A84 HydrophobicContact CG2-CB 3.57Å; V72-L87 HydrophobicContact CG2-CD1 4.1Å; V72-V177 HydrophobicContact CG2-CG1 4.1Å; V72-I178 PolarHBondContact N-O 3.38Å; V72-R180 WeakPolarHBondContact O-CA 3.47Å; V72-R180 PolarHBondContact O-N 3.31Å; V72-V224 CarbonylContact C-O 3.43Å; V72-V224 WeakPolarHBondContact CA-O 2.99Å; V72-V224 HydrophobicContact CG1-CB 4.49Å; V72-V224 HydrophobicContact CG2-CB 4.3Å; V72-I226 HydrophobicContact CG1-CD1 3.59Å; V72-I226 HydrophobicContact CG1-CG1 4.35Å
73	E	96.9	Very high	93.1	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	155.1	-178	-67.5	-69	170.8	0	0	110.7	V71 G181 S184 I223 V224 Y225 I226 Y267	V71-E73 HydrophobicContact CG1-CG 3.94Å; V71-E73 VanDerWaalsContact CG1-OE1 3.26Å; V71-E73 WeakPolarHBondContact CG1-OE1 3.46Å; E73-G181 PolarHBondContact OE1-N 3.07Å; E73-S184 VanDerWaalsContact CD-OG 3.25Å; E73-S184 PolarHBondContact OE1-OG 2.88Å; E73-S184 WeakPolarHBondContact OE2-CB 3.45Å; E73-S184 PolarHBondContact OE2-OG 3.49Å; E73-I223 HydrophobicContact CB-CG2 4.24Å; E73-I223 HydrophobicContact CG-CG2 3.86Å; E73-V224 PolarHBondContact N-O 3.23Å; E73-Y225 HydrophobicContact CB-CD2 4.35Å; E73-I226 PolarHBondContact O-N 2.88Å; E73-Y267 HydrophobicContact CG-CE1 4.01Å
74	G	95.3	Very high	93.6	Very high	0 Å²	0	11 Å²	11	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.4	172.7	175.6	0	0	0	0	0	113	R180	G74-R180 PolarHBondContact O-NH2 2.72Å
75	N	94.8	Very high	94.2	Very high	2 Å²	2	11.5 Å²	11.5	1%	0.011	7%	0.072	C	C	.	.			trans	-62.8	169.2	179.3	-143.1	-45.8	0	0	0	113	A77 S78 I233 L256 Y259 E260	N75-A77 PolarHBondContact O-N 3.22Å; N75-S78 WeakPolarHBondContact O-CB 3.42Å; N75-S78 PolarHBondContact O-N 2.77Å; N75-S78 PolarHBondContact O-OG 2.8Å; N75-I233 HydrophobicContact CB-CD1 3.71Å; N75-L256 PolarHBondContact ND2-O 3.21Å; N75-Y259 WeakPolarHBondContact OD1-CD1 3.25Å; N75-E260 WeakPolarHBondContact CB-OE2 3.36Å; N75-E260 PolarHBondContact ND2-OE2 3.31Å
76	I	92.8	Very high	94.7	Very high	22 Å²	22	10.4 Å²	10.4	11%	0.113	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	137.4	167.4	-57.8	175.5	0	0	0	108.4	S78 W136 F188 I233 L251 F255 L256	I76-S78 PolarHBondContact O-N 2.67Å; I76-S78 VanDerWaalsContact O-N 3.1Å; I76-W136 HydrophobicContact CD1-CH2 4.09Å; I76-W136 HydrophobicContact CD1-CZ2 4.03Å; I76-F188 HydrophobicContact CD1-CE2 4.3Å; I76-I233 VanDerWaalsContact O-CG2 3.29Å; I76-I233 WeakPolarHBondContact O-CG2 3.5Å; I76-L251 HydrophobicContact CD1-CD1 3.81Å; I76-F255 HydrophobicContact CD1-CE1 4.04Å; I76-L256 HydrophobicContact CB-CD2 4.18Å; I76-L256 HydrophobicContact CD1-CD2 4.23Å
77	A	91.3	Very high	95	Very high	17 Å²	17	10.3 Å²	10.3	14%	0.14	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	15.7	-179.7	0	0	0	0	0	116.5	N75 G79 I233 K236 I237	N75-A77 PolarHBondContact O-N 3.22Å; A77-G79 PolarHBondContact O-N 3.04Å; A77-I233 HydrophobicContact CB-CG2 4.1Å; A77-K236 HydrophobicContact CB-CB 4.1Å; A77-K236 WeakPolarHBondContact O-CD 3.48Å; A77-I237 HydrophobicContact CB-CG1 3.99Å
78	S	92.9	Very high	95.2	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	7%	0.067	C	C	.	.	S	Bend	trans	-65.7	-24.1	178.9	65.3	0	0	0	0	113.4	N75 I76 K80 K236	N75-S78 WeakPolarHBondContact O-CB 3.42Å; N75-S78 PolarHBondContact O-N 2.77Å; N75-S78 PolarHBondContact O-OG 2.8Å; I76-S78 PolarHBondContact O-N 2.67Å; I76-S78 VanDerWaalsContact O-N 3.1Å; S78-K80 PolarHBondContact OG-N 3.15Å; S78-K236 PolarHBondContact O-NZ 3.4Å
79	G	91.5	Very high	95.3	Very high	9 Å²	9	16.6 Å²	16.6	9%	0.093	9%	0.094	C	C	.	.	S	Bend	trans	100.3	8	-173.5	0	0	0	0	0	113.7	A77 S81 N82 V83 V287	A77-G79 PolarHBondContact O-N 3.04Å; G79-S81 VanDerWaalsContact C-N 3.28Å; G79-S81 PolarHBondContact O-N 3.21Å; G79-S81 VanDerWaalsContact O-N 3.15Å; G79-N82 WeakPolarHBondContact O-CB 3.04Å; G79-N82 PolarHBondContact O-N 3.04Å; G79-V83 PolarHBondContact O-N 2.95Å; G79-V287 VanDerWaalsContact O-CG1 3.24Å; G79-V287 WeakPolarHBondContact O-CG1 3.39Å
80	K	94.2	Very high	95.1	Very high	19 Å²	19	18.3 Å²	18.3	8%	0.083	10%	0.101	C	C	.	.	H	α-helix	trans	-47.6	-40.8	-179.4	59.9	178.4	-149.6	-58.9	0	115.9	V72 S78 N82 V83 A84 D98 D179 I226	V72-K80 HydrophobicContact CG1-CB 3.87Å; S78-K80 PolarHBondContact OG-N 3.15Å; K80-N82 VanDerWaalsContact C-N 3.26Å; K80-N82 PolarHBondContact O-N 3.37Å; K80-V83 PolarHBondContact O-N 3.06Å; K80-A84 VanDerWaalsContact O-CB 3.3Å; K80-A84 WeakPolarHBondContact O-CB 3.49Å; K80-A84 PolarHBondContact O-N 3.09Å; K80-D98 IonicContact NZ-OD2 2.68Å; K80-D179 WeakPolarHBondContact CD-OD1 3.12Å; K80-D179 WeakPolarHBondContact CE-OD1 3.08Å; K80-D179 VanDerWaalsContact CG-OD1 3.28Å; K80-D179 WeakPolarHBondContact CG-OD1 3.11Å; K80-I226 VanDerWaalsContact CA-CD1 3.44Å; K80-I226 HydrophobicContact CB-CD1 3.85Å
81	S	94.9	Very high	94.9	Very high	53 Å²	53	18.3 Å²	18.3	37%	0.371	10%	0.102	S	C	.	.	H	α-helix	trans	-62.4	-34.1	179.3	-45.5	0	0	0	0	112.5	G79 A85 Y95 D179	G79-S81 VanDerWaalsContact C-N 3.28Å; G79-S81 PolarHBondContact O-N 3.21Å; G79-S81 VanDerWaalsContact O-N 3.15Å; S81-A85 WeakPolarHBondContact O-CB 3.31Å; S81-A85 PolarHBondContact O-N 2.88Å; S81-Y95 PolarHBondContact O-OH 3.38Å; S81-D179 VanDerWaalsContact CA-OD2 3.3Å; S81-D179 WeakPolarHBondContact CA-OD2 3.17Å; S81-D179 WeakPolarHBondContact CB-OD2 3.41Å; S81-D179 PolarHBondContact OG-OD2 2.94Å
82	N	94.7	Very high	94.7	Very high	49 Å²	49	21.6 Å²	21.6	26%	0.262	12%	0.119	S	C	.	.	H	α-helix	trans	-71.7	-46.8	177.7	-166.1	64	0	0	0	111.4	G79 K80 A84 A85 N86 V287 Y288	G79-N82 WeakPolarHBondContact O-CB 3.04Å; G79-N82 PolarHBondContact O-N 3.04Å; K80-N82 VanDerWaalsContact C-N 3.26Å; K80-N82 PolarHBondContact O-N 3.37Å; N82-A84 VanDerWaalsContact C-N 3.32Å; N82-A84 PolarHBondContact O-N 2.62Å; N82-A85 PolarHBondContact O-N 3.48Å; N82-N86 WeakPolarHBondContact O-CB 3.41Å; N82-N86 PolarHBondContact O-N 3.15Å; N82-V287 HydrophobicContact CB-CG1 4.49Å; N82-V287 PolarHBondContact ND2-O 3.1Å; N82-Y288 HydrophobicContact CB-CD1 4.18Å; N82-Y288 HydrophobicContact CB-CE1 4.14Å
83	V	96.1	Very high	94.6	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-58.2	-47.1	174.7	-176.6	0	0	0	0	110.3	V72 G79 K80 A85 N86 L87 V224 I226 V287 I296	V72-V83 HydrophobicContact CG1-CB 4.35Å; V72-V83 HydrophobicContact CG1-CG1 4.48Å; G79-V83 PolarHBondContact O-N 2.95Å; K80-V83 PolarHBondContact O-N 3.06Å; V83-A85 PolarHBondContact O-N 2.95Å; V83-N86 PolarHBondContact O-N 3.06Å; V83-L87 HydrophobicContact CG1-CD1 3.76Å; V83-L87 HydrophobicContact CG1-CG 4Å; V83-L87 WeakPolarHBondContact O-CB 3.36Å; V83-L87 VanDerWaalsContact O-CG 3.28Å; V83-L87 WeakPolarHBondContact O-CG 3.23Å; V83-L87 PolarHBondContact O-N 3.32Å; V83-V224 HydrophobicContact CG1-CG1 4.45Å; V83-I226 HydrophobicContact CB-CD1 3.83Å; V83-I226 HydrophobicContact CG1-CD1 4.32Å; V83-I226 HydrophobicContact CG2-CD1 3.43Å; V83-I226 VanDerWaalsContact CG2-CD1 3.43Å; V83-I226 HydrophobicContact CG2-CG1 4.36Å; V83-V287 HydrophobicContact CG2-CB 4.18Å; V83-V287 HydrophobicContact CG2-CG1 3.34Å; V83-V287 HydrophobicContact CG2-CG2 4.16Å; V83-I296 HydrophobicContact CG1-CD1 4.28Å
84	A	97.2	Very high	94.5	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.5	-43.6	-179.6	0	0	0	0	0	112.3	V72 K80 N82 A88 Y95 V177 D179	V72-A84 HydrophobicContact CB-CB 3.91Å; V72-A84 HydrophobicContact CG2-CB 3.57Å; K80-A84 VanDerWaalsContact O-CB 3.3Å; K80-A84 WeakPolarHBondContact O-CB 3.49Å; K80-A84 PolarHBondContact O-N 3.09Å; N82-A84 VanDerWaalsContact C-N 3.32Å; N82-A84 PolarHBondContact O-N 2.62Å; A84-A88 WeakPolarHBondContact O-CB 3.45Å; A84-A88 PolarHBondContact O-N 2.98Å; A84-A88 VanDerWaalsContact O-N 3.09Å; A84-Y95 HydrophobicContact CB-CD2 4.22Å; A84-Y95 HydrophobicContact CB-CE2 3.53Å; A84-V177 HydrophobicContact CB-CG1 4.05Å; A84-V177 WeakPolarHBondContact O-CG1 3.42Å; A84-D179 HydrophobicContact CB-CB 4.03Å
85	A	96.9	Very high	94.7	Very high	24 Å²	24	26.7 Å²	26.7	20%	0.198	14%	0.143	C	C	.	.	H	α-helix	trans	-65.7	-40.6	176.1	0	0	0	0	0	112.5	S81 N82 V83 A88 K89 Y95	S81-A85 WeakPolarHBondContact O-CB 3.31Å; S81-A85 PolarHBondContact O-N 2.88Å; N82-A85 PolarHBondContact O-N 3.48Å; V83-A85 PolarHBondContact O-N 2.95Å; A85-A88 PolarHBondContact O-N 3.42Å; A85-K89 WeakPolarHBondContact O-CG 3.25Å; A85-K89 PolarHBondContact O-N 3.46Å; A85-Y95 HydrophobicContact CB-CD1 4.37Å; A85-Y95 HydrophobicContact CB-CE1 4.17Å; A85-Y95 HydrophobicContact CB-CE2 4.39Å
86	N	95.8	Very high	94.8	Very high	5 Å²	5	27.3 Å²	27.3	3%	0.027	15%	0.146	C	C	.	.	H	α-helix	trans	-72.5	-41.3	179.5	-81.5	-9.8	0	0	0	112.4	N82 V83 A88 K89 H90 D290 N293	N82-N86 WeakPolarHBondContact O-CB 3.41Å; N82-N86 PolarHBondContact O-N 3.15Å; V83-N86 PolarHBondContact O-N 3.06Å; N86-A88 VanDerWaalsContact C-N 3.28Å; N86-A88 PolarHBondContact O-N 3.31Å; N86-K89 WeakPolarHBondContact O-CB 3.26Å; N86-K89 PolarHBondContact O-N 2.98Å; N86-K89 VanDerWaalsContact O-N 3.09Å; N86-K89 PolarHBondContact OD1-NZ 2.69Å; N86-H90 PolarHBondContact O-CD2 2.98Å; N86-H90 PolarHBondContact O-N 3.33Å; N86-D290 PolarHBondContact ND2-OD1 2.62Å; N86-D290 VanDerWaalsContact ND2-OD1 3.07Å; N86-N293 HydrophobicContact CB-CB 4.01Å; N86-N293 PolarHBondContact ND2-ND2 3.47Å
87	L	96	Very high	95	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-57.7	-41.4	171.6	-71.7	178.1	0	0	0	111.7	V72 V83 K89 H90 F91 V177 V224 I296 A297	V72-L87 HydrophobicContact CG2-CD1 4.1Å; V83-L87 HydrophobicContact CG1-CD1 3.76Å; V83-L87 HydrophobicContact CG1-CG 4Å; V83-L87 WeakPolarHBondContact O-CB 3.36Å; V83-L87 VanDerWaalsContact O-CG 3.28Å; V83-L87 WeakPolarHBondContact O-CG 3.23Å; V83-L87 PolarHBondContact O-N 3.32Å; L87-K89 VanDerWaalsContact C-N 3.31Å; L87-K89 PolarHBondContact O-N 2.87Å; L87-H90 PolarHBondContact O-N 3.07Å; L87-F91 HydrophobicContact CB-CD2 4.49Å; L87-F91 HydrophobicContact CD2-CE2 4.03Å; L87-F91 VanDerWaalsContact O-CD2 3.24Å; L87-F91 WeakPolarHBondContact O-CD2 3.07Å; L87-F91 PolarHBondContact O-N 2.57Å; L87-V177 HydrophobicContact CB-CG1 4.46Å; L87-V224 HydrophobicContact CD1-CB 4.48Å; L87-V224 HydrophobicContact CD1-CG2 3.98Å; L87-I296 HydrophobicContact CD2-CG2 4.12Å; L87-A297 HydrophobicContact CD2-CB 3.91Å
88	A	96.2	Very high	95.2	Very high	6 Å²	6	30 Å²	30	5%	0.05	16%	0.162	C	C	.	.	H	α-helix	trans	-60.4	-40.5	176.1	0	0	0	0	0	112.1	A84 A85 N86 D92 M93 Y95 V177	A84-A88 WeakPolarHBondContact O-CB 3.45Å; A84-A88 PolarHBondContact O-N 2.98Å; A84-A88 VanDerWaalsContact O-N 3.09Å; A85-A88 PolarHBondContact O-N 3.42Å; N86-A88 VanDerWaalsContact C-N 3.28Å; N86-A88 PolarHBondContact O-N 3.31Å; A88-D92 WeakPolarHBondContact O-CA 3.23Å; A88-D92 PolarHBondContact O-N 3Å; A88-D92 VanDerWaalsContact O-N 3.09Å; A88-M93 PolarHBondContact O-N 3.26Å; A88-Y95 HydrophobicContact CB-CD2 4.48Å; A88-Y95 HydrophobicContact CB-CG 4.46Å; A88-V177 HydrophobicContact CB-CB 4.04Å; A88-V177 HydrophobicContact CB-CG2 3.93Å
89	K	94.3	Very high	95.3	Very high	142 Å²	142	30.4 Å²	30.4	62%	0.617	17%	0.165	S	C	*	.	H	α-helix	trans	-65.8	-48.8	174.7	-65.1	170.1	-166.6	161.4	0	111.7	A85 N86 L87 F91 D92	A85-K89 WeakPolarHBondContact O-CG 3.25Å; A85-K89 PolarHBondContact O-N 3.46Å; N86-K89 WeakPolarHBondContact O-CB 3.26Å; N86-K89 PolarHBondContact O-N 2.98Å; N86-K89 VanDerWaalsContact O-N 3.09Å; N86-K89 PolarHBondContact OD1-NZ 2.69Å; L87-K89 VanDerWaalsContact C-N 3.31Å; L87-K89 PolarHBondContact O-N 2.87Å; K89-F91 VanDerWaalsContact C-N 3.26Å; K89-F91 PolarHBondContact O-N 2.8Å; K89-D92 PolarHBondContact O-N 3.35Å
90	H	93.4	Very high	95.4	Very high	35 Å²	35	33.3 Å²	33.3	16%	0.162	18%	0.181	C	C	.	.	H	α-helix	trans	-63	-30.6	-176.8	-69.7	-57.2	0	0	0	113.2	L26 A27 N86 L87 Y294 A297	L26-H90 HydrophobicContact CD2-CB 4.24Å; A27-H90 VanDerWaalsContact CB-O 3.29Å; A27-H90 WeakPolarHBondContact CB-O 3.26Å; A27-H90 PolarHBondContact N-O 3.43Å; N86-H90 PolarHBondContact O-CD2 2.98Å; N86-H90 PolarHBondContact O-N 3.33Å; L87-H90 PolarHBondContact O-N 3.07Å; H90-Y294 AromaticContact CE1-CD2 3.98Å; H90-Y294 AromaticContact ND1-CD2 3.96Å; H90-A297 HydrophobicContact CB-CB 3.91Å
91	F	92.9	Very high	95.3	Very high	1 Å²	1	34 Å²	34	0%	0.004	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	0.2	177.3	-63.6	-52.9	0	0	0	114.9	L24 L26 N66 I70 L87 K89 M93 A297 A300 T301	L24-F91 HydrophobicContact CB-CD1 4.29Å; L24-F91 HydrophobicContact CB-CE1 3.88Å; L24-F91 HydrophobicContact CB-CZ 4.35Å; L24-F91 HydrophobicContact CD1-CE1 4.23Å; L24-F91 HydrophobicContact CD1-CE2 4.13Å; L24-F91 HydrophobicContact CD1-CZ 3.9Å; L26-F91 HydrophobicContact CD2-CD1 4.24Å; L26-F91 HydrophobicContact CD2-CE1 3.78Å; L26-F91 HydrophobicContact CD2-CZ 4.5Å; N66-F91 PolarHBondContact ND2-O 2.99Å; I70-F91 HydrophobicContact CD1-CD2 3.86Å; I70-F91 HydrophobicContact CD1-CE2 3.91Å; L87-F91 HydrophobicContact CB-CD2 4.49Å; L87-F91 HydrophobicContact CD2-CE2 4.03Å; L87-F91 VanDerWaalsContact O-CD2 3.24Å; L87-F91 WeakPolarHBondContact O-CD2 3.07Å; L87-F91 PolarHBondContact O-N 2.57Å; K89-F91 VanDerWaalsContact C-N 3.26Å; K89-F91 PolarHBondContact O-N 2.8Å; F91-M93 VanDerWaalsContact C-N 3.26Å; F91-M93 HydrophobicContact CB-CB 4.43Å; F91-M93 HydrophobicContact CB-CE 3.74Å; F91-M93 HydrophobicContact CB-CG 3.66Å; F91-M93 HydrophobicContact CB-SD 4.03Å; F91-M93 HydrophobicContact CD2-CE 4.4Å; F91-M93 HydrophobicContact CG-CE 4.12Å; F91-M93 PolarHBondContact O-N 3.4Å; F91-A297 HydrophobicContact CE2-CB 4.43Å; F91-A297 HydrophobicContact CZ-CB 4.04Å; F91-A297 WeakPolarHBondContact CZ-O 3.42Å; F91-A300 HydrophobicContact CE2-CB 4.35Å; F91-A300 HydrophobicContact CZ-CB 3.9Å; F91-T301 HydrophobicContact CE1-CG2 3.72Å; F91-T301 HydrophobicContact CZ-CG2 4.35Å
92	D	93	Very high	95.2	Very high	69 Å²	69	34.8 Å²	34.8	37%	0.369	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	47.6	-171.1	-173.8	19.8	0	0	0	111.6	A27 I32 R34 A88 K89 Q174	A27-D92 HydrophobicContact CB-CB 3.98Å; I32-D92 HydrophobicContact CD1-CB 4.23Å; R34-D92 IonicContact CZ-OD1 3.76Å; R34-D92 IonicContact CZ-OD2 2.96Å; R34-D92 IonicContact NE-OD2 2.64Å; R34-D92 IonicContact NH1-OD1 2.83Å; R34-D92 IonicContact NH1-OD2 2.76Å; R34-D92 PolarHBondContact NH2-O 3.12Å; R34-D92 IonicContact NH2-OD1 3.78Å; R34-D92 PolarHBondContact NH2-OD1 3.24Å; R34-D92 IonicContact NH2-OD2 2.72Å; R34-D92 PolarHBondContact NH2-OD2 3.43Å; A88-D92 WeakPolarHBondContact O-CA 3.23Å; A88-D92 PolarHBondContact O-N 3Å; A88-D92 VanDerWaalsContact O-N 3.09Å; K89-D92 PolarHBondContact O-N 3.35Å; D92-Q174 PolarHBondContact O-NE2 3.44Å; D92-Q174 VanDerWaalsContact O-NE2 3.16Å
93	M	95	Very high	95.1	Very high	11 Å²	11	34.6 Å²	34.6	5%	0.054	18%	0.183	C	C	.	.			trans	-104.4	159.2	178.8	-70.3	-168.2	-170.4	0	0	111.3	L24 N66 I70 A88 F91 G175 V177	L24-M93 HydrophobicContact CD2-CE 3.48Å; L24-M93 VanDerWaalsContact CD2-CE 3.48Å; N66-M93 HydrophobicContact CB-CE 4.08Å; N66-M93 VanDerWaalsContact O-CE 3.25Å; N66-M93 WeakPolarHBondContact O-CE 3.32Å; I70-M93 HydrophobicContact CD1-CE 4.06Å; I70-M93 HydrophobicContact CD1-SD 3.94Å; I70-M93 HydrophobicContact CG1-SD 4.38Å; A88-M93 PolarHBondContact O-N 3.26Å; F91-M93 VanDerWaalsContact C-N 3.26Å; F91-M93 HydrophobicContact CB-CB 4.43Å; F91-M93 HydrophobicContact CB-CE 3.74Å; F91-M93 HydrophobicContact CB-CG 3.66Å; F91-M93 HydrophobicContact CB-SD 4.03Å; F91-M93 HydrophobicContact CD2-CE 4.4Å; F91-M93 HydrophobicContact CG-CE 4.12Å; F91-M93 PolarHBondContact O-N 3.4Å; M93-G175 CarbonylContact C-O 3.41Å; M93-G175 WeakPolarHBondContact CA-O 3.37Å; M93-G175 VanDerWaalsContact CB-O 3.31Å; M93-G175 WeakPolarHBondContact CB-O 3.18Å; M93-V177 HydrophobicContact CB-CG2 3.97Å; M93-V177 HydrophobicContact SD-CG2 3.95Å
94	A	96.2	Very high	94.8	Very high	17 Å²	17	34.9 Å²	34.9	14%	0.14	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	126.5	174.5	0	0	0	0	0	110.6	F96 H168 G175 V176 V177	A94-F96 HydrophobicContact CB-CD2 4.46Å; A94-F96 HydrophobicContact CB-CE2 3.83Å; A94-H168 WeakPolarHBondContact CB-NE2 3.12Å; A94-G175 PolarHBondContact N-O 3.34Å; A94-V176 HydrophobicContact CB-CG1 4.37Å; A94-V176 WeakPolarHBondContact O-CA 3.42Å; A94-V177 PolarHBondContact O-N 3.37Å
95	Y	97.7	Very high	94.5	Very high	79 Å²	79	35 Å²	35	31%	0.31	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	128.9	176.3	177.8	-123.8	0	0	0	111.3	S81 A84 A85 A88 P97 D179	S81-Y95 PolarHBondContact O-OH 3.38Å; A84-Y95 HydrophobicContact CB-CD2 4.22Å; A84-Y95 HydrophobicContact CB-CE2 3.53Å; A85-Y95 HydrophobicContact CB-CD1 4.37Å; A85-Y95 HydrophobicContact CB-CE1 4.17Å; A85-Y95 HydrophobicContact CB-CE2 4.39Å; A88-Y95 HydrophobicContact CB-CD2 4.48Å; A88-Y95 HydrophobicContact CB-CG 4.46Å; Y95-P97 HydrophobicContact CE1-CB 3.84Å; Y95-P97 HydrophobicContact CE1-CG 4.47Å; Y95-D179 HydrophobicContact CE2-CB 4.1Å
96	F	97.4	Very high	94.2	Very high	14 Å²	14	35.6 Å²	35.6	6%	0.061	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	104.3	174.5	-74.6	-95.4	0	0	0	109	A94 R164 A165 H168 V176 V177 I178 D179	A94-F96 HydrophobicContact CB-CD2 4.46Å; A94-F96 HydrophobicContact CB-CE2 3.83Å; F96-R164 HydrophobicContact CE1-CB 4.12Å; F96-R164 HydrophobicContact CE1-CG 3.86Å; F96-A165 HydrophobicContact CD1-CB 4.05Å; F96-A165 HydrophobicContact CD2-CB 3.8Å; F96-A165 HydrophobicContact CE1-CB 4.12Å; F96-A165 HydrophobicContact CE2-CB 3.87Å; F96-A165 HydrophobicContact CG-CB 3.91Å; F96-A165 HydrophobicContact CZ-CB 4.04Å; F96-H168 HydrophobicContact CE2-CB 4.33Å; F96-H168 HydrophobicContact CZ-CB 3.94Å; F96-V176 HydrophobicContact CD2-CB 4.11Å; F96-V176 HydrophobicContact CD2-CG1 4.2Å; F96-V176 HydrophobicContact CE2-CB 4.11Å; F96-V176 HydrophobicContact CE2-CG1 3.68Å; F96-V177 PolarHBondContact N-O 3.36Å; F96-I178 HydrophobicContact CB-CB 4.49Å; F96-I178 HydrophobicContact CB-CG1 4.11Å; F96-I178 HydrophobicContact CB-CG2 4.46Å; F96-I178 WeakPolarHBondContact O-CA 3.36Å; F96-D179 PolarHBondContact O-N 3.47Å
97	P	97.1	Very high	93.8	Very high	69 Å²	69	36.5 Å²	36.5	45%	0.448	19%	0.188	S	C	.	.	P	Polyproline II helix	trans	-69.8	158.3	-178.1	28.9	-34.8	0	0	0	112.4	Y95 N161	Y95-P97 HydrophobicContact CE1-CB 3.84Å; Y95-P97 HydrophobicContact CE1-CG 4.47Å; P97-N161 PolarHBondContact O-ND2 2.96Å
98	D	95.9	Very high	93.3	Very high	26 Å²	26	41 Å²	41	14%	0.139	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-61.4	129.3	172.5	-169.1	8.2	0	0	0	108.6	K80 T100 R158 D179	K80-D98 IonicContact NZ-OD2 2.68Å; D98-T100 PolarHBondContact O-N 3.44Å; D98-R158 IonicContact OD1-CZ 2.7Å; D98-R158 IonicContact OD1-NE 3.58Å; D98-R158 PolarHBondContact OD1-NE 2.61Å; D98-R158 IonicContact OD1-NH2 3.77Å; D98-R158 PolarHBondContact OD1-NH2 2.99Å; D98-R158 IonicContact OD2-NH2 2.73Å; D98-D179 WeakPolarHBondContact CA-O 2.89Å; D98-D179 HydrophobicContact CB-CB 4.3Å; D98-D179 WeakPolarHBondContact CB-O 2.83Å; D98-D179 PolarHBondContact N-O 3.33Å
99	P	94.9	Very high	92.6	Very high	10 Å²	10	42 Å²	42	7%	0.065	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-57.4	139.5	178	-27.5	36.1	0	0	0	112.7	D103 F154 R157 R158 N161	P99-D103 HydrophobicContact CB-CB 4.28Å; P99-F154 WeakPolarHBondContact O-CE1 3.28Å; P99-R157 HydrophobicContact CB-CB 3.66Å; P99-R157 HydrophobicContact CG-CB 3.99Å; P99-R158 HydrophobicContact CG-CG 4.01Å; P99-N161 HydrophobicContact CG-CB 4.04Å
100	T	94	Very high	91.9	Very high	70 Å²	70	35.3 Å²	35.3	43%	0.429	18%	0.18	S	C	.	.	P	Polyproline II helix	trans	-101.8	171.8	179	61.3	0	0	0	0	111.3	D98 D102 D103 I104	D98-T100 PolarHBondContact O-N 3.44Å; T100-D102 PolarHBondContact O-N 2.97Å; T100-D102 PolarHBondContact OG1-N 3.34Å; T100-D103 PolarHBondContact N-OD2 3.42Å; T100-D103 WeakPolarHBondContact O-CB 3.42Å; T100-D103 PolarHBondContact O-N 2.88Å; T100-D103 PolarHBondContact OG1-N 3.15Å; T100-D103 PolarHBondContact OG1-OD2 3.25Å; T100-I104 PolarHBondContact O-N 2.77Å
101	E	91.5	Very high	91.3	Very high	33 Å²	33	37.4 Å²	37.4	15%	0.154	19%	0.19	C	C	.	.	H	α-helix	trans	-58.5	-31.6	170.8	-69.2	-175	83.1	0	0	112.4	D103 I104 Y105 T131 C132 F154	E101-D103 PolarHBondContact O-N 3.37Å; E101-I104 WeakPolarHBondContact O-CA 3.45Å; E101-I104 WeakPolarHBondContact O-CB 3.4Å; E101-I104 PolarHBondContact O-N 3.23Å; E101-Y105 HydrophobicContact CB-CD2 4.17Å; E101-Y105 HydrophobicContact CB-CE2 4.48Å; E101-Y105 VanDerWaalsContact O-CD2 3.25Å; E101-Y105 WeakPolarHBondContact O-CD2 3.1Å; E101-Y105 PolarHBondContact O-N 2.56Å; E101-T131 WeakPolarHBondContact OE1-CA 3.44Å; E101-T131 WeakPolarHBondContact OE1-CB 3.39Å; E101-C132 VanDerWaalsContact CD-N 3.3Å; E101-C132 HydrophobicContact CG-CB 4.4Å; E101-C132 WeakPolarHBondContact CG-SG 3.33Å; E101-C132 PolarHBondContact OE1-N 2.68Å; E101-C132 WeakPolarHBondContact OE2-CB 3.46Å; E101-C132 PolarHBondContact OE2-SG 2.75Å; E101-F154 HydrophobicContact CG-CZ 4.02Å
102	D	93.2	Very high	90.9	Very high	69 Å²	69	41.1 Å²	41.1	37%	0.369	21%	0.214	S	C	.	.	H	α-helix	trans	-64.8	-32.9	175.7	-73.5	1.5	0	0	0	111.3	T100 I104 I106 R117	T100-D102 PolarHBondContact O-N 2.97Å; T100-D102 PolarHBondContact OG1-N 3.34Å; D102-I104 VanDerWaalsContact C-N 3.25Å; D102-I104 PolarHBondContact O-N 3.45Å; D102-I106 HydrophobicContact CB-CD1 3.62Å; D102-I106 HydrophobicContact CB-CG1 4.04Å; D102-I106 WeakPolarHBondContact O-CB 3.37Å; D102-I106 VanDerWaalsContact O-CG1 3.26Å; D102-I106 WeakPolarHBondContact O-CG1 3.28Å; D102-I106 PolarHBondContact O-N 3.12Å; D102-R117 IonicContact OD1-CZ 3.78Å; D102-R117 IonicContact OD1-NH1 2.64Å; D102-R117 IonicContact OD1-NH2 3.33Å; D102-R117 PolarHBondContact OD1-NH2 2.89Å
103	D	91.7	Very high	90.7	Very high	45 Å²	45	41.4 Å²	41.4	24%	0.241	22%	0.216	C	C	.	.	H	α-helix	trans	-68.9	-26.3	172.3	-62.6	-57.2	0	0	0	112.4	P99 T100 E101 R108 R157	P99-D103 HydrophobicContact CB-CB 4.28Å; T100-D103 PolarHBondContact N-OD2 3.42Å; T100-D103 WeakPolarHBondContact O-CB 3.42Å; T100-D103 PolarHBondContact O-N 2.88Å; T100-D103 PolarHBondContact OG1-N 3.15Å; T100-D103 PolarHBondContact OG1-OD2 3.25Å; E101-D103 PolarHBondContact O-N 3.37Å; D103-R108 IonicContact OD1-CZ 3.21Å; D103-R108 IonicContact OD1-NH2 2.74Å; D103-R108 PolarHBondContact OD1-NH2 3.37Å; D103-R157 PolarHBondContact O-NE 3.38Å; D103-R157 PolarHBondContact O-NH1 3.28Å; D103-R157 PolarHBondContact O-NH2 3.42Å
104	I	90.8	Very high	90.5	Very high	6 Å²	6	41.5 Å²	41.5	3%	0.031	22%	0.216	C	C	.	.	H	α-helix	trans	-77	-50.3	174.5	-60.3	168.1	0	0	0	110.6	T100 E101 D102 L150 H153 F154 R157	T100-I104 PolarHBondContact O-N 2.77Å; E101-I104 WeakPolarHBondContact O-CA 3.45Å; E101-I104 WeakPolarHBondContact O-CB 3.4Å; E101-I104 PolarHBondContact O-N 3.23Å; D102-I104 VanDerWaalsContact C-N 3.25Å; D102-I104 PolarHBondContact O-N 3.45Å; I104-L150 HydrophobicContact CD1-CD1 4.33Å; I104-H153 HydrophobicContact CD1-CB 3.96Å; I104-H153 HydrophobicContact CG1-CB 4.36Å; I104-H153 HydrophobicContact CG2-CB 4.05Å; I104-F154 HydrophobicContact CD1-CD1 3.96Å; I104-F154 HydrophobicContact CD1-CD2 4.27Å; I104-F154 HydrophobicContact CD1-CE1 3.91Å; I104-F154 HydrophobicContact CD1-CE2 4.24Å; I104-F154 HydrophobicContact CD1-CG 4.12Å; I104-F154 HydrophobicContact CD1-CZ 4.05Å; I104-R157 HydrophobicContact CG1-CG 3.65Å; I104-R157 PolarHBondContact O-NH2 2.96Å
105	Y	91.1	Very high	90.3	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.008	22%	0.223	C	C	.	.	H	α-helix	trans	-103.6	-18.8	-162.1	-66	-58.4	0	0	0	115.9	E101 Y107 I116 R117 Y129 Y130 Y149	E101-Y105 HydrophobicContact CB-CD2 4.17Å; E101-Y105 HydrophobicContact CB-CE2 4.48Å; E101-Y105 VanDerWaalsContact O-CD2 3.25Å; E101-Y105 WeakPolarHBondContact O-CD2 3.1Å; E101-Y105 PolarHBondContact O-N 2.56Å; Y105-Y107 PolarHBondContact O-N 3.49Å; Y105-I116 HydrophobicContact CD1-CD1 3.88Å; Y105-I116 HydrophobicContact CD1-CG1 3.9Å; Y105-I116 HydrophobicContact CG-CG1 4.5Å; Y105-I116 WeakPolarHBondContact O-CG1 3.4Å; Y105-I116 PolarHBondContact O-N 3.06Å; Y105-I116 VanDerWaalsContact O-N 3.12Å; Y105-R117 HydrophobicContact CD1-CG 4.11Å; Y105-R117 HydrophobicContact CD2-CG 3.92Å; Y105-R117 HydrophobicContact CG-CG 3.67Å; Y105-Y129 HydrophobicContact CD1-CD1 4.23Å; Y105-Y129 HydrophobicContact CD1-CG 4.46Å; Y105-Y129 HydrophobicContact CE1-CD1 4.03Å; Y105-Y129 HydrophobicContact CE1-CG 4.33Å; Y105-Y130 PolarHBondContact OH-N 2.96Å; Y105-Y130 PolarHBondContact OH-O 2.82Å; Y105-Y149 WeakPolarHBondContact OH-CE1 3.13Å
106	I	90.5	Very high	89.9	Confident	38 Å²	38	39.7 Å²	39.7	20%	0.195	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	114.5	172.8	-62	-179.9	0	0	0	108.4	D102 R108 N113 F114	D102-I106 HydrophobicContact CB-CD1 3.62Å; D102-I106 HydrophobicContact CB-CG1 4.04Å; D102-I106 WeakPolarHBondContact O-CB 3.37Å; D102-I106 VanDerWaalsContact O-CG1 3.26Å; D102-I106 WeakPolarHBondContact O-CG1 3.28Å; D102-I106 PolarHBondContact O-N 3.12Å; I106-R108 HydrophobicContact CG2-CG 4.13Å; I106-R108 PolarHBondContact O-N 3.2Å; I106-R108 VanDerWaalsContact O-N 3.08Å; I106-N113 HydrophobicContact CG2-CB 3.93Å; I106-F114 CarbonylContact C-O 3.58Å; I106-F114 WeakPolarHBondContact CA-O 3.37Å
107	Y	86.5	Confident	89.7	Confident	23 Å²	23	41.3 Å²	41.3	9%	0.09	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	99	177.9	-167.7	-134	0	0	0	110.3	Y105 N109 V110 F114 T380 K413 I416	Y105-Y107 PolarHBondContact O-N 3.49Å; Y107-N109 VanDerWaalsContact C-N 3.35Å; Y107-N109 HydrophobicContact CD2-CB 4.34Å; Y107-N109 HydrophobicContact CE1-CB 4.35Å; Y107-N109 HydrophobicContact CE2-CB 3.78Å; Y107-V110 HydrophobicContact CD1-CB 4.27Å; Y107-V110 HydrophobicContact CD1-CG1 3.78Å; Y107-V110 HydrophobicContact CD1-CG2 3.53Å; Y107-V110 HydrophobicContact CE1-CB 4.45Å; Y107-V110 HydrophobicContact CE1-CG1 3.54Å; Y107-V110 HydrophobicContact CE1-CG2 4.18Å; Y107-V110 HydrophobicContact CG-CG2 4.28Å; Y107-V110 VanDerWaalsContact O-CG2 3.31Å; Y107-V110 WeakPolarHBondContact O-CG2 3.46Å; Y107-F114 AromaticContact CD1-CE1 3.89Å; Y107-F114 HydrophobicContact CD1-CE1 3.89Å; Y107-F114 HydrophobicContact CD1-CZ 4.27Å; Y107-F114 PolarHBondContact N-O 3.44Å; Y107-T380 HydrophobicContact CD1-CG2 4.32Å; Y107-T380 HydrophobicContact CE1-CG2 4.01Å; Y107-K413 WeakPolarHBondContact OH-CE 3.45Å; Y107-I416 HydrophobicContact CD2-CD1 4.33Å; Y107-I416 HydrophobicContact CE2-CD1 4.19Å
108	R	85.9	Confident	89.4	Confident	95 Å²	95	40.9 Å²	40.9	36%	0.358	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-6.3	-175	-62	173.9	-171.3	-104.4	9.1	114.4	D103 I106 V110 N113 K404 D410	D103-R108 IonicContact OD1-CZ 3.21Å; D103-R108 IonicContact OD1-NH2 2.74Å; D103-R108 PolarHBondContact OD1-NH2 3.37Å; I106-R108 HydrophobicContact CG2-CG 4.13Å; I106-R108 PolarHBondContact O-N 3.2Å; I106-R108 VanDerWaalsContact O-N 3.08Å; R108-V110 VanDerWaalsContact C-N 3.27Å; R108-V110 PolarHBondContact O-N 3.47Å; R108-N113 PolarHBondContact O-OD1 2.93Å; R108-K404 PolarHBondContact O-NZ 3.32Å; R108-D410 HydrophobicContact CB-CB 4.48Å
109	N	81.3	Confident	89.1	Confident	27 Å²	27	40.3 Å²	40.3	14%	0.144	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-4.5	-179.7	-73.9	-27.5	0	0	0	113.7	Y107 P384 A409 D410	Y107-N109 VanDerWaalsContact C-N 3.35Å; Y107-N109 HydrophobicContact CD2-CB 4.34Å; Y107-N109 HydrophobicContact CE1-CB 4.35Å; Y107-N109 HydrophobicContact CE2-CB 3.78Å; N109-P384 WeakPolarHBondContact O-CB 3.28Å; N109-P384 VanDerWaalsContact O-CG 3.26Å; N109-P384 WeakPolarHBondContact O-CG 3.38Å; N109-A409 WeakPolarHBondContact OD1-CA 3.09Å; N109-D410 PolarHBondContact OD1-N 3.1Å
110	V	80.7	Confident	89	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.012	21%	0.213	C	C	.	.	S	Bend	trans	-118.6	156.4	178.3	-73.9	0	0	0	0	111.1	Y107 R108 P112 N113 F114 R379 T380 P384	Y107-V110 HydrophobicContact CD1-CB 4.27Å; Y107-V110 HydrophobicContact CD1-CG1 3.78Å; Y107-V110 HydrophobicContact CD1-CG2 3.53Å; Y107-V110 HydrophobicContact CE1-CB 4.45Å; Y107-V110 HydrophobicContact CE1-CG1 3.54Å; Y107-V110 HydrophobicContact CE1-CG2 4.18Å; Y107-V110 HydrophobicContact CG-CG2 4.28Å; Y107-V110 VanDerWaalsContact O-CG2 3.31Å; Y107-V110 WeakPolarHBondContact O-CG2 3.46Å; R108-V110 VanDerWaalsContact C-N 3.27Å; R108-V110 PolarHBondContact O-N 3.47Å; V110-P112 CarbonylContact O-C 3.56Å; V110-N113 PolarHBondContact O-N 3Å; V110-N113 PolarHBondContact O-OD1 3.45Å; V110-F114 HydrophobicContact CG2-CD1 3.58Å; V110-F114 HydrophobicContact CG2-CE1 3.71Å; V110-R379 HydrophobicContact CB-CB 4.33Å; V110-R379 HydrophobicContact CG1-CB 4.24Å; V110-T380 HydrophobicContact CG1-CG2 4.06Å; V110-P384 HydrophobicContact CB-CB 4.48Å; V110-P384 HydrophobicContact CB-CG 4.44Å; V110-P384 HydrophobicContact CG1-CB 3.85Å; V110-P384 HydrophobicContact CG1-CG 3.38Å
111	E	79.2	Confident	88.9	Confident	80 Å²	80	45.7 Å²	45.7	37%	0.374	23%	0.228	S	C	.	.	S	Bend	trans	-123.6	121.3	175.2	-74.6	173	-171	0	0	109.5	F390 K391 K404	E111-F390 VanDerWaalsContact O-CD1 3.28Å; E111-F390 WeakPolarHBondContact O-CD1 3.25Å; E111-F390 WeakPolarHBondContact O-CG 3.42Å; E111-K391 WeakPolarHBondContact OE2-CE 3.34Å; E111-K391 IonicContact OE2-NZ 2.67Å; E111-K391 PolarHBondContact OE2-NZ 2.86Å; E111-K404 WeakPolarHBondContact OE1-CE 3.5Å; E111-K404 IonicContact OE1-NZ 2.85Å; E111-K404 PolarHBondContact OE1-NZ 2.78Å
112	P	85.7	Confident	88.9	Confident	78 Å²	78	48.6 Å²	48.6	51%	0.506	24%	0.243	S	C	.	.	S	Bend	cis	-70	149.8	-6.3	30.9	-35	0	0	0	112.4	V110	V110-P112 CarbonylContact O-C 3.56Å
113	N	89.1	Confident	88.8	Confident	75 Å²	75	45.8 Å²	45.8	40%	0.401	23%	0.228	S	C	.	.			trans	-55.3	151.5	171	-61.6	-8.8	0	0	0	110.2	I106 R108 V110	I106-N113 HydrophobicContact CG2-CB 3.93Å; R108-N113 PolarHBondContact O-OD1 2.93Å; V110-N113 PolarHBondContact O-N 3Å; V110-N113 PolarHBondContact O-OD1 3.45Å
114	F	90.2	Very high	88.8	Confident	14 Å²	14	45.9 Å²	45.9	6%	0.061	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	158.9	174	75.7	-90.3	0	0	0	112.6	I106 Y107 V110 I116 H119 D377 R379 T380	I106-F114 CarbonylContact C-O 3.58Å; I106-F114 WeakPolarHBondContact CA-O 3.37Å; Y107-F114 AromaticContact CD1-CE1 3.89Å; Y107-F114 HydrophobicContact CD1-CE1 3.89Å; Y107-F114 HydrophobicContact CD1-CZ 4.27Å; Y107-F114 PolarHBondContact N-O 3.44Å; V110-F114 HydrophobicContact CG2-CD1 3.58Å; V110-F114 HydrophobicContact CG2-CE1 3.71Å; F114-I116 HydrophobicContact CD2-CG2 4.46Å; F114-I116 HydrophobicContact CE2-CG2 3.84Å; F114-I116 HydrophobicContact CZ-CG2 4.26Å; F114-H119 AromaticContact CE2-CE1 3.6Å; F114-D377 HydrophobicContact CZ-CB 4.49Å; F114-R379 VanDerWaalsContact CB-CZ 3.43Å; F114-R379 VanDerWaalsContact CD1-CZ 3.42Å; F114-R379 VanDerWaalsContact CG-CZ 3.44Å; F114-R379 VanDerWaalsContact CG-NH2 3.28Å; F114-T380 HydrophobicContact CE1-CG2 3.88Å; F114-T380 HydrophobicContact CZ-CG2 4.03Å
115	D	91.9	Very high	88.6	Confident	52 Å²	52	51 Å²	51	28%	0.278	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	117	178.3	-174.9	-6.8	0	0	0	110.7	R117 C118	D115-R117 VanDerWaalsContact CG-NE 3.32Å; D115-R117 PolarHBondContact O-N 2.81Å; D115-R117 WeakPolarHBondContact OD1-CB 3.5Å; D115-R117 WeakPolarHBondContact OD1-CG 2.91Å; D115-R117 IonicContact OD1-CZ 3.43Å; D115-R117 PolarHBondContact OD1-N 3.19Å; D115-R117 IonicContact OD1-NE 3.21Å; D115-R117 PolarHBondContact OD1-NE 3.09Å; D115-R117 IonicContact OD1-NH2 3Å; D115-R117 IonicContact OD2-CZ 2.96Å; D115-R117 IonicContact OD2-NE 3.8Å; D115-R117 PolarHBondContact OD2-NE 2.88Å; D115-R117 IonicContact OD2-NH2 3.87Å; D115-R117 PolarHBondContact OD2-NH2 3.27Å; D115-C118 WeakPolarHBondContact O-CB 3.06Å; D115-C118 PolarHBondContact O-N 3.28Å; D115-C118 PolarHBondContact O-SG 2.76Å
116	I	90.3	Very high	88.3	Confident	5 Å²	5	55.9 Å²	55.9	3%	0.026	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-69.8	-19.1	-179.3	70.7	-168.6	0	0	0	112.9	Y105 F114 C118 H119 Y129 I416 W417	Y105-I116 HydrophobicContact CD1-CD1 3.88Å; Y105-I116 HydrophobicContact CD1-CG1 3.9Å; Y105-I116 HydrophobicContact CG-CG1 4.5Å; Y105-I116 WeakPolarHBondContact O-CG1 3.4Å; Y105-I116 PolarHBondContact O-N 3.06Å; Y105-I116 VanDerWaalsContact O-N 3.12Å; F114-I116 HydrophobicContact CD2-CG2 4.46Å; F114-I116 HydrophobicContact CE2-CG2 3.84Å; F114-I116 HydrophobicContact CZ-CG2 4.26Å; I116-C118 PolarHBondContact O-N 3.35Å; I116-C118 VanDerWaalsContact O-N 3.15Å; I116-H119 WeakPolarHBondContact O-CB 3.37Å; I116-H119 PolarHBondContact O-N 3.49Å; I116-H119 PolarHBondContact O-ND1 3.38Å; I116-Y129 HydrophobicContact CB-CE2 4.34Å; I116-Y129 HydrophobicContact CD1-CD1 3.9Å; I116-Y129 HydrophobicContact CD1-CE1 3.61Å; I116-Y129 HydrophobicContact CG1-CD1 3.96Å; I116-Y129 HydrophobicContact CG1-CD2 4.31Å; I116-Y129 HydrophobicContact CG1-CE1 3.86Å; I116-Y129 HydrophobicContact CG1-CE2 4.28Å; I116-Y129 HydrophobicContact CG1-CG 4.19Å; I116-Y129 WeakPolarHBondContact O-CD2 2.91Å; I116-Y129 VanDerWaalsContact O-CE2 3.26Å; I116-Y129 WeakPolarHBondContact O-CE2 3.43Å; I116-I416 HydrophobicContact CD1-CG2 4.34Å; I116-W417 HydrophobicContact CD1-CH2 3.98Å; I116-W417 HydrophobicContact CD1-CZ2 4.47Å
117	R	91.7	Very high	88.2	Confident	48 Å²	48	54.1 Å²	54.1	18%	0.181	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-62.4	-19.4	173.6	-62.2	173.4	-66.8	-166.4	0.1	111.8	D102 Y105 D115 H119 N120 T131	D102-R117 IonicContact OD1-CZ 3.78Å; D102-R117 IonicContact OD1-NH1 2.64Å; D102-R117 IonicContact OD1-NH2 3.33Å; D102-R117 PolarHBondContact OD1-NH2 2.89Å; Y105-R117 HydrophobicContact CD1-CG 4.11Å; Y105-R117 HydrophobicContact CD2-CG 3.92Å; Y105-R117 HydrophobicContact CG-CG 3.67Å; D115-R117 VanDerWaalsContact CG-NE 3.32Å; D115-R117 PolarHBondContact O-N 2.81Å; D115-R117 WeakPolarHBondContact OD1-CB 3.5Å; D115-R117 WeakPolarHBondContact OD1-CG 2.91Å; D115-R117 IonicContact OD1-CZ 3.43Å; D115-R117 PolarHBondContact OD1-N 3.19Å; D115-R117 IonicContact OD1-NE 3.21Å; D115-R117 PolarHBondContact OD1-NE 3.09Å; D115-R117 IonicContact OD1-NH2 3Å; D115-R117 IonicContact OD2-CZ 2.96Å; D115-R117 IonicContact OD2-NE 3.8Å; D115-R117 PolarHBondContact OD2-NE 2.88Å; D115-R117 IonicContact OD2-NH2 3.87Å; D115-R117 PolarHBondContact OD2-NH2 3.27Å; R117-H119 PolarHBondContact O-N 3.36Å; R117-H119 VanDerWaalsContact O-N 3.1Å; R117-N120 VanDerWaalsContact O-CB 3.23Å; R117-N120 WeakPolarHBondContact O-CB 3.41Å; R117-N120 PolarHBondContact O-N 2.86Å; R117-T131 HydrophobicContact CG-CG2 4.43Å
118	C	91.6	Very high	88.4	Confident	61 Å²	61	55.4 Å²	55.4	41%	0.412	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-56.8	-26	173.1	78.1	0	0	0	0	111.4	D115 I116 N120 F121	D115-C118 WeakPolarHBondContact O-CB 3.06Å; D115-C118 PolarHBondContact O-N 3.28Å; D115-C118 PolarHBondContact O-SG 2.76Å; I116-C118 PolarHBondContact O-N 3.35Å; I116-C118 VanDerWaalsContact O-N 3.15Å; C118-N120 VanDerWaalsContact C-N 3.28Å; C118-N120 PolarHBondContact O-N 2.9Å; C118-F121 WeakPolarHBondContact O-CD1 3.1Å; C118-F121 WeakPolarHBondContact O-CE1 3.5Å
119	H	89.9	Confident	88.5	Confident	13 Å²	13	50.9 Å²	50.9	6%	0.06	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-77.9	-6.5	177.4	-54	142.9	0	0	0	114.2	F114 I116 R117 F121 L122 L123 Y129 A373	F114-H119 AromaticContact CE2-CE1 3.6Å; I116-H119 WeakPolarHBondContact O-CB 3.37Å; I116-H119 PolarHBondContact O-N 3.49Å; I116-H119 PolarHBondContact O-ND1 3.38Å; R117-H119 PolarHBondContact O-N 3.36Å; R117-H119 VanDerWaalsContact O-N 3.1Å; H119-F121 PolarHBondContact O-N 3.48Å; H119-L122 WeakPolarHBondContact O-CB 3.34Å; H119-L122 PolarHBondContact O-N 3.04Å; H119-L123 HydrophobicContact CB-CD1 4.34Å; H119-L123 PolarHBondContact O-N 3.42Å; H119-Y129 HydrophobicContact CB-CE2 4.19Å; H119-A373 HydrophobicContact CB-CB 4.04Å
120	N	92.2	Very high	88.8	Confident	27 Å²	27	49.9 Å²	49.9	14%	0.144	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-57.5	-24.7	-177.3	-83.2	-10.8	0	0	0	113.5	R117 C118 L122 L123 K128 Y129	R117-N120 VanDerWaalsContact O-CB 3.23Å; R117-N120 WeakPolarHBondContact O-CB 3.41Å; R117-N120 PolarHBondContact O-N 2.86Å; C118-N120 VanDerWaalsContact C-N 3.28Å; C118-N120 PolarHBondContact O-N 2.9Å; N120-L122 VanDerWaalsContact C-N 3.29Å; N120-L122 PolarHBondContact O-N 3.45Å; N120-L123 PolarHBondContact O-N 3.5Å; N120-K128 HydrophobicContact CB-CG 4.29Å; N120-K128 VanDerWaalsContact O-CE 3.25Å; N120-K128 WeakPolarHBondContact O-CE 3.5Å; N120-Y129 PolarHBondContact ND2-O 3.33Å; N120-Y129 WeakPolarHBondContact OD1-CB 3.48Å; N120-Y129 VanDerWaalsContact OD1-CD2 3.23Å; N120-Y129 WeakPolarHBondContact OD1-CD2 3.24Å; N120-Y129 PolarHBondContact OD1-N 3.22Å
121	F	91.8	Very high	89.3	Confident	167 Å²	167	50.7 Å²	50.7	73%	0.732	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-71.9	-21	176	71.1	-95.5	0	0	0	113.7	C118 H119	C118-F121 WeakPolarHBondContact O-CD1 3.1Å; C118-F121 WeakPolarHBondContact O-CE1 3.5Å; H119-F121 PolarHBondContact O-N 3.48Å
122	L	92.1	Very high	90	Very high	93 Å²	93	47.6 Å²	47.6	49%	0.487	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-18.4	177.8	-62.9	173.7	0	0	0	112.6	H119 N120	H119-L122 WeakPolarHBondContact O-CB 3.34Å; H119-L122 PolarHBondContact O-N 3.04Å; N120-L122 VanDerWaalsContact C-N 3.29Å; N120-L122 PolarHBondContact O-N 3.45Å
123	L	91.8	Very high	90.3	Very high	10 Å²	10	48.6 Å²	48.6	5%	0.052	24%	0.242	C	C	.	.	S	Bend	trans	-99.9	138.5	-168.9	-62.9	169.7	0	0	0	110.8	H119 N120 A127 K128 Y129 L369 Q370 A373	H119-L123 HydrophobicContact CB-CD1 4.34Å; H119-L123 PolarHBondContact O-N 3.42Å; N120-L123 PolarHBondContact O-N 3.5Å; L123-A127 HydrophobicContact CB-CB 4.3Å; L123-A127 WeakPolarHBondContact CD1-O 3.37Å; L123-A127 HydrophobicContact CD2-CB 4.43Å; L123-K128 HydrophobicContact CB-CG 4.14Å; L123-K128 WeakPolarHBondContact O-CE 3.38Å; L123-Y129 HydrophobicContact CD1-CD2 4.05Å; L123-Y129 HydrophobicContact CD1-CE2 3.66Å; L123-L369 HydrophobicContact CD2-CB 3.84Å; L123-Q370 HydrophobicContact CD1-CG 3.96Å; L123-Q370 HydrophobicContact CD2-CG 4.36Å; L123-A373 HydrophobicContact CD2-CB 4.21Å
124	P	90.9	Very high	90.4	Very high	47 Å²	47	47.5 Å²	47.5	31%	0.305	24%	0.236	S	C	.	.			trans	-64.4	158.1	169.4	29.3	-35.3	0	0	0	110.5	Y126 A127 K128 L369	P124-Y126 HydrophobicContact CB-CD1 3.85Å; P124-Y126 HydrophobicContact CB-CE1 3.5Å; P124-Y126 HydrophobicContact CG-CD1 3.96Å; P124-Y126 HydrophobicContact CG-CE1 3.35Å; P124-Y126 HydrophobicContact CG-CE2 4.06Å; P124-Y126 VanDerWaalsContact CG-CZ 3.4Å; P124-Y126 PolarHBondContact O-N 3.38Å; P124-A127 HydrophobicContact CG-CB 3.92Å; P124-A127 CarbonylContact O-C 3.6Å; P124-A127 WeakPolarHBondContact O-CA 3.26Å; P124-A127 PolarHBondContact O-N 2.94Å; P124-K128 PolarHBondContact O-N 2.98Å; P124-L369 HydrophobicContact CG-CD1 3.72Å
125	D	86.5	Confident	90.5	Very high	114 Å²	114	47.1 Å²	47.1	61%	0.61	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-53.2	-36.6	-171.5	-70.6	-23	0	0	0	114.5	A127 K128	D125-A127 VanDerWaalsContact C-N 3.28Å; D125-A127 PolarHBondContact O-N 3.48Å; D125-K128 VanDerWaalsContact OD1-CE 3.31Å; D125-K128 WeakPolarHBondContact OD1-CE 3.32Å; D125-K128 IonicContact OD1-NZ 3.76Å; D125-K128 PolarHBondContact OD1-NZ 2.97Å
126	Y	85.5	Confident	90.6	Very high	105 Å²	105	45.7 Å²	45.7	41%	0.412	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-70.1	-23.8	178.7	67.9	-98	0	0	0	113.4	P124 K146 A366 L369	P124-Y126 HydrophobicContact CB-CD1 3.85Å; P124-Y126 HydrophobicContact CB-CE1 3.5Å; P124-Y126 HydrophobicContact CG-CD1 3.96Å; P124-Y126 HydrophobicContact CG-CE1 3.35Å; P124-Y126 HydrophobicContact CG-CE2 4.06Å; P124-Y126 VanDerWaalsContact CG-CZ 3.4Å; P124-Y126 PolarHBondContact O-N 3.38Å; Y126-K146 WeakPolarHBondContact O-CE 3.37Å; Y126-K146 PolarHBondContact O-NZ 3.05Å; Y126-A366 HydrophobicContact CD2-CB 3.74Å; Y126-A366 HydrophobicContact CE2-CB 3.74Å; Y126-L369 HydrophobicContact CE2-CD1 4.44Å; Y126-L369 WeakPolarHBondContact OH-CD1 3.48Å
127	A	87.7	Confident	90.7	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-102.4	-2.5	-178.2	0	0	0	0	0	113.5	L123 P124 D125 A366 L369 Q370	L123-A127 HydrophobicContact CB-CB 4.3Å; L123-A127 WeakPolarHBondContact CD1-O 3.37Å; L123-A127 HydrophobicContact CD2-CB 4.43Å; P124-A127 HydrophobicContact CG-CB 3.92Å; P124-A127 CarbonylContact O-C 3.6Å; P124-A127 WeakPolarHBondContact O-CA 3.26Å; P124-A127 PolarHBondContact O-N 2.94Å; D125-A127 VanDerWaalsContact C-N 3.28Å; D125-A127 PolarHBondContact O-N 3.48Å; A127-A366 HydrophobicContact CB-CB 3.76Å; A127-L369 HydrophobicContact CB-CD1 4.46Å; A127-Q370 WeakPolarHBondContact O-CG 3.32Å; A127-Q370 PolarHBondContact O-NE2 3.04Å
128	K	89.7	Confident	90.6	Very high	51 Å²	51	46.9 Å²	46.9	22%	0.222	23%	0.234	C	C	.	.	S	Bend	trans	-65.5	146.3	177.4	-72.9	177.6	-177.2	170.1	0	111.9	N120 L123 P124 D125 Y130 M134	N120-K128 HydrophobicContact CB-CG 4.29Å; N120-K128 VanDerWaalsContact O-CE 3.25Å; N120-K128 WeakPolarHBondContact O-CE 3.5Å; L123-K128 HydrophobicContact CB-CG 4.14Å; L123-K128 WeakPolarHBondContact O-CE 3.38Å; P124-K128 PolarHBondContact O-N 2.98Å; D125-K128 VanDerWaalsContact OD1-CE 3.31Å; D125-K128 WeakPolarHBondContact OD1-CE 3.32Å; D125-K128 IonicContact OD1-NZ 3.76Å; D125-K128 PolarHBondContact OD1-NZ 2.97Å; K128-Y130 PolarHBondContact O-N 3.33Å; K128-M134 HydrophobicContact CB-CE 4.32Å; K128-M134 HydrophobicContact CD-CE 4.27Å
129	Y	89.2	Confident	90.5	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-66.4	116.6	166.7	-60.7	-76.3	0	0	0	109.2	Y105 I116 H119 N120 L123 T131 Q370 W417	Y105-Y129 HydrophobicContact CD1-CD1 4.23Å; Y105-Y129 HydrophobicContact CD1-CG 4.46Å; Y105-Y129 HydrophobicContact CE1-CD1 4.03Å; Y105-Y129 HydrophobicContact CE1-CG 4.33Å; I116-Y129 HydrophobicContact CB-CE2 4.34Å; I116-Y129 HydrophobicContact CD1-CD1 3.9Å; I116-Y129 HydrophobicContact CD1-CE1 3.61Å; I116-Y129 HydrophobicContact CG1-CD1 3.96Å; I116-Y129 HydrophobicContact CG1-CD2 4.31Å; I116-Y129 HydrophobicContact CG1-CE1 3.86Å; I116-Y129 HydrophobicContact CG1-CE2 4.28Å; I116-Y129 HydrophobicContact CG1-CG 4.19Å; I116-Y129 WeakPolarHBondContact O-CD2 2.91Å; I116-Y129 VanDerWaalsContact O-CE2 3.26Å; I116-Y129 WeakPolarHBondContact O-CE2 3.43Å; H119-Y129 HydrophobicContact CB-CE2 4.19Å; N120-Y129 PolarHBondContact ND2-O 3.33Å; N120-Y129 WeakPolarHBondContact OD1-CB 3.48Å; N120-Y129 VanDerWaalsContact OD1-CD2 3.23Å; N120-Y129 WeakPolarHBondContact OD1-CD2 3.24Å; N120-Y129 PolarHBondContact OD1-N 3.22Å; L123-Y129 HydrophobicContact CD1-CD2 4.05Å; L123-Y129 HydrophobicContact CD1-CE2 3.66Å; Y129-T131 PolarHBondContact O-N 3.09Å; Y129-Q370 HydrophobicContact CE1-CG 4.37Å; Y129-W417 HydrophobicContact CE1-CE3 4.5Å; Y129-W417 AromaticContact CE1-CH2 3.44Å; Y129-W417 HydrophobicContact CE1-CH2 3.44Å; Y129-W417 VanDerWaalsContact CE1-CH2 3.44Å; Y129-W417 AromaticContact CE1-CZ3 3.31Å; Y129-W417 HydrophobicContact CE1-CZ3 3.31Å; Y129-W417 AromaticContact CZ-CH2 3.66Å; Y129-W417 AromaticContact CZ-CZ3 3.63Å; Y129-W417 WeakPolarHBondContact OH-CH2 3.25Å; Y129-W417 WeakPolarHBondContact OH-CZ3 3.43Å
130	Y	88	Confident	90.4	Very high	5 Å²	5	50 Å²	50	2%	0.02	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-83.2	116.6	-167.4	-151.9	-111.1	0	0	0	112.2	Y105 K128 M134 F135 E138 L141 K146	Y105-Y130 PolarHBondContact OH-N 2.96Å; Y105-Y130 PolarHBondContact OH-O 2.82Å; K128-Y130 PolarHBondContact O-N 3.33Å; Y130-M134 HydrophobicContact CD2-CB 4.03Å; Y130-M134 HydrophobicContact CD2-CE 3.96Å; Y130-M134 HydrophobicContact CD2-SD 4.15Å; Y130-M134 HydrophobicContact CE1-CB 4.32Å; Y130-M134 HydrophobicContact CE2-CB 3.75Å; Y130-M134 HydrophobicContact CE2-CE 4.05Å; Y130-M134 HydrophobicContact CG-CB 4.41Å; Y130-F135 HydrophobicContact CD1-CB 4.2Å; Y130-F135 HydrophobicContact CE1-CB 3.71Å; Y130-F135 HydrophobicContact CE1-CD2 4.25Å; Y130-E138 WeakPolarHBondContact OH-CB 3.15Å; Y130-E138 VanDerWaalsContact OH-CG 3.26Å; Y130-E138 WeakPolarHBondContact OH-CG 3.22Å; Y130-L141 HydrophobicContact CE1-CD2 4.24Å; Y130-K146 HydrophobicContact CD1-CB 3.78Å; Y130-K146 HydrophobicContact CD2-CB 3.91Å; Y130-K146 HydrophobicContact CD2-CD 4.26Å; Y130-K146 HydrophobicContact CD2-CG 3.8Å; Y130-K146 HydrophobicContact CE1-CB 3.55Å; Y130-K146 HydrophobicContact CE1-CG 4.47Å; Y130-K146 HydrophobicContact CE2-CB 3.72Å; Y130-K146 HydrophobicContact CE2-CG 3.77Å; Y130-K146 HydrophobicContact CG-CB 3.94Å; Y130-K146 HydrophobicContact CG-CD 4.42Å; Y130-K146 HydrophobicContact CG-CG 4.19Å
131	T	91.6	Very high	90.1	Very high	19 Å²	19	49 Å²	49	12%	0.117	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-92.7	165.8	-177.6	62.4	0	0	0	0	112.7	E101 R117 Y129 E133 M134 F135	E101-T131 WeakPolarHBondContact OE1-CA 3.44Å; E101-T131 WeakPolarHBondContact OE1-CB 3.39Å; R117-T131 HydrophobicContact CG-CG2 4.43Å; Y129-T131 PolarHBondContact O-N 3.09Å; T131-E133 PolarHBondContact O-N 2.96Å; T131-M134 PolarHBondContact O-N 3.43Å; T131-M134 VanDerWaalsContact O-N 3.17Å; T131-M134 WeakPolarHBondContact OG1-CG 3.47Å; T131-M134 PolarHBondContact OG1-N 3Å; T131-F135 PolarHBondContact O-N 3.26Å
132	C	92.6	Very high	89.9	Confident	16 Å²	16	43.4 Å²	43.4	11%	0.108	22%	0.223	C	C	.	.	H	α-helix	trans	-56.7	-40.7	170.3	-69.8	0	0	0	0	111	E101 M134 F135 W136 W244	E101-C132 VanDerWaalsContact CD-N 3.3Å; E101-C132 HydrophobicContact CG-CB 4.4Å; E101-C132 WeakPolarHBondContact CG-SG 3.33Å; E101-C132 PolarHBondContact OE1-N 2.68Å; E101-C132 WeakPolarHBondContact OE2-CB 3.46Å; E101-C132 PolarHBondContact OE2-SG 2.75Å; C132-M134 VanDerWaalsContact C-N 3.31Å; C132-M134 PolarHBondContact O-N 3.09Å; C132-F135 PolarHBondContact O-N 2.86Å; C132-W136 PolarHBondContact O-N 3.42Å; C132-W244 HydrophobicContact CB-CH2 4.05Å; C132-W244 HydrophobicContact CB-CZ3 4.38Å
133	E	92.3	Very high	89.5	Confident	99 Å²	99	44.9 Å²	44.9	46%	0.463	23%	0.231	S	C	.	.	H	α-helix	trans	-57.7	-44.6	176.1	171.5	170.7	-154.7	0	0	111.7	T131 N137 W244	T131-E133 PolarHBondContact O-N 2.96Å; E133-N137 WeakPolarHBondContact O-CB 3.34Å; E133-N137 PolarHBondContact O-N 3.41Å; E133-N137 PolarHBondContact O-ND2 2.98Å; E133-W244 HydrophobicContact CB-CB 4.27Å; E133-W244 HydrophobicContact CB-CD2 3.89Å; E133-W244 HydrophobicContact CB-CE3 4.37Å; E133-W244 HydrophobicContact CB-CG 3.82Å; E133-W244 HydrophobicContact CG-CB 3.68Å; E133-W244 HydrophobicContact CG-CD2 4.3Å; E133-W244 HydrophobicContact CG-CG 3.73Å
134	M	91.9	Very high	89.1	Confident	52 Å²	52	49.8 Å²	49.8	26%	0.256	25%	0.252	S	S	.	.	H	α-helix	trans	-65.4	-46.5	176.3	-65.8	173.9	83	0	0	110.7	K128 Y130 T131 C132 W136 N137 E138	K128-M134 HydrophobicContact CB-CE 4.32Å; K128-M134 HydrophobicContact CD-CE 4.27Å; Y130-M134 HydrophobicContact CD2-CB 4.03Å; Y130-M134 HydrophobicContact CD2-CE 3.96Å; Y130-M134 HydrophobicContact CD2-SD 4.15Å; Y130-M134 HydrophobicContact CE1-CB 4.32Å; Y130-M134 HydrophobicContact CE2-CB 3.75Å; Y130-M134 HydrophobicContact CE2-CE 4.05Å; Y130-M134 HydrophobicContact CG-CB 4.41Å; T131-M134 PolarHBondContact O-N 3.43Å; T131-M134 VanDerWaalsContact O-N 3.17Å; T131-M134 WeakPolarHBondContact OG1-CG 3.47Å; T131-M134 PolarHBondContact OG1-N 3Å; C132-M134 VanDerWaalsContact C-N 3.31Å; C132-M134 PolarHBondContact O-N 3.09Å; M134-W136 PolarHBondContact O-N 3.46Å; M134-N137 PolarHBondContact O-N 3.29Å; M134-E138 VanDerWaalsContact O-CB 3.28Å; M134-E138 WeakPolarHBondContact O-CB 3.33Å; M134-E138 PolarHBondContact O-N 2.82Å
135	F	92	Very high	88.5	Confident	5 Å²	5	47.9 Å²	47.9	2%	0.022	24%	0.241	C	C	.	.	H	α-helix	trans	-58.9	-47.6	-179.4	174.6	-94.6	0	0	0	113.2	Y130 T131 C132 N137 L141 L150 M192 N250	Y130-F135 HydrophobicContact CD1-CB 4.2Å; Y130-F135 HydrophobicContact CE1-CB 3.71Å; Y130-F135 HydrophobicContact CE1-CD2 4.25Å; T131-F135 PolarHBondContact O-N 3.26Å; C132-F135 PolarHBondContact O-N 2.86Å; F135-N137 VanDerWaalsContact C-N 3.26Å; F135-N137 PolarHBondContact O-N 3.47Å; F135-L141 HydrophobicContact CD2-CD1 4.2Å; F135-L141 HydrophobicContact CD2-CD2 3.68Å; F135-L141 HydrophobicContact CE2-CD1 3.87Å; F135-L141 HydrophobicContact CE2-CD2 4.06Å; F135-L141 HydrophobicContact CG-CD2 4.4Å; F135-L141 HydrophobicContact CZ-CD1 4.23Å; F135-L150 HydrophobicContact CB-CD2 3.64Å; F135-L150 HydrophobicContact CD1-CD2 4.44Å; F135-L150 HydrophobicContact CD2-CD2 4.4Å; F135-L150 HydrophobicContact CG-CD2 3.93Å; F135-M192 HydrophobicContact CE2-CE 3.63Å; F135-M192 HydrophobicContact CZ-CE 3.69Å; F135-M192 HydrophobicContact CZ-CG 4.5Å; F135-M192 HydrophobicContact CZ-SD 4.21Å; F135-N250 PolarHBondContact O-ND2 2.68Å
136	W	93	Very high	88.2	Confident	23 Å²	23	43.2 Å²	43.2	9%	0.087	22%	0.215	C	C	.	.	H	α-helix	trans	-73.9	-16.4	-176.1	-70.4	120	0	0	0	113.9	I76 C132 M134 F188 W244 A248 R249 N250 L251 F255	I76-W136 HydrophobicContact CD1-CH2 4.09Å; I76-W136 HydrophobicContact CD1-CZ2 4.03Å; C132-W136 PolarHBondContact O-N 3.42Å; M134-W136 PolarHBondContact O-N 3.46Å; W136-F188 AromaticContact CH2-CZ 3.99Å; W136-F188 HydrophobicContact CH2-CZ 3.99Å; W136-F188 HydrophobicContact CZ2-CZ 4.12Å; W136-W244 AromaticContact CD1-CZ3 3.72Å; W136-A248 HydrophobicContact CB-CB 3.87Å; W136-R249 PolarHBondContact O-N 3.4Å; W136-R249 VanDerWaalsContact O-N 3.12Å; W136-N250 HydrophobicContact CE3-CB 4.07Å; W136-N250 WeakPolarHBondContact O-CB 3.37Å; W136-N250 PolarHBondContact O-N 2.74Å; W136-L251 HydrophobicContact CD2-CB 4.31Å; W136-L251 HydrophobicContact CE3-CB 3.84Å; W136-L251 HydrophobicContact CE3-CD1 4.2Å; W136-L251 HydrophobicContact CH2-CD1 3.88Å; W136-L251 HydrophobicContact CZ2-CD1 4.25Å; W136-L251 HydrophobicContact CZ3-CB 4.21Å; W136-L251 HydrophobicContact CZ3-CD1 3.84Å; W136-F255 HydrophobicContact CH2-CD1 4.08Å; W136-F255 AromaticContact CH2-CE1 3.55Å; W136-F255 HydrophobicContact CH2-CE1 3.55Å; W136-F255 AromaticContact CH2-CZ 3.93Å; W136-F255 HydrophobicContact CH2-CZ 3.93Å; W136-F255 HydrophobicContact CZ3-CD1 4.14Å; W136-F255 HydrophobicContact CZ3-CE1 4.04Å; W136-F255 HydrophobicContact CZ3-CZ 4.44Å
137	N	92.4	Very high	88	Confident	58 Å²	58	38.2 Å²	38.2	31%	0.31	20%	0.196	S	C	.	.	H	α-helix	trans	-111.2	-4.5	-178.3	-68.7	-57.7	0	0	0	114.1	E133 M134 F135 P139 W244 A248 R249	E133-N137 WeakPolarHBondContact O-CB 3.34Å; E133-N137 PolarHBondContact O-N 3.41Å; E133-N137 PolarHBondContact O-ND2 2.98Å; M134-N137 PolarHBondContact O-N 3.29Å; F135-N137 VanDerWaalsContact C-N 3.26Å; F135-N137 PolarHBondContact O-N 3.47Å; N137-P139 WeakPolarHBondContact O-CD 3.45Å; N137-W244 PolarHBondContact ND2-O 3.42Å; N137-A248 WeakPolarHBondContact OD1-CA 3.35Å; N137-R249 PolarHBondContact OD1-N 3.16Å
138	E	90	Very high	88	Confident	19 Å²	19	38.2 Å²	38.2	9%	0.089	20%	0.196	C	C	.	.			trans	-69.8	121.4	-178.2	-178.7	58.3	-118.6	0	0	111.9	Y130 M134 D140 L141 K144 N250	Y130-E138 WeakPolarHBondContact OH-CB 3.15Å; Y130-E138 VanDerWaalsContact OH-CG 3.26Å; Y130-E138 WeakPolarHBondContact OH-CG 3.22Å; M134-E138 VanDerWaalsContact O-CB 3.28Å; M134-E138 WeakPolarHBondContact O-CB 3.33Å; M134-E138 PolarHBondContact O-N 2.82Å; E138-D140 VanDerWaalsContact C-N 3.29Å; E138-D140 PolarHBondContact O-N 2.99Å; E138-L141 HydrophobicContact CB-CD2 3.73Å; E138-L141 HydrophobicContact CB-CG 4.07Å; E138-L141 HydrophobicContact CG-CD2 3.9Å; E138-L141 HydrophobicContact CG-CG 4.15Å; E138-K144 HydrophobicContact CG-CD 4.2Å; E138-K144 WeakPolarHBondContact OE1-CD 3.47Å; E138-K144 WeakPolarHBondContact OE1-CE 3.24Å; E138-K144 IonicContact OE1-NZ 2.77Å; E138-K144 PolarHBondContact OE1-NZ 3Å; E138-K144 WeakPolarHBondContact OE2-CD 3.34Å; E138-K144 IonicContact OE2-NZ 2.79Å; E138-K144 PolarHBondContact OE2-NZ 3Å; E138-N250 PolarHBondContact O-ND2 3.19Å
139	P	89.1	Confident	88	Confident	79 Å²	79	36 Å²	36	51%	0.513	19%	0.186	S	C	.	.	S	Bend	trans	-62.9	-30.6	177	22.5	-36.3	0	0	0	114.9	N137	N137-P139 WeakPolarHBondContact O-CD 3.45Å
140	D	87.2	Confident	88	Confident	62 Å²	62	36.3 Å²	36.3	33%	0.332	19%	0.188	S	C	.	.			trans	-140	83	-172.8	-168.8	-9.6	0	0	0	111.8	E138 N143 K144	E138-D140 VanDerWaalsContact C-N 3.29Å; E138-D140 PolarHBondContact O-N 2.99Å; D140-N143 WeakPolarHBondContact OD1-CB 3.49Å; D140-N143 PolarHBondContact OD1-N 3.4Å; D140-N143 PolarHBondContact OD1-ND2 2.86Å; D140-N143 WeakPolarHBondContact OD2-CB 3.07Å; D140-N143 PolarHBondContact OD2-ND2 3.28Å; D140-K144 WeakPolarHBondContact O-CB 3.3Å; D140-K144 WeakPolarHBondContact O-CG 3.28Å; D140-K144 PolarHBondContact O-N 2.82Å
141	L	87.4	Confident	88.2	Confident	6 Å²	6	36.4 Å²	36.4	3%	0.031	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-32.7	-177.7	-76.3	168.8	0	0	0	113.3	Y130 F135 E138 G145 K146 G147 Y197	Y130-L141 HydrophobicContact CE1-CD2 4.24Å; F135-L141 HydrophobicContact CD2-CD1 4.2Å; F135-L141 HydrophobicContact CD2-CD2 3.68Å; F135-L141 HydrophobicContact CE2-CD1 3.87Å; F135-L141 HydrophobicContact CE2-CD2 4.06Å; F135-L141 HydrophobicContact CG-CD2 4.4Å; F135-L141 HydrophobicContact CZ-CD1 4.23Å; E138-L141 HydrophobicContact CB-CD2 3.73Å; E138-L141 HydrophobicContact CB-CG 4.07Å; E138-L141 HydrophobicContact CG-CD2 3.9Å; E138-L141 HydrophobicContact CG-CG 4.15Å; L141-G145 PolarHBondContact O-N 3.35Å; L141-K146 PolarHBondContact O-N 3.32Å; L141-G147 PolarHBondContact O-N 3.44Å; L141-Y197 HydrophobicContact CD1-CD1 3.97Å; L141-Y197 HydrophobicContact CD1-CD2 4.49Å; L141-Y197 HydrophobicContact CD1-CG 3.8Å
142	I	86.6	Confident	88.2	Confident	48 Å²	48	35.7 Å²	35.7	25%	0.246	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-54.5	-175.6	-63.5	178.1	0	0	0	109.7	K144 G145 N196	I142-K144 VanDerWaalsContact C-N 3.27Å; I142-K144 PolarHBondContact O-N 3Å; I142-G145 PolarHBondContact O-N 3.46Å; I142-N196 VanDerWaalsContact CD1-O 3.24Å; I142-N196 WeakPolarHBondContact CD1-O 3.31Å
143	N	84.9	Confident	88.1	Confident	124 Å²	124	35.2 Å²	35.2	66%	0.663	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-27.4	-175.2	-67.7	-38.8	0	0	0	112.6	D140 G145	D140-N143 WeakPolarHBondContact OD1-CB 3.49Å; D140-N143 PolarHBondContact OD1-N 3.4Å; D140-N143 PolarHBondContact OD1-ND2 2.86Å; D140-N143 WeakPolarHBondContact OD2-CB 3.07Å; D140-N143 PolarHBondContact OD2-ND2 3.28Å; N143-G145 VanDerWaalsContact C-N 3.28Å
144	K	83.1	Confident	88.2	Confident	114 Å²	114	31.6 Å²	31.6	50%	0.496	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-11	172.3	-69.5	-167.2	-175.7	177.5	0	113.9	E138 D140 I142 K146	E138-K144 HydrophobicContact CG-CD 4.2Å; E138-K144 WeakPolarHBondContact OE1-CD 3.47Å; E138-K144 WeakPolarHBondContact OE1-CE 3.24Å; E138-K144 IonicContact OE1-NZ 2.77Å; E138-K144 PolarHBondContact OE1-NZ 3Å; E138-K144 WeakPolarHBondContact OE2-CD 3.34Å; E138-K144 IonicContact OE2-NZ 2.79Å; E138-K144 PolarHBondContact OE2-NZ 3Å; D140-K144 WeakPolarHBondContact O-CB 3.3Å; D140-K144 WeakPolarHBondContact O-CG 3.28Å; D140-K144 PolarHBondContact O-N 2.82Å; I142-K144 VanDerWaalsContact C-N 3.27Å; I142-K144 PolarHBondContact O-N 3Å; K144-K146 HydrophobicContact CB-CG 4.43Å; K144-K146 WeakPolarHBondContact O-CG 3.38Å; K144-K146 PolarHBondContact O-N 3.46Å
145	G	77.2	Confident	88.4	Confident	6 Å²	6	29.2 Å²	29.2	6%	0.062	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.5	12.6	177.6	0	0	0	0	0	115.2	L141 I142 N143 N358 E359 L360	L141-G145 PolarHBondContact O-N 3.35Å; I142-G145 PolarHBondContact O-N 3.46Å; N143-G145 VanDerWaalsContact C-N 3.28Å; G145-N358 WeakPolarHBondContact CA-O 3.42Å; G145-E359 WeakPolarHBondContact O-CA 3.35Å; G145-L360 PolarHBondContact O-N 3.23Å
146	K	80.2	Confident	88.5	Confident	17 Å²	17	29 Å²	29	7%	0.074	15%	0.149	C	C	.	.			trans	-100.3	-11.4	-172.6	-61.4	-58.6	-176.1	179.6	0	114.2	Y126 Y130 L141 K144 L148 Y149 Y362	Y126-K146 WeakPolarHBondContact O-CE 3.37Å; Y126-K146 PolarHBondContact O-NZ 3.05Å; Y130-K146 HydrophobicContact CD1-CB 3.78Å; Y130-K146 HydrophobicContact CD2-CB 3.91Å; Y130-K146 HydrophobicContact CD2-CD 4.26Å; Y130-K146 HydrophobicContact CD2-CG 3.8Å; Y130-K146 HydrophobicContact CE1-CB 3.55Å; Y130-K146 HydrophobicContact CE1-CG 4.47Å; Y130-K146 HydrophobicContact CE2-CB 3.72Å; Y130-K146 HydrophobicContact CE2-CG 3.77Å; Y130-K146 HydrophobicContact CG-CB 3.94Å; Y130-K146 HydrophobicContact CG-CD 4.42Å; Y130-K146 HydrophobicContact CG-CG 4.19Å; L141-K146 PolarHBondContact O-N 3.32Å; K144-K146 HydrophobicContact CB-CG 4.43Å; K144-K146 WeakPolarHBondContact O-CG 3.38Å; K144-K146 PolarHBondContact O-N 3.46Å; K146-L148 PolarHBondContact O-N 3.2Å; K146-Y149 WeakPolarHBondContact O-CB 3.49Å; K146-Y149 PolarHBondContact O-N 2.91Å; K146-Y362 PolarHBondContact NZ-OH 3.16Å
147	G	81.6	Confident	88.5	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-55.4	-53.7	177.8	0	0	0	0	0	112.1	L141 Y149 M192	L141-G147 PolarHBondContact O-N 3.44Å; G147-Y149 VanDerWaalsContact C-N 3.32Å; G147-Y149 PolarHBondContact O-N 3.24Å; G147-M192 WeakPolarHBondContact O-CE 3.42Å
148	L	88.9	Confident	88.7	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-71.5	-25.4	-178.6	-168.7	54.6	0	0	0	113.8	K146 Q151 Y152 L198 W205 F206 M357 E359 L360	K146-L148 PolarHBondContact O-N 3.2Å; L148-Q151 PolarHBondContact O-N 2.93Å; L148-Y152 WeakPolarHBondContact O-CB 3.37Å; L148-Y152 PolarHBondContact O-N 3.46Å; L148-L198 HydrophobicContact CB-CD1 3.69Å; L148-L198 HydrophobicContact CD1-CD1 4Å; L148-L198 HydrophobicContact CD1-CD2 4.31Å; L148-L198 HydrophobicContact CD2-CD1 4.28Å; L148-L198 HydrophobicContact CG-CD1 4.19Å; L148-W205 HydrophobicContact CD2-CE3 3.75Å; L148-W205 HydrophobicContact CD2-CZ3 3.98Å; L148-W205 HydrophobicContact CG-CZ3 4.39Å; L148-F206 HydrophobicContact CD1-CB 3.99Å; L148-F206 HydrophobicContact CD1-CD2 3.78Å; L148-F206 HydrophobicContact CD1-CG 4.13Å; L148-M357 HydrophobicContact CD2-CE 3.92Å; L148-M357 HydrophobicContact CD2-SD 4.21Å; L148-E359 HydrophobicContact CB-CB 3.82Å; L148-E359 HydrophobicContact CD2-CB 4.14Å; L148-L360 HydrophobicContact CB-CG 4.04Å; L148-L360 HydrophobicContact CD2-CD1 3.41Å; L148-L360 VanDerWaalsContact CD2-CD1 3.41Å; L148-L360 HydrophobicContact CD2-CG 3.73Å; L148-L360 HydrophobicContact CG-CD1 3.62Å; L148-L360 HydrophobicContact CG-CD2 4.26Å; L148-L360 HydrophobicContact CG-CG 3.67Å
149	Y	88.2	Confident	88.9	Confident	5 Å²	5	25.5 Å²	25.5	2%	0.02	13%	0.131	C	C	.	.	H	α-helix	trans	-58.4	-57.3	-177.2	173.3	-97.1	0	0	0	112.3	Y105 K146 G147 Q151 Y152 H153 Y362	Y105-Y149 WeakPolarHBondContact OH-CE1 3.13Å; K146-Y149 WeakPolarHBondContact O-CB 3.49Å; K146-Y149 PolarHBondContact O-N 2.91Å; G147-Y149 VanDerWaalsContact C-N 3.32Å; G147-Y149 PolarHBondContact O-N 3.24Å; Y149-Q151 VanDerWaalsContact C-N 3.3Å; Y149-Q151 PolarHBondContact O-N 3Å; Y149-Y152 PolarHBondContact O-N 3.25Å; Y149-H153 AromaticContact CD2-CD2 3.64Å; Y149-H153 AromaticContact CD2-NE2 3.63Å; Y149-H153 AromaticContact CE1-CD2 3.74Å; Y149-H153 AromaticContact CE2-CD2 3.24Å; Y149-H153 WeakPolarHBondContact CE2-CD2 3.35Å; Y149-H153 AromaticContact CE2-NE2 2.91Å; Y149-H153 WeakPolarHBondContact CE2-NE2 3.12Å; Y149-H153 AromaticContact CZ-CD2 3.3Å; Y149-H153 AromaticContact CZ-NE2 3.23Å; Y149-H153 PolarHBondContact O-CD2 3.18Å; Y149-H153 VanDerWaalsContact O-CD2 3.25Å; Y149-H153 PolarHBondContact O-N 3.37Å; Y149-H153 PolarHBondContact OH-NE2 2.64Å; Y149-Y362 AromaticContact CD2-CE2 3.42Å; Y149-Y362 HydrophobicContact CD2-CE2 3.42Å; Y149-Y362 VanDerWaalsContact CD2-CE2 3.42Å; Y149-Y362 AromaticContact CD2-CZ 3.94Å; Y149-Y362 WeakPolarHBondContact CE1-OH 3.33Å; Y149-Y362 HydrophobicContact CE2-CD2 4.36Å; Y149-Y362 AromaticContact CE2-CE2 3.15Å; Y149-Y362 HydrophobicContact CE2-CE2 3.15Å; Y149-Y362 AromaticContact CE2-CZ 3.51Å; Y149-Y362 WeakPolarHBondContact CE2-OH 3.42Å; Y149-Y362 HydrophobicContact CG-CE2 4.43Å; Y149-Y362 AromaticContact CZ-CZ 3.9Å; Y149-Y362 PolarHBondContact OH-OH 2.71Å
150	L	89.3	Confident	89.2	Confident	6 Å²	6	22.8 Å²	22.8	3%	0.031	11%	0.111	C	C	.	.	H	α-helix	trans	-64.6	-39.5	-178	-173.6	62.4	0	0	0	110.9	I104 F135 Y152 H153 F154	I104-L150 HydrophobicContact CD1-CD1 4.33Å; F135-L150 HydrophobicContact CB-CD2 3.64Å; F135-L150 HydrophobicContact CD1-CD2 4.44Å; F135-L150 HydrophobicContact CD2-CD2 4.4Å; F135-L150 HydrophobicContact CG-CD2 3.93Å; L150-Y152 PolarHBondContact O-N 3.05Å; L150-H153 PolarHBondContact O-N 3.28Å; L150-F154 HydrophobicContact CD1-CD2 3.99Å; L150-F154 HydrophobicContact CD1-CE2 3.59Å; L150-F154 HydrophobicContact CD1-CZ 4.46Å; L150-F154 HydrophobicContact CD2-CE2 4.05Å; L150-F154 HydrophobicContact CG-CD2 3.81Å; L150-F154 HydrophobicContact CG-CE2 3.6Å; L150-F154 VanDerWaalsContact O-CD2 3.28Å; L150-F154 WeakPolarHBondContact O-CD2 3.35Å; L150-F154 PolarHBondContact O-N 3.4Å
151	Q	92.1	Very high	89.5	Confident	6 Å²	6	20.7 Å²	20.7	3%	0.028	10%	0.1	C	C	.	.	H	α-helix	trans	-60.6	-43.5	176.9	178.7	53.4	20.6	0	0	112.1	L148 Y149 F154 Y155 E185 F188 M192 F206	L148-Q151 PolarHBondContact O-N 2.93Å; Y149-Q151 VanDerWaalsContact C-N 3.3Å; Y149-Q151 PolarHBondContact O-N 3Å; Q151-F154 PolarHBondContact O-N 3.34Å; Q151-Y155 WeakPolarHBondContact O-CB 3.28Å; Q151-Y155 PolarHBondContact O-N 3.33Å; Q151-E185 PolarHBondContact NE2-O 3.41Å; Q151-E185 PolarHBondContact NE2-OE2 2.99Å; Q151-F188 HydrophobicContact CG-CD1 4.47Å; Q151-M192 HydrophobicContact CB-CE 4.45Å; Q151-M192 HydrophobicContact CB-SD 4.06Å; Q151-M192 HydrophobicContact CG-SD 4.11Å; Q151-F206 HydrophobicContact CG-CE2 4.08Å; Q151-F206 HydrophobicContact CG-CZ 4.11Å
152	Y	92.2	Very high	90	Very high	4 Å²	4	20.4 Å²	20.4	2%	0.016	10%	0.098	C	C	.	.	H	α-helix	trans	-67.5	-39.6	177.9	-173.1	-118.6	0	0	0	112.3	L148 Y149 L150 Y155 L156 W205 F206 L360	L148-Y152 WeakPolarHBondContact O-CB 3.37Å; L148-Y152 PolarHBondContact O-N 3.46Å; Y149-Y152 PolarHBondContact O-N 3.25Å; L150-Y152 PolarHBondContact O-N 3.05Å; Y152-Y155 HydrophobicContact CD2-CD1 4.22Å; Y152-Y155 HydrophobicContact CE2-CD1 4.22Å; Y152-Y155 WeakPolarHBondContact O-CB 3.47Å; Y152-Y155 PolarHBondContact O-N 2.85Å; Y152-L156 HydrophobicContact CD1-CD1 3.91Å; Y152-L156 HydrophobicContact CD1-CG 4.38Å; Y152-L156 HydrophobicContact CE1-CD1 3.65Å; Y152-L156 HydrophobicContact CE1-CD2 4.29Å; Y152-L156 HydrophobicContact CE1-CG 4.13Å; Y152-L156 HydrophobicContact CE2-CD2 4.29Å; Y152-L156 HydrophobicContact CE2-CG 4.41Å; Y152-L156 WeakPolarHBondContact O-CG 3.39Å; Y152-L156 PolarHBondContact O-N 2.81Å; Y152-W205 AromaticContact CD2-CH2 3.8Å; Y152-W205 HydrophobicContact CD2-CH2 3.8Å; Y152-W205 HydrophobicContact CD2-CZ3 4.09Å; Y152-W205 AromaticContact CE2-CH2 3.68Å; Y152-W205 HydrophobicContact CE2-CH2 3.68Å; Y152-W205 HydrophobicContact CE2-CZ3 4.37Å; Y152-W205 HydrophobicContact CG-CH2 4.32Å; Y152-F206 HydrophobicContact CD2-CE2 4.37Å; Y152-L360 HydrophobicContact CD1-CD2 3.91Å; Y152-L360 HydrophobicContact CG-CD1 4.43Å; Y152-L360 HydrophobicContact CG-CD2 4.05Å
153	H	91.4	Very high	90.4	Very high	6 Å²	6	18.1 Å²	18.1	3%	0.028	9%	0.086	C	C	.	.	H	α-helix	trans	-64.8	-42.2	175.6	-82	-72.5	0	0	0	112.9	I104 Y149 L150 Y155 L156 R157 Y415	I104-H153 HydrophobicContact CD1-CB 3.96Å; I104-H153 HydrophobicContact CG1-CB 4.36Å; I104-H153 HydrophobicContact CG2-CB 4.05Å; Y149-H153 AromaticContact CD2-CD2 3.64Å; Y149-H153 AromaticContact CD2-NE2 3.63Å; Y149-H153 AromaticContact CE1-CD2 3.74Å; Y149-H153 AromaticContact CE2-CD2 3.24Å; Y149-H153 WeakPolarHBondContact CE2-CD2 3.35Å; Y149-H153 AromaticContact CE2-NE2 2.91Å; Y149-H153 WeakPolarHBondContact CE2-NE2 3.12Å; Y149-H153 AromaticContact CZ-CD2 3.3Å; Y149-H153 AromaticContact CZ-NE2 3.23Å; Y149-H153 PolarHBondContact O-CD2 3.18Å; Y149-H153 VanDerWaalsContact O-CD2 3.25Å; Y149-H153 PolarHBondContact O-N 3.37Å; Y149-H153 PolarHBondContact OH-NE2 2.64Å; L150-H153 PolarHBondContact O-N 3.28Å; H153-Y155 VanDerWaalsContact C-N 3.29Å; H153-Y155 PolarHBondContact O-N 3.33Å; H153-L156 PolarHBondContact O-N 2.96Å; H153-R157 WeakPolarHBondContact O-CG 3.32Å; H153-R157 PolarHBondContact O-N 3Å; H153-Y415 PolarHBondContact CE1-O 3.17Å
154	F	93.8	Very high	90.8	Very high	24 Å²	24	18.1 Å²	18.1	11%	0.105	8%	0.077	C	C	.	.	H	α-helix	trans	-61.2	-40.5	171.9	-83.4	-64.4	0	0	0	111.7	P99 E101 I104 L150 Q151 R157 R158	P99-F154 WeakPolarHBondContact O-CE1 3.28Å; E101-F154 HydrophobicContact CG-CZ 4.02Å; I104-F154 HydrophobicContact CD1-CD1 3.96Å; I104-F154 HydrophobicContact CD1-CD2 4.27Å; I104-F154 HydrophobicContact CD1-CE1 3.91Å; I104-F154 HydrophobicContact CD1-CE2 4.24Å; I104-F154 HydrophobicContact CD1-CG 4.12Å; I104-F154 HydrophobicContact CD1-CZ 4.05Å; L150-F154 HydrophobicContact CD1-CD2 3.99Å; L150-F154 HydrophobicContact CD1-CE2 3.59Å; L150-F154 HydrophobicContact CD1-CZ 4.46Å; L150-F154 HydrophobicContact CD2-CE2 4.05Å; L150-F154 HydrophobicContact CG-CD2 3.81Å; L150-F154 HydrophobicContact CG-CE2 3.6Å; L150-F154 VanDerWaalsContact O-CD2 3.28Å; L150-F154 WeakPolarHBondContact O-CD2 3.35Å; L150-F154 PolarHBondContact O-N 3.4Å; Q151-F154 PolarHBondContact O-N 3.34Å; F154-R157 PolarHBondContact O-N 2.94Å; F154-R158 WeakPolarHBondContact O-CB 3.33Å; F154-R158 WeakPolarHBondContact O-CG 3.33Å; F154-R158 PolarHBondContact O-N 3.02Å
155	Y	95	Very high	91.5	Very high	1 Å²	1	12.7 Å²	12.7	0%	0.004	5%	0.053	C	C	.	.	H	α-helix	trans	-57.8	-49.9	174.9	176.3	-119.7	0	0	0	112.2	Q151 Y152 H153 R157 R158 Y159 P182 E185 F206 H210 T213 F348	Q151-Y155 WeakPolarHBondContact O-CB 3.28Å; Q151-Y155 PolarHBondContact O-N 3.33Å; Y152-Y155 HydrophobicContact CD2-CD1 4.22Å; Y152-Y155 HydrophobicContact CE2-CD1 4.22Å; Y152-Y155 WeakPolarHBondContact O-CB 3.47Å; Y152-Y155 PolarHBondContact O-N 2.85Å; H153-Y155 VanDerWaalsContact C-N 3.29Å; H153-Y155 PolarHBondContact O-N 3.33Å; Y155-R157 VanDerWaalsContact C-N 3.32Å; Y155-R157 PolarHBondContact O-N 2.76Å; Y155-R158 PolarHBondContact O-N 3.26Å; Y155-Y159 WeakPolarHBondContact O-CB 3.15Å; Y155-Y159 PolarHBondContact O-N 3.08Å; Y155-P182 HydrophobicContact CE2-CB 4.14Å; Y155-E185 HydrophobicContact CD2-CB 3.86Å; Y155-E185 HydrophobicContact CD2-CG 3.82Å; Y155-E185 HydrophobicContact CE2-CB 4.41Å; Y155-E185 HydrophobicContact CE2-CG 4.46Å; Y155-F206 HydrophobicContact CD1-CE2 4.38Å; Y155-F206 HydrophobicContact CD2-CZ 4.46Å; Y155-F206 HydrophobicContact CG-CE2 4.24Å; Y155-F206 HydrophobicContact CG-CZ 4.11Å; Y155-H210 AromaticContact CE2-CD2 3.42Å; Y155-H210 VanDerWaalsContact CE2-CD2 3.42Å; Y155-H210 WeakPolarHBondContact CE2-CD2 3.46Å; Y155-H210 AromaticContact CZ-CD2 3.81Å; Y155-T213 WeakPolarHBondContact OH-CB 3.48Å; Y155-T213 PolarHBondContact OH-OG1 3.4Å; Y155-F348 HydrophobicContact CD1-CE1 4.14Å; Y155-F348 HydrophobicContact CD1-CZ 4.34Å; Y155-F348 AromaticContact CE1-CE1 3.64Å; Y155-F348 HydrophobicContact CE1-CE1 3.64Å; Y155-F348 AromaticContact CE1-CZ 3.72Å; Y155-F348 HydrophobicContact CE1-CZ 3.72Å
156	L	94	Very high	92.3	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-58.5	-43.3	177.3	-67.1	171.1	0	0	0	111.6	Y152 H153 Y159 W160 F344 F348 L411	Y152-L156 HydrophobicContact CD1-CD1 3.91Å; Y152-L156 HydrophobicContact CD1-CG 4.38Å; Y152-L156 HydrophobicContact CE1-CD1 3.65Å; Y152-L156 HydrophobicContact CE1-CD2 4.29Å; Y152-L156 HydrophobicContact CE1-CG 4.13Å; Y152-L156 HydrophobicContact CE2-CD2 4.29Å; Y152-L156 HydrophobicContact CE2-CG 4.41Å; Y152-L156 WeakPolarHBondContact O-CG 3.39Å; Y152-L156 PolarHBondContact O-N 2.81Å; H153-L156 PolarHBondContact O-N 2.96Å; L156-Y159 PolarHBondContact O-N 2.92Å; L156-W160 WeakPolarHBondContact O-CB 3.46Å; L156-W160 PolarHBondContact O-N 3Å; L156-F344 HydrophobicContact CB-CZ 4.35Å; L156-F344 HydrophobicContact CD2-CE2 4.46Å; L156-F344 HydrophobicContact CD2-CZ 3.69Å; L156-F348 HydrophobicContact CD2-CD1 3.44Å; L156-F348 VanDerWaalsContact CD2-CD1 3.44Å; L156-F348 HydrophobicContact CD2-CD2 4.31Å; L156-F348 HydrophobicContact CD2-CE1 3.27Å; L156-F348 HydrophobicContact CD2-CE2 4.19Å; L156-F348 HydrophobicContact CD2-CG 3.97Å; L156-F348 HydrophobicContact CD2-CZ 3.69Å; L156-L411 HydrophobicContact CB-CD1 4.19Å
157	R	94.2	Very high	92.9	Very high	13 Å²	13	11.6 Å²	11.6	5%	0.049	5%	0.047	C	C	.	.	H	α-helix	trans	-68.6	-41.2	179.5	-67.9	-61.1	179.5	177.4	8	112.5	P99 D103 I104 H153 F154 Y155 W160 N161 D410	P99-R157 HydrophobicContact CB-CB 3.66Å; P99-R157 HydrophobicContact CG-CB 3.99Å; D103-R157 PolarHBondContact O-NE 3.38Å; D103-R157 PolarHBondContact O-NH1 3.28Å; D103-R157 PolarHBondContact O-NH2 3.42Å; I104-R157 HydrophobicContact CG1-CG 3.65Å; I104-R157 PolarHBondContact O-NH2 2.96Å; H153-R157 WeakPolarHBondContact O-CG 3.32Å; H153-R157 PolarHBondContact O-N 3Å; F154-R157 PolarHBondContact O-N 2.94Å; Y155-R157 VanDerWaalsContact C-N 3.32Å; Y155-R157 PolarHBondContact O-N 2.76Å; R157-W160 PolarHBondContact O-N 3.35Å; R157-N161 WeakPolarHBondContact O-CB 3.45Å; R157-N161 PolarHBondContact O-N 2.91Å; R157-D410 IonicContact CZ-OD1 2.88Å; R157-D410 IonicContact CZ-OD2 3.28Å; R157-D410 IonicContact NH1-OD1 3.77Å; R157-D410 PolarHBondContact NH1-OD1 3.17Å; R157-D410 IonicContact NH1-OD2 2.75Å; R157-D410 IonicContact NH2-OD1 2.76Å; R157-D410 PolarHBondContact NH2-OD1 2.63Å; R157-D410 IonicContact NH2-OD2 3.73Å; R157-D410 PolarHBondContact NH2-OD2 3.45Å
158	R	95.8	Very high	93.5	Very high	14 Å²	14	12.8 Å²	12.8	5%	0.053	5%	0.052	C	C	.	.	H	α-helix	trans	-65.2	-40.4	175.5	-73.9	172.5	-172.8	135.6	4.3	111.4	D98 P99 F154 Y155 N161 Y162 P182 E185	D98-R158 IonicContact OD1-CZ 2.7Å; D98-R158 IonicContact OD1-NE 3.58Å; D98-R158 PolarHBondContact OD1-NE 2.61Å; D98-R158 IonicContact OD1-NH2 3.77Å; D98-R158 PolarHBondContact OD1-NH2 2.99Å; D98-R158 IonicContact OD2-NH2 2.73Å; P99-R158 HydrophobicContact CG-CG 4.01Å; F154-R158 WeakPolarHBondContact O-CB 3.33Å; F154-R158 WeakPolarHBondContact O-CG 3.33Å; F154-R158 PolarHBondContact O-N 3.02Å; Y155-R158 PolarHBondContact O-N 3.26Å; R158-N161 PolarHBondContact O-N 2.97Å; R158-Y162 WeakPolarHBondContact O-CB 3.05Å; R158-Y162 PolarHBondContact O-N 3.2Å; R158-P182 HydrophobicContact CB-CB 4.42Å; R158-E185 VanDerWaalsContact CD-CD 3.41Å; R158-E185 WeakPolarHBondContact CD-OE1 3.41Å; R158-E185 IonicContact CZ-OE1 2.66Å; R158-E185 VanDerWaalsContact CZ-OE1 3.25Å; R158-E185 IonicContact CZ-OE2 3.41Å; R158-E185 IonicContact NE-OE1 3.13Å; R158-E185 PolarHBondContact NE-OE1 3.46Å; R158-E185 IonicContact NH1-OE1 3.75Å; R158-E185 PolarHBondContact NH1-OE1 2.71Å; R158-E185 IonicContact NH1-OE2 3.6Å; R158-E185 PolarHBondContact NH1-OE2 3.17Å
159	Y	95.5	Very high	93.7	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-61.3	-46.1	173.3	-169.7	-76.5	0	0	0	111.4	Y155 L156 Y162 L163 L217 F344 F348	Y155-Y159 WeakPolarHBondContact O-CB 3.15Å; Y155-Y159 PolarHBondContact O-N 3.08Å; L156-Y159 PolarHBondContact O-N 2.92Å; Y159-Y162 PolarHBondContact O-N 2.87Å; Y159-L163 HydrophobicContact CD1-CD1 3.92Å; Y159-L163 HydrophobicContact CD1-CG 4.08Å; Y159-L163 HydrophobicContact CE1-CD1 3.58Å; Y159-L163 HydrophobicContact CE1-CD2 4.35Å; Y159-L163 HydrophobicContact CE1-CG 3.81Å; Y159-L163 PolarHBondContact O-N 3.43Å; Y159-L217 HydrophobicContact CD2-CD1 3.51Å; Y159-L217 HydrophobicContact CD2-CG 4.16Å; Y159-L217 HydrophobicContact CE1-CD2 4.11Å; Y159-L217 HydrophobicContact CE1-CG 4.46Å; Y159-L217 HydrophobicContact CE2-CD1 3.38Å; Y159-L217 HydrophobicContact CE2-CD2 4.05Å; Y159-L217 HydrophobicContact CE2-CG 3.49Å; Y159-L217 VanDerWaalsContact CE2-CG 3.49Å; Y159-L217 HydrophobicContact CG-CD1 4.12Å; Y159-F344 AromaticContact CD1-CD2 3.72Å; Y159-F344 HydrophobicContact CD1-CD2 3.72Å; Y159-F344 AromaticContact CD1-CE2 3.89Å; Y159-F344 HydrophobicContact CD1-CE2 3.89Å; Y159-F344 HydrophobicContact CE1-CD2 4.02Å; Y159-F348 AromaticContact CD1-CE2 3.61Å; Y159-F348 HydrophobicContact CD1-CE2 3.61Å; Y159-F348 HydrophobicContact CD1-CZ 4.26Å; Y159-F348 HydrophobicContact CD2-CE2 4.04Å; Y159-F348 AromaticContact CD2-CZ 4Å; Y159-F348 HydrophobicContact CD2-CZ 4Å; Y159-F348 AromaticContact CE1-CE2 3.79Å; Y159-F348 HydrophobicContact CE1-CE2 3.79Å; Y159-F348 HydrophobicContact CE2-CE2 4.25Å; Y159-F348 HydrophobicContact CE2-CZ 4.45Å; Y159-F348 AromaticContact CG-CE2 3.73Å; Y159-F348 HydrophobicContact CG-CE2 3.73Å; Y159-F348 AromaticContact CG-CZ 3.91Å; Y159-F348 HydrophobicContact CG-CZ 3.91Å
160	W	94	Very high	93.8	Very high	22 Å²	22	12.5 Å²	12.5	8%	0.083	5%	0.051	C	C	.	.	H	α-helix	trans	-62.6	-42.5	177.1	-171.5	-103.4	0	0	0	112.6	L156 R157 Y162 L163 R164 A340 F344 F407 L411	L156-W160 WeakPolarHBondContact O-CB 3.46Å; L156-W160 PolarHBondContact O-N 3Å; R157-W160 PolarHBondContact O-N 3.35Å; W160-Y162 VanDerWaalsContact C-N 3.33Å; W160-Y162 PolarHBondContact O-N 3.4Å; W160-L163 PolarHBondContact O-N 2.7Å; W160-R164 PolarHBondContact O-N 2.73Å; W160-A340 HydrophobicContact CH2-CB 3.88Å; W160-A340 HydrophobicContact CZ2-CB 4.4Å; W160-A340 HydrophobicContact CZ3-CB 4.12Å; W160-F344 HydrophobicContact CE3-CB 3.98Å; W160-F344 HydrophobicContact CE3-CD1 4.48Å; W160-F344 AromaticContact CE3-CD2 3.55Å; W160-F344 HydrophobicContact CE3-CD2 3.55Å; W160-F344 HydrophobicContact CE3-CE2 4.09Å; W160-F344 AromaticContact CE3-CG 3.76Å; W160-F344 HydrophobicContact CE3-CG 3.76Å; W160-F344 HydrophobicContact CZ3-CB 3.63Å; W160-F344 HydrophobicContact CZ3-CD1 4.39Å; W160-F344 HydrophobicContact CZ3-CD2 4.08Å; W160-F344 AromaticContact CZ3-CG 3.79Å; W160-F344 HydrophobicContact CZ3-CG 3.79Å; W160-F407 HydrophobicContact CD2-CD1 4.48Å; W160-F407 HydrophobicContact CD2-CE1 4.35Å; W160-F407 AromaticContact CE2-CD1 3.72Å; W160-F407 AromaticContact CZ2-CD1 3.79Å; W160-F407 HydrophobicContact CZ2-CD1 3.79Å; W160-F407 HydrophobicContact CZ2-CE1 4.24Å; W160-F407 AromaticContact NE1-CD1 3.75Å; W160-L411 HydrophobicContact CB-CD2 4.05Å; W160-L411 HydrophobicContact CD2-CD2 3.59Å; W160-L411 HydrophobicContact CD2-CG 4.34Å; W160-L411 HydrophobicContact CE3-CD2 3.44Å; W160-L411 VanDerWaalsContact CE3-CD2 3.44Å; W160-L411 HydrophobicContact CG-CD2 3.88Å; W160-L411 HydrophobicContact CG-CG 4.35Å; W160-L411 HydrophobicContact CZ3-CD2 4.05Å
161	N	95.1	Very high	93.8	Very high	19 Å²	19	12.4 Å²	12.4	10%	0.102	5%	0.051	C	C	.	.	H	α-helix	trans	-62.9	-40.4	176.3	-163	38.8	0	0	0	111.6	P97 P99 R157 R158 R164 A165	P97-N161 PolarHBondContact O-ND2 2.96Å; P99-N161 HydrophobicContact CG-CB 4.04Å; R157-N161 WeakPolarHBondContact O-CB 3.45Å; R157-N161 PolarHBondContact O-N 2.91Å; R158-N161 PolarHBondContact O-N 2.97Å; N161-R164 WeakPolarHBondContact O-CB 3.49Å; N161-R164 PolarHBondContact O-N 3.02Å; N161-A165 PolarHBondContact O-N 3.38Å
162	Y	96.7	Very high	93.6	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-65.6	-41.7	175.5	-161.4	-89.7	0	0	0	112.4	V69 V71 R158 Y159 W160 R164 A165 L166 I178 P182 F183 L217 W218	V69-Y162 HydrophobicContact CG1-CE2 4.13Å; V71-Y162 HydrophobicContact CG2-CE2 4.02Å; R158-Y162 WeakPolarHBondContact O-CB 3.05Å; R158-Y162 PolarHBondContact O-N 3.2Å; Y159-Y162 PolarHBondContact O-N 2.87Å; W160-Y162 VanDerWaalsContact C-N 3.33Å; W160-Y162 PolarHBondContact O-N 3.4Å; Y162-R164 VanDerWaalsContact C-N 3.29Å; Y162-R164 PolarHBondContact O-N 3.34Å; Y162-A165 WeakPolarHBondContact O-CB 3.38Å; Y162-A165 PolarHBondContact O-N 3.06Å; Y162-L166 HydrophobicContact CD1-CD1 3.89Å; Y162-L166 HydrophobicContact CD1-CG 4.07Å; Y162-L166 HydrophobicContact CE1-CD1 3.74Å; Y162-L166 HydrophobicContact CE1-CD2 4.17Å; Y162-L166 HydrophobicContact CE1-CG 3.93Å; Y162-L166 WeakPolarHBondContact O-CG 3.25Å; Y162-L166 PolarHBondContact O-N 2.74Å; Y162-I178 HydrophobicContact CD2-CD1 3.27Å; Y162-I178 HydrophobicContact CE2-CD1 3.42Å; Y162-I178 VanDerWaalsContact CE2-CD1 3.42Å; Y162-I178 HydrophobicContact CG-CD1 4.15Å; Y162-P182 HydrophobicContact CD2-CG 4.15Å; Y162-P182 HydrophobicContact CG-CG 3.95Å; Y162-F183 HydrophobicContact CD2-CE2 4.35Å; Y162-F183 HydrophobicContact CE1-CE2 4.14Å; Y162-F183 HydrophobicContact CE1-CZ 4.12Å; Y162-F183 AromaticContact CE2-CE2 3.7Å; Y162-F183 HydrophobicContact CE2-CE2 3.7Å; Y162-F183 HydrophobicContact CE2-CZ 4.48Å; Y162-F183 AromaticContact CZ-CE2 3.57Å; Y162-F183 AromaticContact CZ-CZ 3.93Å; Y162-L217 HydrophobicContact CD1-CB 4.34Å; Y162-L217 HydrophobicContact CD1-CD1 3.74Å; Y162-L217 HydrophobicContact CD1-CD2 4.13Å; Y162-L217 HydrophobicContact CD1-CG 4.3Å; Y162-L217 HydrophobicContact CE1-CB 4.26Å; Y162-L217 HydrophobicContact CE1-CD1 4.39Å; Y162-L217 HydrophobicContact CG-CD1 4.27Å; Y162-W218 VanDerWaalsContact CE1-O 3.25Å; Y162-W218 WeakPolarHBondContact CE1-O 3.33Å; Y162-W218 VanDerWaalsContact CZ-O 3.31Å; Y162-W218 PolarHBondContact OH-O 3.41Å
163	L	94.9	Very high	93.5	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-59.4	-41.2	171.6	-78.8	-179	0	0	0	111.8	Y159 W160 A165 L166 C167 L217 F337 K343 F344 F407	Y159-L163 HydrophobicContact CD1-CD1 3.92Å; Y159-L163 HydrophobicContact CD1-CG 4.08Å; Y159-L163 HydrophobicContact CE1-CD1 3.58Å; Y159-L163 HydrophobicContact CE1-CD2 4.35Å; Y159-L163 HydrophobicContact CE1-CG 3.81Å; Y159-L163 PolarHBondContact O-N 3.43Å; W160-L163 PolarHBondContact O-N 2.7Å; L163-A165 VanDerWaalsContact C-N 3.32Å; L163-A165 PolarHBondContact O-N 3.29Å; L163-L166 PolarHBondContact O-N 2.94Å; L163-C167 WeakPolarHBondContact O-CB 3.03Å; L163-C167 PolarHBondContact O-N 3Å; L163-L217 HydrophobicContact CD2-CD2 3.51Å; L163-L217 HydrophobicContact CG-CD2 4.06Å; L163-F337 HydrophobicContact CD2-CD1 4.02Å; L163-F337 HydrophobicContact CD2-CE1 4.41Å; L163-K343 HydrophobicContact CD2-CG 3.97Å; L163-F344 HydrophobicContact CD1-CB 4.14Å; L163-F344 HydrophobicContact CD1-CD2 4.19Å; L163-F407 HydrophobicContact CB-CE1 4.26Å; L163-F407 HydrophobicContact CB-CZ 4.11Å
164	R	94.5	Very high	93.5	Very high	123 Å²	123	14.3 Å²	14.3	46%	0.464	6%	0.061	S	C	.	.	H	α-helix	trans	-61.7	-41.3	176.4	-166.5	-175.2	164.5	179.8	-4.3	111.3	F43 F96 W160 N161 Y162 C167 H168 F407	F43-R164 HydrophobicContact CD1-CG 4.17Å; F43-R164 HydrophobicContact CE1-CG 3.71Å; F96-R164 HydrophobicContact CE1-CB 4.12Å; F96-R164 HydrophobicContact CE1-CG 3.86Å; W160-R164 PolarHBondContact O-N 2.73Å; N161-R164 WeakPolarHBondContact O-CB 3.49Å; N161-R164 PolarHBondContact O-N 3.02Å; Y162-R164 VanDerWaalsContact C-N 3.29Å; Y162-R164 PolarHBondContact O-N 3.34Å; R164-C167 PolarHBondContact O-N 3.21Å; R164-H168 PolarHBondContact O-N 3.34Å; R164-F407 VanDerWaalsContact CA-CE1 3.5Å; R164-F407 HydrophobicContact CB-CD1 3.91Å; R164-F407 HydrophobicContact CB-CE1 3.56Å; R164-F407 HydrophobicContact CB-CZ 3.98Å; R164-F407 HydrophobicContact CG-CD1 3.94Å; R164-F407 HydrophobicContact CG-CE1 4.06Å; R164-F407 HydrophobicContact CG-CG 4.22Å; R164-F407 HydrophobicContact CG-CZ 4.44Å
165	A	96	Very high	93.5	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-64.3	-43.8	175.1	0	0	0	0	0	112.3	F96 N161 Y162 L163 H168 L169 V176 I178	F96-A165 HydrophobicContact CD1-CB 4.05Å; F96-A165 HydrophobicContact CD2-CB 3.8Å; F96-A165 HydrophobicContact CE1-CB 4.12Å; F96-A165 HydrophobicContact CE2-CB 3.87Å; F96-A165 HydrophobicContact CG-CB 3.91Å; F96-A165 HydrophobicContact CZ-CB 4.04Å; N161-A165 PolarHBondContact O-N 3.38Å; Y162-A165 WeakPolarHBondContact O-CB 3.38Å; Y162-A165 PolarHBondContact O-N 3.06Å; L163-A165 VanDerWaalsContact C-N 3.32Å; L163-A165 PolarHBondContact O-N 3.29Å; A165-H168 WeakPolarHBondContact O-CB 3.26Å; A165-H168 PolarHBondContact O-N 3.49Å; A165-L169 PolarHBondContact O-N 3.17Å; A165-V176 HydrophobicContact CB-CB 4.19Å; A165-V176 HydrophobicContact CB-CG1 4.3Å; A165-V176 HydrophobicContact CB-CG2 4.05Å; A165-I178 HydrophobicContact CB-CD1 3.55Å; A165-I178 HydrophobicContact CB-CG1 3.98Å
166	L	94.7	Very high	93.7	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-64.7	-40.9	174.5	-66.6	179.6	0	0	0	112.1	V69 Y162 L163 H168 L169 F170 L217 W320 F337	V69-L166 HydrophobicContact CG2-CD2 4.1Å; Y162-L166 HydrophobicContact CD1-CD1 3.89Å; Y162-L166 HydrophobicContact CD1-CG 4.07Å; Y162-L166 HydrophobicContact CE1-CD1 3.74Å; Y162-L166 HydrophobicContact CE1-CD2 4.17Å; Y162-L166 HydrophobicContact CE1-CG 3.93Å; Y162-L166 WeakPolarHBondContact O-CG 3.25Å; Y162-L166 PolarHBondContact O-N 2.74Å; L163-L166 PolarHBondContact O-N 2.94Å; L166-H168 VanDerWaalsContact C-N 3.29Å; L166-H168 PolarHBondContact O-N 2.89Å; L166-L169 PolarHBondContact O-N 3.2Å; L166-F170 HydrophobicContact CD2-CE2 4.42Å; L166-F170 WeakPolarHBondContact O-CD2 3.16Å; L166-F170 PolarHBondContact O-N 3.36Å; L166-L217 HydrophobicContact CD1-CD2 4.36Å; L166-W320 HydrophobicContact CD2-CH2 4.11Å; L166-W320 HydrophobicContact CD2-CZ2 4.46Å; L166-F337 HydrophobicContact CB-CB 4.39Å; L166-F337 HydrophobicContact CB-CD1 4.2Å; L166-F337 HydrophobicContact CB-CD2 4.2Å; L166-F337 HydrophobicContact CB-CG 4.03Å; L166-F337 HydrophobicContact CD1-CD1 3.95Å; L166-F337 HydrophobicContact CD1-CE1 3.56Å; L166-F337 HydrophobicContact CD1-CE2 4.21Å; L166-F337 HydrophobicContact CD1-CG 4.45Å; L166-F337 HydrophobicContact CD1-CZ 3.72Å
167	C	93.6	Very high	93.8	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-57.7	-44.2	174.1	-179.9	0	0	0	0	111.5	F43 L163 R164 N171 F407	F43-C167 HydrophobicContact CE1-CB 4.42Å; L163-C167 WeakPolarHBondContact O-CB 3.03Å; L163-C167 PolarHBondContact O-N 3Å; R164-C167 PolarHBondContact O-N 3.21Å; C167-N171 WeakPolarHBondContact O-CB 2.89Å; C167-N171 PolarHBondContact O-N 2.98Å; C167-N171 PolarHBondContact O-ND2 3.39Å; C167-N171 PolarHBondContact SG-ND2 2.97Å; C167-N171 VanDerWaalsContact SG-ND2 3.38Å; C167-F407 HydrophobicContact CB-CD2 4.44Å; C167-F407 HydrophobicContact CB-CE2 3.48Å; C167-F407 VanDerWaalsContact CB-CE2 3.48Å; C167-F407 HydrophobicContact CB-CZ 3.99Å
168	H	93.5	Very high	94	Very high	25 Å²	25	12.6 Å²	12.6	12%	0.116	6%	0.055	C	C	.	.	H	α-helix	trans	-57.9	-54.2	175.5	-170.9	67.5	0	0	0	111.8	F43 A94 F96 R164 A165 L166 F170 N171 T172 Q174 V176	F43-H168 AromaticContact CE2-ND1 3.85Å; F43-H168 HydrophobicContact CZ-CB 3.72Å; F43-H168 AromaticContact CZ-ND1 3.66Å; A94-H168 WeakPolarHBondContact CB-NE2 3.12Å; F96-H168 HydrophobicContact CE2-CB 4.33Å; F96-H168 HydrophobicContact CZ-CB 3.94Å; R164-H168 PolarHBondContact O-N 3.34Å; A165-H168 WeakPolarHBondContact O-CB 3.26Å; A165-H168 PolarHBondContact O-N 3.49Å; L166-H168 VanDerWaalsContact C-N 3.29Å; L166-H168 PolarHBondContact O-N 2.89Å; H168-F170 PolarHBondContact O-N 3.16Å; H168-N171 PolarHBondContact O-N 2.85Å; H168-T172 PolarHBondContact NE2-OG1 3.39Å; H168-T172 WeakPolarHBondContact O-CB 3.48Å; H168-T172 WeakPolarHBondContact O-CG2 3.47Å; H168-T172 PolarHBondContact O-N 3.46Å; H168-T172 PolarHBondContact O-OG1 3.23Å; H168-Q174 PolarHBondContact NE2-OE1 3.34Å; H168-V176 HydrophobicContact CB-CG1 4.33Å
169	L	93.1	Very high	94.1	Very high	0 Å²	0	12 Å²	12	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-57.3	-49.6	-176.4	176.7	66.8	0	0	0	111.6	F63 V69 A165 L166 N171 G173 Q174 V176 W320	F63-L169 HydrophobicContact CE1-CG 4.36Å; F63-L169 HydrophobicContact CZ-CG 4.43Å; V69-L169 HydrophobicContact CG2-CD2 3.58Å; A165-L169 PolarHBondContact O-N 3.17Å; L166-L169 PolarHBondContact O-N 3.2Å; L169-N171 VanDerWaalsContact C-N 3.34Å; L169-N171 PolarHBondContact O-N 3.21Å; L169-G173 VanDerWaalsContact O-CA 3.24Å; L169-G173 WeakPolarHBondContact O-CA 3.36Å; L169-G173 PolarHBondContact O-N 2.89Å; L169-Q174 WeakPolarHBondContact CD1-O 3.06Å; L169-V176 HydrophobicContact CB-CG1 4.3Å; L169-W320 HydrophobicContact CD2-CH2 3.65Å; L169-W320 HydrophobicContact CD2-CZ3 3.91Å
170	F	90.5	Very high	94	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-72.5	-26	-175.1	-81.9	-106.4	0	0	0	113.7	T59 F63 L166 H168 W218 W320 L330 R334 F337	T59-F170 HydrophobicContact CG2-CD1 4.25Å; F63-F170 HydrophobicContact CE2-CD1 4.38Å; F63-F170 HydrophobicContact CZ-CD1 4.04Å; F63-F170 HydrophobicContact CZ-CD2 4.34Å; F63-F170 HydrophobicContact CZ-CE1 4.29Å; F63-F170 HydrophobicContact CZ-CG 4.12Å; L166-F170 HydrophobicContact CD2-CE2 4.42Å; L166-F170 WeakPolarHBondContact O-CD2 3.16Å; L166-F170 PolarHBondContact O-N 3.36Å; H168-F170 PolarHBondContact O-N 3.16Å; F170-W218 HydrophobicContact CE1-CH2 4.1Å; F170-W218 HydrophobicContact CE1-CZ3 4.25Å; F170-W218 HydrophobicContact CE2-CE3 4.48Å; F170-W218 HydrophobicContact CE2-CZ3 4.32Å; F170-W218 AromaticContact CZ-CE3 3.94Å; F170-W218 HydrophobicContact CZ-CE3 3.94Å; F170-W218 AromaticContact CZ-CH2 3.63Å; F170-W218 HydrophobicContact CZ-CH2 3.63Å; F170-W218 HydrophobicContact CZ-CZ2 4.4Å; F170-W218 AromaticContact CZ-CZ3 3.44Å; F170-W218 HydrophobicContact CZ-CZ3 3.44Å; F170-W218 VanDerWaalsContact CZ-CZ3 3.44Å; F170-W320 HydrophobicContact CE2-CH2 4.32Å; F170-W320 HydrophobicContact CE2-CZ3 4.2Å; F170-W320 HydrophobicContact CZ-CZ3 4.36Å; F170-L330 HydrophobicContact CD1-CD1 4.23Å; F170-L330 HydrophobicContact CE1-CD1 3.59Å; F170-L330 HydrophobicContact CE1-CG 4.26Å; F170-L330 HydrophobicContact CZ-CD1 4.38Å; F170-R334 HydrophobicContact CB-CB 4.16Å; F170-R334 HydrophobicContact CB-CG 4.04Å; F170-R334 HydrophobicContact CD1-CB 3.92Å; F170-R334 HydrophobicContact CG-CB 4.47Å; F170-F337 AromaticContact CD2-CD2 3.92Å; F170-F337 HydrophobicContact CD2-CD2 3.92Å; F170-F337 HydrophobicContact CD2-CE2 4.35Å; F170-F337 HydrophobicContact CE1-CD2 4.31Å; F170-F337 HydrophobicContact CE1-CE2 4.3Å; F170-F337 AromaticContact CE2-CD2 3.71Å; F170-F337 HydrophobicContact CE2-CD2 3.71Å; F170-F337 AromaticContact CE2-CE2 3.66Å; F170-F337 HydrophobicContact CE2-CE2 3.66Å; F170-F337 HydrophobicContact CG-CD2 4.28Å; F170-F337 AromaticContact CZ-CD2 3.89Å; F170-F337 HydrophobicContact CZ-CD2 3.89Å; F170-F337 AromaticContact CZ-CE2 3.61Å; F170-F337 HydrophobicContact CZ-CE2 3.61Å
171	N	89.1	Confident	94	Very high	3 Å²	3	11.6 Å²	11.6	2%	0.016	5%	0.051	C	C	.	.	H	α-helix	trans	-90.2	-31.9	179.4	-73.5	-53.2	0	0	0	113.1	Y42 R62 C167 H168 L169 R334 S338	Y42-N171 WeakPolarHBondContact CD1-OD1 3.5Å; Y42-N171 HydrophobicContact CD2-CB 4.09Å; Y42-N171 HydrophobicContact CG-CB 4.24Å; R62-N171 WeakPolarHBondContact CD-O 3.49Å; R62-N171 PolarHBondContact NE-O 2.57Å; C167-N171 WeakPolarHBondContact O-CB 2.89Å; C167-N171 PolarHBondContact O-N 2.98Å; C167-N171 PolarHBondContact O-ND2 3.39Å; C167-N171 PolarHBondContact SG-ND2 2.97Å; C167-N171 VanDerWaalsContact SG-ND2 3.38Å; H168-N171 PolarHBondContact O-N 2.85Å; L169-N171 VanDerWaalsContact C-N 3.34Å; L169-N171 PolarHBondContact O-N 3.21Å; N171-R334 PolarHBondContact OD1-NE 3.16Å; N171-R334 PolarHBondContact OD1-NH2 3.14Å; N171-R334 VanDerWaalsContact OD1-NH2 3.09Å; N171-S338 PolarHBondContact ND2-OG 2.96Å
172	T	88.9	Confident	94	Very high	18 Å²	18	10.7 Å²	10.7	11%	0.11	5%	0.046	C	C	.	.	H	α-helix	trans	-105.2	-26.3	-176.3	67.5	0	0	0	0	113.7	L37 H168 Q174	L37-T172 HydrophobicContact CD2-CG2 3.93Å; H168-T172 PolarHBondContact NE2-OG1 3.39Å; H168-T172 WeakPolarHBondContact O-CB 3.48Å; H168-T172 WeakPolarHBondContact O-CG2 3.47Å; H168-T172 PolarHBondContact O-N 3.46Å; H168-T172 PolarHBondContact O-OG1 3.23Å; T172-Q174 PolarHBondContact O-N 3.02Å; T172-Q174 WeakPolarHBondContact OG1-CB 3.31Å; T172-Q174 PolarHBondContact OG1-N 2.8Å
173	G	89.3	Confident	94	Very high	1 Å²	1	10.9 Å²	10.9	1%	0.01	5%	0.047	C	C	.	.			trans	76.2	-1.9	-167.4	0	0	0	0	0	113.8	R62 S67 L169	R62-G173 WeakPolarHBondContact O-CA 3.22Å; S67-G173 PolarHBondContact OG-O 3.06Å; L169-G173 VanDerWaalsContact O-CA 3.24Å; L169-G173 WeakPolarHBondContact O-CA 3.36Å; L169-G173 PolarHBondContact O-N 2.89Å
174	Q	92	Very high	94	Very high	37 Å²	37	10.9 Å²	10.9	17%	0.173	5%	0.047	C	C	.	.			trans	-76.4	128.4	176.6	-170	-176.5	15.3	0	0	109.7	D92 H168 L169 T172	D92-Q174 PolarHBondContact O-NE2 3.44Å; D92-Q174 VanDerWaalsContact O-NE2 3.16Å; H168-Q174 PolarHBondContact NE2-OE1 3.34Å; L169-Q174 WeakPolarHBondContact CD1-O 3.06Å; T172-Q174 PolarHBondContact O-N 3.02Å; T172-Q174 WeakPolarHBondContact OG1-CB 3.31Å; T172-Q174 PolarHBondContact OG1-N 2.8Å
175	G	94.1	Very high	94	Very high	1 Å²	1	5 Å²	5	1%	0.01	3%	0.025	C	C	.	.			trans	-54.8	160	171.5	0	0	0	0	0	112.8	N66 K68 M93 A94	N66-G175 WeakPolarHBondContact O-CA 3.38Å; N66-G175 PolarHBondContact O-N 3.12Å; K68-G175 VanDerWaalsContact O-CA 3.29Å; K68-G175 WeakPolarHBondContact O-CA 3.48Å; M93-G175 CarbonylContact C-O 3.41Å; M93-G175 WeakPolarHBondContact CA-O 3.37Å; M93-G175 VanDerWaalsContact CB-O 3.31Å; M93-G175 WeakPolarHBondContact CB-O 3.18Å; A94-G175 PolarHBondContact N-O 3.34Å
176	V	97.2	Very high	93.9	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.031	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	136.9	-177.9	-61.2	0	0	0	0	110.9	K68 V69 I70 A94 F96 A165 H168 L169 I178	K68-V176 PolarHBondContact O-N 2.82Å; V69-V176 HydrophobicContact CB-CG2 4.14Å; V69-V176 HydrophobicContact CG1-CG2 4Å; V69-V176 HydrophobicContact CG2-CG2 3.8Å; I70-V176 PolarHBondContact N-O 3.38Å; A94-V176 HydrophobicContact CB-CG1 4.37Å; A94-V176 WeakPolarHBondContact O-CA 3.42Å; F96-V176 HydrophobicContact CD2-CB 4.11Å; F96-V176 HydrophobicContact CD2-CG1 4.2Å; F96-V176 HydrophobicContact CE2-CB 4.11Å; F96-V176 HydrophobicContact CE2-CG1 3.68Å; A165-V176 HydrophobicContact CB-CB 4.19Å; A165-V176 HydrophobicContact CB-CG1 4.3Å; A165-V176 HydrophobicContact CB-CG2 4.05Å; H168-V176 HydrophobicContact CB-CG1 4.33Å; L169-V176 HydrophobicContact CB-CG1 4.3Å; V176-I178 HydrophobicContact CG2-CD1 4.42Å
177	V	98.1	Very high	94	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.031	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	124.7	170.9	-173.8	0	0	0	0	108.1	I70 V72 A84 L87 A88 M93 A94 F96	I70-V177 HydrophobicContact CB-CG1 4.41Å; I70-V177 HydrophobicContact CB-CG2 4.22Å; I70-V177 HydrophobicContact CD1-CG2 4.37Å; I70-V177 HydrophobicContact CG2-CG1 4.46Å; I70-V177 CarbonylContact O-C 3.54Å; I70-V177 WeakPolarHBondContact O-CA 3.16Å; V72-V177 HydrophobicContact CG2-CG1 4.1Å; A84-V177 HydrophobicContact CB-CG1 4.05Å; A84-V177 WeakPolarHBondContact O-CG1 3.42Å; L87-V177 HydrophobicContact CB-CG1 4.46Å; A88-V177 HydrophobicContact CB-CB 4.04Å; A88-V177 HydrophobicContact CB-CG2 3.93Å; M93-V177 HydrophobicContact CB-CG2 3.97Å; M93-V177 HydrophobicContact SD-CG2 3.95Å; A94-V177 PolarHBondContact O-N 3.37Å; F96-V177 PolarHBondContact N-O 3.36Å
178	I	98.2	Very high	94	Very high	2 Å²	2	7.2 Å²	7.2	1%	0.01	3%	0.034	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	124.5	-174	-53.4	171.5	0	0	0	108.3	V69 I70 V71 V72 F96 Y162 A165 V176 R180	V69-I178 HydrophobicContact CG1-CD1 4.1Å; I70-I178 PolarHBondContact O-N 3.17Å; V71-I178 WeakPolarHBondContact CA-O 3.49Å; V71-I178 HydrophobicContact CG2-CB 4.31Å; V72-I178 PolarHBondContact N-O 3.38Å; F96-I178 HydrophobicContact CB-CB 4.49Å; F96-I178 HydrophobicContact CB-CG1 4.11Å; F96-I178 HydrophobicContact CB-CG2 4.46Å; F96-I178 WeakPolarHBondContact O-CA 3.36Å; Y162-I178 HydrophobicContact CD2-CD1 3.27Å; Y162-I178 HydrophobicContact CE2-CD1 3.42Å; Y162-I178 VanDerWaalsContact CE2-CD1 3.42Å; Y162-I178 HydrophobicContact CG-CD1 4.15Å; A165-I178 HydrophobicContact CB-CD1 3.55Å; A165-I178 HydrophobicContact CB-CG1 3.98Å; V176-I178 HydrophobicContact CG2-CD1 4.42Å; I178-R180 PolarHBondContact O-N 3.37Å
179	D	96.2	Very high	94.1	Very high	2 Å²	2	6 Å²	6	1%	0.011	3%	0.029	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	109.9	171.3	-179.3	19.2	0	0	0	109.1	K80 S81 A84 Y95 F96 D98	K80-D179 WeakPolarHBondContact CD-OD1 3.12Å; K80-D179 WeakPolarHBondContact CE-OD1 3.08Å; K80-D179 VanDerWaalsContact CG-OD1 3.28Å; K80-D179 WeakPolarHBondContact CG-OD1 3.11Å; S81-D179 VanDerWaalsContact CA-OD2 3.3Å; S81-D179 WeakPolarHBondContact CA-OD2 3.17Å; S81-D179 WeakPolarHBondContact CB-OD2 3.41Å; S81-D179 PolarHBondContact OG-OD2 2.94Å; A84-D179 HydrophobicContact CB-CB 4.03Å; Y95-D179 HydrophobicContact CE2-CB 4.1Å; F96-D179 PolarHBondContact O-N 3.47Å; D98-D179 WeakPolarHBondContact CA-O 2.89Å; D98-D179 HydrophobicContact CB-CB 4.3Å; D98-D179 WeakPolarHBondContact CB-O 2.83Å; D98-D179 PolarHBondContact N-O 3.33Å
180	R	94.8	Very high	94.3	Very high	13 Å²	13	7.1 Å²	7.1	5%	0.049	4%	0.035	C	C	.	.	S	Bend	trans	58.9	115.5	-172.3	-171.1	173.8	-75.6	-175.7	-4.2	114.8	V72 G74 I178	V72-R180 WeakPolarHBondContact O-CA 3.47Å; V72-R180 PolarHBondContact O-N 3.31Å; G74-R180 PolarHBondContact O-NH2 2.72Å; I178-R180 PolarHBondContact O-N 3.37Å
181	G	93.7	Very high	94.5	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.035	C	C	.	.			trans	-85.9	168	177.7	0	0	0	0	0	113.1	V71 E73 F183 S184	V71-G181 VanDerWaalsContact CG1-N 3.34Å; E73-G181 PolarHBondContact OE1-N 3.07Å; G181-F183 PolarHBondContact O-N 3.27Å; G181-S184 PolarHBondContact O-OG 2.85Å
182	P	96	Very high	94.8	Very high	0 Å²	0	7 Å²	7	0%	0	3%	0.034	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-7.8	174.1	29.3	-34.2	0	0	0	113.3	Y155 R158 Y162 E185 H210 I214 L217	Y155-P182 HydrophobicContact CE2-CB 4.14Å; R158-P182 HydrophobicContact CB-CB 4.42Å; Y162-P182 HydrophobicContact CD2-CG 4.15Å; Y162-P182 HydrophobicContact CG-CG 3.95Å; P182-E185 WeakPolarHBondContact O-CG 3.35Å; P182-H210 PolarHBondContact O-NE2 2.63Å; P182-I214 HydrophobicContact CB-CD1 3.78Å; P182-I214 HydrophobicContact CG-CD1 3.91Å; P182-I214 WeakPolarHBondContact O-CD1 3.24Å; P182-L217 HydrophobicContact CB-CD1 4.46Å; P182-L217 HydrophobicContact CG-CD1 3.62Å
183	F	95.7	Very high	95.1	Very high	4 Å²	4	9 Å²	9	2%	0.018	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-31.9	-172.6	-55.5	-84.7	0	0	0	113.7	Y162 G181 E185 F186 H210 I214 L217 K219 Y267 M271	Y162-F183 HydrophobicContact CD2-CE2 4.35Å; Y162-F183 HydrophobicContact CE1-CE2 4.14Å; Y162-F183 HydrophobicContact CE1-CZ 4.12Å; Y162-F183 AromaticContact CE2-CE2 3.7Å; Y162-F183 HydrophobicContact CE2-CE2 3.7Å; Y162-F183 HydrophobicContact CE2-CZ 4.48Å; Y162-F183 AromaticContact CZ-CE2 3.57Å; Y162-F183 AromaticContact CZ-CZ 3.93Å; G181-F183 PolarHBondContact O-N 3.27Å; F183-E185 VanDerWaalsContact C-N 3.26Å; F183-E185 PolarHBondContact O-N 2.96Å; F183-F186 VanDerWaalsContact O-CD1 3.23Å; F183-F186 WeakPolarHBondContact O-CD1 3.37Å; F183-F186 VanDerWaalsContact O-CE1 3.24Å; F183-F186 WeakPolarHBondContact O-CE1 3.39Å; F183-H210 PolarHBondContact O-CE1 2.83Å; F183-I214 HydrophobicContact CD1-CD1 3.72Å; F183-I214 HydrophobicContact CD1-CG1 3.27Å; F183-I214 HydrophobicContact CE1-CD1 3.98Å; F183-I214 HydrophobicContact CE1-CG1 3.57Å; F183-I214 HydrophobicContact CG-CD1 4.19Å; F183-I214 HydrophobicContact CG-CG1 4.16Å; F183-L217 HydrophobicContact CE1-CB 4.48Å; F183-L217 HydrophobicContact CZ-CB 4.22Å; F183-K219 HydrophobicContact CD1-CG 4.43Å; F183-K219 HydrophobicContact CE1-CG 3.86Å; F183-K219 HydrophobicContact CZ-CG 4.32Å; F183-Y267 HydrophobicContact CB-CE2 3.69Å; F183-M271 HydrophobicContact CB-CE 3.4Å; F183-M271 VanDerWaalsContact CB-CE 3.4Å; F183-M271 HydrophobicContact CD1-CE 3.59Å; F183-M271 HydrophobicContact CD2-CE 4.46Å; F183-M271 HydrophobicContact CG-CE 3.58Å
184	S	94.7	Very high	95.4	Very high	0 Å²	0	14 Å²	14	0%	0	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-1.3	-179.1	54.3	0	0	0	0	113.4	E73 G181 F186 A187	E73-S184 VanDerWaalsContact CD-OG 3.25Å; E73-S184 PolarHBondContact OE1-OG 2.88Å; E73-S184 WeakPolarHBondContact OE2-CB 3.45Å; E73-S184 PolarHBondContact OE2-OG 3.49Å; G181-S184 PolarHBondContact O-OG 2.85Å; S184-F186 VanDerWaalsContact C-N 3.3Å; S184-F186 PolarHBondContact O-N 3.5Å; S184-A187 WeakPolarHBondContact O-CB 3.38Å; S184-A187 PolarHBondContact O-N 3.48Å
185	E	95	Very high	95.4	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-65.7	-28.6	-170	-67.1	-72.9	115.3	0	0	114	Q151 Y155 R158 P182 F183 A187 F188 A189 F206	Q151-E185 PolarHBondContact NE2-O 3.41Å; Q151-E185 PolarHBondContact NE2-OE2 2.99Å; Y155-E185 HydrophobicContact CD2-CB 3.86Å; Y155-E185 HydrophobicContact CD2-CG 3.82Å; Y155-E185 HydrophobicContact CE2-CB 4.41Å; Y155-E185 HydrophobicContact CE2-CG 4.46Å; R158-E185 VanDerWaalsContact CD-CD 3.41Å; R158-E185 WeakPolarHBondContact CD-OE1 3.41Å; R158-E185 IonicContact CZ-OE1 2.66Å; R158-E185 VanDerWaalsContact CZ-OE1 3.25Å; R158-E185 IonicContact CZ-OE2 3.41Å; R158-E185 IonicContact NE-OE1 3.13Å; R158-E185 PolarHBondContact NE-OE1 3.46Å; R158-E185 IonicContact NH1-OE1 3.75Å; R158-E185 PolarHBondContact NH1-OE1 2.71Å; R158-E185 IonicContact NH1-OE2 3.6Å; R158-E185 PolarHBondContact NH1-OE2 3.17Å; P182-E185 WeakPolarHBondContact O-CG 3.35Å; F183-E185 VanDerWaalsContact C-N 3.26Å; F183-E185 PolarHBondContact O-N 2.96Å; E185-A187 VanDerWaalsContact C-N 3.25Å; E185-A187 PolarHBondContact O-N 3.31Å; E185-F188 PolarHBondContact O-N 2.93Å; E185-A189 PolarHBondContact O-N 2.96Å; E185-F206 HydrophobicContact CB-CE1 4.41Å; E185-F206 HydrophobicContact CB-CZ 4.23Å
186	F	94.6	Very high	95.4	Very high	28 Å²	28	18.8 Å²	18.8	12%	0.123	9%	0.091	C	C	.	.	H	α-helix	trans	-67	-28.7	172.4	75.4	-92.7	0	0	0	111.9	F183 S184 F188 A189 D190 H210 I262 Y266 Y267	F183-F186 VanDerWaalsContact O-CD1 3.23Å; F183-F186 WeakPolarHBondContact O-CD1 3.37Å; F183-F186 VanDerWaalsContact O-CE1 3.24Å; F183-F186 WeakPolarHBondContact O-CE1 3.39Å; S184-F186 VanDerWaalsContact C-N 3.3Å; S184-F186 PolarHBondContact O-N 3.5Å; F186-F188 VanDerWaalsContact C-N 3.3Å; F186-F188 PolarHBondContact O-N 3.35Å; F186-A189 PolarHBondContact O-N 2.84Å; F186-D190 WeakPolarHBondContact O-CB 3.38Å; F186-D190 PolarHBondContact O-N 3.29Å; F186-H210 AromaticContact CD1-CE1 3.75Å; F186-I262 HydrophobicContact CE2-CG2 4.36Å; F186-Y266 HydrophobicContact CD2-CD1 4.47Å; F186-Y266 HydrophobicContact CD2-CE1 4.35Å; F186-Y266 AromaticContact CE2-CD1 3.31Å; F186-Y266 HydrophobicContact CE2-CD1 3.31Å; F186-Y266 AromaticContact CE2-CE1 3.44Å; F186-Y266 HydrophobicContact CE2-CE1 3.44Å; F186-Y266 VanDerWaalsContact CE2-CE1 3.44Å; F186-Y266 AromaticContact CZ-CD1 3.57Å; F186-Y266 HydrophobicContact CZ-CD1 3.57Å; F186-Y266 AromaticContact CZ-CE1 3.69Å; F186-Y266 HydrophobicContact CZ-CE1 3.69Å; F186-Y267 AromaticContact CE1-CD2 3.71Å; F186-Y267 HydrophobicContact CE1-CD2 3.71Å; F186-Y267 HydrophobicContact CE1-CG 4.49Å; F186-Y267 AromaticContact CZ-CD2 3.91Å; F186-Y267 HydrophobicContact CZ-CD2 3.91Å; F186-Y267 HydrophobicContact CZ-CG 4.32Å
187	A	95.4	Very high	95.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-67.1	-36.1	179.2	0	0	0	0	0	110.9	S184 E185 A191 Y259 I262 L263	S184-A187 WeakPolarHBondContact O-CB 3.38Å; S184-A187 PolarHBondContact O-N 3.48Å; E185-A187 VanDerWaalsContact C-N 3.25Å; E185-A187 PolarHBondContact O-N 3.31Å; A187-A191 WeakPolarHBondContact O-CB 3.49Å; A187-A191 PolarHBondContact O-N 3.38Å; A187-Y259 HydrophobicContact CB-CD2 4.38Å; A187-Y259 HydrophobicContact CB-CE2 4.03Å; A187-I262 HydrophobicContact CB-CB 4.24Å; A187-I262 HydrophobicContact CB-CG2 3.65Å; A187-L263 HydrophobicContact CB-CD1 4.47Å
188	F	95.2	Very high	94.9	Very high	17 Å²	17	20 Å²	20	8%	0.075	10%	0.095	C	C	.	.	H	α-helix	trans	-68	-45.8	174	-165.4	-87.2	0	0	0	111.3	I76 W136 Q151 E185 F186 D190 A191 M192 F255 Y259	I76-F188 HydrophobicContact CD1-CE2 4.3Å; W136-F188 AromaticContact CH2-CZ 3.99Å; W136-F188 HydrophobicContact CH2-CZ 3.99Å; W136-F188 HydrophobicContact CZ2-CZ 4.12Å; Q151-F188 HydrophobicContact CG-CD1 4.47Å; E185-F188 PolarHBondContact O-N 2.93Å; F186-F188 VanDerWaalsContact C-N 3.3Å; F186-F188 PolarHBondContact O-N 3.35Å; F188-D190 VanDerWaalsContact C-N 3.32Å; F188-D190 PolarHBondContact O-N 2.9Å; F188-A191 PolarHBondContact O-N 3.28Å; F188-M192 HydrophobicContact CD1-CG 3.97Å; F188-M192 HydrophobicContact CD1-SD 3.57Å; F188-M192 VanDerWaalsContact CD1-SD 3.57Å; F188-M192 HydrophobicContact CE1-CG 3.91Å; F188-M192 HydrophobicContact CE1-SD 3.52Å; F188-M192 VanDerWaalsContact CE1-SD 3.52Å; F188-M192 WeakPolarHBondContact O-CG 3.44Å; F188-M192 PolarHBondContact O-N 3.12Å; F188-F255 HydrophobicContact CD2-CZ 4.09Å; F188-F255 HydrophobicContact CE1-CZ 4.22Å; F188-F255 HydrophobicContact CE2-CE1 4.02Å; F188-F255 AromaticContact CE2-CZ 3.6Å; F188-F255 HydrophobicContact CE2-CZ 3.6Å; F188-F255 HydrophobicContact CZ-CE1 4.3Å; F188-F255 AromaticContact CZ-CZ 3.68Å; F188-F255 HydrophobicContact CZ-CZ 3.68Å; F188-Y259 HydrophobicContact CB-CD2 4.28Å; F188-Y259 HydrophobicContact CB-CE2 3.85Å; F188-Y259 HydrophobicContact CD2-CD2 4.24Å; F188-Y259 HydrophobicContact CD2-CE1 4.48Å; F188-Y259 HydrophobicContact CD2-CE2 4.03Å; F188-Y259 HydrophobicContact CG-CE2 4.44Å
189	A	95.4	Very high	94.6	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.4	-38.7	176.3	0	0	0	0	0	112.7	E185 F186 M192 H193 L198 L203 F206	E185-A189 PolarHBondContact O-N 2.96Å; F186-A189 PolarHBondContact O-N 2.84Å; A189-M192 WeakPolarHBondContact O-CB 3.39Å; A189-M192 PolarHBondContact O-N 3.31Å; A189-H193 PolarHBondContact O-N 3.49Å; A189-L198 HydrophobicContact CB-CD2 4.35Å; A189-L203 HydrophobicContact CB-CD1 3.98Å; A189-F206 HydrophobicContact CB-CD1 3.47Å; A189-F206 VanDerWaalsContact CB-CD1 3.47Å; A189-F206 HydrophobicContact CB-CE1 3.75Å; A189-F206 HydrophobicContact CB-CG 4.2Å
190	D	95.6	Very high	94.5	Very high	24 Å²	24	27.4 Å²	27.4	13%	0.128	13%	0.133	C	C	.	.	H	α-helix	trans	-65.3	-40.9	174.5	-89.7	-29.2	0	0	0	112.3	F186 F188 M192 H193 K194 L203 K207 I262	F186-D190 WeakPolarHBondContact O-CB 3.38Å; F186-D190 PolarHBondContact O-N 3.29Å; F188-D190 VanDerWaalsContact C-N 3.32Å; F188-D190 PolarHBondContact O-N 2.9Å; D190-M192 VanDerWaalsContact C-N 3.31Å; D190-M192 PolarHBondContact O-N 3.33Å; D190-H193 PolarHBondContact O-N 2.85Å; D190-K194 WeakPolarHBondContact O-CG 3.39Å; D190-K194 PolarHBondContact O-N 3.1Å; D190-L203 WeakPolarHBondContact OD1-CD1 3.45Å; D190-L203 VanDerWaalsContact OD1-CD2 3.31Å; D190-L203 WeakPolarHBondContact OD1-CD2 3.5Å; D190-K207 WeakPolarHBondContact OD1-CE 3.45Å; D190-K207 IonicContact OD1-NZ 3.8Å; D190-K207 PolarHBondContact OD1-NZ 3.49Å; D190-K207 WeakPolarHBondContact OD2-CE 3.21Å; D190-K207 IonicContact OD2-NZ 3.56Å; D190-K207 PolarHBondContact OD2-NZ 3.19Å; D190-I262 HydrophobicContact CB-CD1 3.42Å; D190-I262 VanDerWaalsContact CB-CD1 3.42Å; D190-I262 HydrophobicContact CB-CG1 4.4Å; D190-I262 HydrophobicContact CB-CG2 4.27Å
191	A	96	Very high	94.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.3	-39.5	174.6	0	0	0	0	0	111.6	A187 F188 H193 K194 C195 F255 A258 Y259 I262	A187-A191 WeakPolarHBondContact O-CB 3.49Å; A187-A191 PolarHBondContact O-N 3.38Å; F188-A191 PolarHBondContact O-N 3.28Å; A191-H193 VanDerWaalsContact C-N 3.34Å; A191-H193 PolarHBondContact O-N 2.91Å; A191-K194 PolarHBondContact O-N 3.14Å; A191-C195 PolarHBondContact O-N 3.31Å; A191-C195 VanDerWaalsContact O-N 3.17Å; A191-F255 HydrophobicContact CB-CD2 4.2Å; A191-F255 HydrophobicContact CB-CE2 3.76Å; A191-F255 HydrophobicContact CB-CZ 4.3Å; A191-A258 HydrophobicContact CB-CB 4.24Å; A191-Y259 HydrophobicContact CB-CD2 4.25Å; A191-Y259 HydrophobicContact CB-CG 4.44Å; A191-I262 HydrophobicContact CB-CD1 4.22Å
192	M	95.1	Very high	94.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.6	-43.7	174.2	-70.8	174.5	63.6	0	0	111.9	F135 G147 Q151 F188 A189 D190 C195 N196 Y197 L198 F255	F135-M192 HydrophobicContact CE2-CE 3.63Å; F135-M192 HydrophobicContact CZ-CE 3.69Å; F135-M192 HydrophobicContact CZ-CG 4.5Å; F135-M192 HydrophobicContact CZ-SD 4.21Å; G147-M192 WeakPolarHBondContact O-CE 3.42Å; Q151-M192 HydrophobicContact CB-CE 4.45Å; Q151-M192 HydrophobicContact CB-SD 4.06Å; Q151-M192 HydrophobicContact CG-SD 4.11Å; F188-M192 HydrophobicContact CD1-CG 3.97Å; F188-M192 HydrophobicContact CD1-SD 3.57Å; F188-M192 VanDerWaalsContact CD1-SD 3.57Å; F188-M192 HydrophobicContact CE1-CG 3.91Å; F188-M192 HydrophobicContact CE1-SD 3.52Å; F188-M192 VanDerWaalsContact CE1-SD 3.52Å; F188-M192 WeakPolarHBondContact O-CG 3.44Å; F188-M192 PolarHBondContact O-N 3.12Å; A189-M192 WeakPolarHBondContact O-CB 3.39Å; A189-M192 PolarHBondContact O-N 3.31Å; D190-M192 VanDerWaalsContact C-N 3.31Å; D190-M192 PolarHBondContact O-N 3.33Å; M192-C195 PolarHBondContact O-N 2.98Å; M192-N196 PolarHBondContact O-N 2.95Å; M192-Y197 WeakPolarHBondContact O-CA 3.36Å; M192-Y197 WeakPolarHBondContact O-CB 3.44Å; M192-Y197 PolarHBondContact O-N 3.18Å; M192-L198 HydrophobicContact CB-CB 4.11Å; M192-L198 HydrophobicContact CE-CB 4.48Å; M192-F255 HydrophobicContact CG-CE2 3.96Å
193	H	94.8	Very high	94.2	Very high	59 Å²	59	32.8 Å²	32.8	27%	0.273	15%	0.154	S	C	.	.	H	α-helix	trans	-64.5	-44.5	177.5	179.6	57.4	0	0	0	112.1	A189 D190 A191 C195 N196 L198 L203	A189-H193 PolarHBondContact O-N 3.49Å; D190-H193 PolarHBondContact O-N 2.85Å; A191-H193 VanDerWaalsContact C-N 3.34Å; A191-H193 PolarHBondContact O-N 2.91Å; H193-C195 PolarHBondContact O-N 3.27Å; H193-N196 PolarHBondContact O-N 3.44Å; H193-L198 PolarHBondContact ND1-O 2.81Å; H193-L203 HydrophobicContact CB-CB 4.32Å; H193-L203 HydrophobicContact CB-CD1 4.45Å; H193-L203 HydrophobicContact CB-CD2 3.69Å; H193-L203 HydrophobicContact CB-CG 4.37Å; H193-L203 VanDerWaalsContact CD2-CD2 3.48Å; H193-L203 WeakPolarHBondContact CD2-CD2 3.22Å
194	K	95.2	Very high	94.1	Very high	107 Å²	107	36.9 Å²	36.9	47%	0.465	18%	0.176	S	C	.	.	H	α-helix	trans	-56.1	-35.3	176.5	-76.8	179.5	175.3	-178.4	0	112.8	D190 A191 A258 I262	D190-K194 WeakPolarHBondContact O-CG 3.39Å; D190-K194 PolarHBondContact O-N 3.1Å; A191-K194 PolarHBondContact O-N 3.14Å; K194-A258 HydrophobicContact CB-CB 4.28Å; K194-A258 HydrophobicContact CD-CB 3.9Å; K194-I262 HydrophobicContact CD-CD1 3.91Å
195	C	93.4	Very high	94.1	Very high	11 Å²	11	37.6 Å²	37.6	7%	0.074	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	14.2	178.4	-61.3	0	0	0	0	114.2	A191 M192 H193 Y197 F255	A191-C195 PolarHBondContact O-N 3.31Å; A191-C195 VanDerWaalsContact O-N 3.17Å; M192-C195 PolarHBondContact O-N 2.98Å; H193-C195 PolarHBondContact O-N 3.27Å; C195-Y197 VanDerWaalsContact C-N 3.31Å; C195-Y197 HydrophobicContact CB-CD1 4.29Å; C195-Y197 HydrophobicContact CB-CD2 3.91Å; C195-Y197 HydrophobicContact CB-CE1 3.94Å; C195-Y197 HydrophobicContact CB-CE2 3.54Å; C195-Y197 HydrophobicContact CB-CG 4.25Å; C195-Y197 WeakPolarHBondContact O-CD1 3.33Å; C195-Y197 WeakPolarHBondContact O-CE1 3.48Å; C195-Y197 PolarHBondContact O-N 3.44Å; C195-F255 HydrophobicContact CB-CD2 4.37Å; C195-F255 WeakPolarHBondContact SG-CA 3.47Å
196	N	92.4	Very high	94.1	Very high	127 Å²	127	37.7 Å²	37.7	68%	0.679	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.6	33.1	-178.8	-59.1	-54	0	0	0	114.6	I142 M192 H193	I142-N196 VanDerWaalsContact CD1-O 3.24Å; I142-N196 WeakPolarHBondContact CD1-O 3.31Å; M192-N196 PolarHBondContact O-N 2.95Å; H193-N196 PolarHBondContact O-N 3.44Å
197	Y	92.6	Very high	94.1	Very high	24 Å²	24	39.6 Å²	39.6	9%	0.094	19%	0.187	C	C	.	.	S	Bend	trans	-95	-13	174.6	-55.1	-22.2	0	0	0	113.1	L141 M192 C195 N250 F255	L141-Y197 HydrophobicContact CD1-CD1 3.97Å; L141-Y197 HydrophobicContact CD1-CD2 4.49Å; L141-Y197 HydrophobicContact CD1-CG 3.8Å; M192-Y197 WeakPolarHBondContact O-CA 3.36Å; M192-Y197 WeakPolarHBondContact O-CB 3.44Å; M192-Y197 PolarHBondContact O-N 3.18Å; C195-Y197 VanDerWaalsContact C-N 3.31Å; C195-Y197 HydrophobicContact CB-CD1 4.29Å; C195-Y197 HydrophobicContact CB-CD2 3.91Å; C195-Y197 HydrophobicContact CB-CE1 3.94Å; C195-Y197 HydrophobicContact CB-CE2 3.54Å; C195-Y197 HydrophobicContact CB-CG 4.25Å; C195-Y197 WeakPolarHBondContact O-CD1 3.33Å; C195-Y197 WeakPolarHBondContact O-CE1 3.48Å; C195-Y197 PolarHBondContact O-N 3.44Å; Y197-N250 HydrophobicContact CE1-CB 4.04Å; Y197-N250 HydrophobicContact CE2-CB 4.04Å; Y197-N250 WeakPolarHBondContact CE2-O 3.43Å; Y197-N250 WeakPolarHBondContact OH-CA 3.32Å; Y197-N250 PolarHBondContact OH-O 3.4Å; Y197-F255 HydrophobicContact CD2-CD2 4.04Å; Y197-F255 HydrophobicContact CD2-CE2 4.33Å; Y197-F255 HydrophobicContact CE2-CB 4.28Å; Y197-F255 AromaticContact CE2-CD2 3.67Å; Y197-F255 HydrophobicContact CE2-CD2 3.67Å; Y197-F255 HydrophobicContact CE2-CE2 4.35Å; Y197-F255 HydrophobicContact CE2-CG 4.13Å
198	L	92.5	Very high	94	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	22%	0.215	C	C	.	.	S	Bend	trans	-141.1	132.2	-177.1	-176.3	62.4	0	0	0	109.6	L148 A189 M192 H193 L203	L148-L198 HydrophobicContact CB-CD1 3.69Å; L148-L198 HydrophobicContact CD1-CD1 4Å; L148-L198 HydrophobicContact CD1-CD2 4.31Å; L148-L198 HydrophobicContact CD2-CD1 4.28Å; L148-L198 HydrophobicContact CG-CD1 4.19Å; A189-L198 HydrophobicContact CB-CD2 4.35Å; M192-L198 HydrophobicContact CB-CB 4.11Å; M192-L198 HydrophobicContact CE-CB 4.48Å; H193-L198 PolarHBondContact ND1-O 2.81Å; L198-L203 HydrophobicContact CD2-CB 3.97Å; L198-L203 HydrophobicContact CD2-CD1 4.27Å; L198-L203 HydrophobicContact CG-CB 4.42Å
199	S	93	Very high	93.9	Very high	27 Å²	27	45.2 Å²	45.2	19%	0.189	22%	0.215	C	C	.	.			trans	-64.4	158.3	173.1	72.5	0	0	0	0	111.8	R201 G202 L203 E359	S199-R201 PolarHBondContact O-N 3.31Å; S199-G202 PolarHBondContact O-N 2.95Å; S199-G202 PolarHBondContact OG-N 3.27Å; S199-L203 PolarHBondContact O-N 3.28Å; S199-E359 WeakPolarHBondContact CB-OE1 3.5Å; S199-E359 PolarHBondContact N-OE1 2.76Å; S199-E359 VanDerWaalsContact N-OE1 3.09Å; S199-E359 PolarHBondContact OG-OE1 2.95Å; S199-E359 PolarHBondContact OG-OE2 2.86Å
200	E	93	Very high	93.9	Very high	133 Å²	133	45.7 Å²	45.7	62%	0.621	22%	0.217	S	C	*	.	H	α-helix	trans	-56.9	-39.8	173.6	-175	178.7	-172.1	0	0	111.7	L203 L204	E200-L203 PolarHBondContact O-N 3.48Å; E200-L204 HydrophobicContact CG-CD1 4.21Å; E200-L204 VanDerWaalsContact O-CG 3.3Å; E200-L204 WeakPolarHBondContact O-CG 3.29Å; E200-L204 PolarHBondContact O-N 3.19Å
201	R	92.1	Very high	93.8	Very high	115 Å²	115	48.2 Å²	48.2	43%	0.434	23%	0.233	S	C	.	.	H	α-helix	trans	-63.6	-45.8	177.6	-173.6	172.5	178.3	150.3	1.5	111.5	S199 L203 L204 W205 E356	S199-R201 PolarHBondContact O-N 3.31Å; R201-L203 VanDerWaalsContact C-N 3.33Å; R201-L203 PolarHBondContact O-N 3.48Å; R201-L204 PolarHBondContact O-N 3.22Å; R201-W205 PolarHBondContact O-N 2.89Å; R201-E356 IonicContact CZ-OE2 2.95Å; R201-E356 VanDerWaalsContact CZ-OE2 3.28Å; R201-E356 IonicContact NH1-OE2 3.14Å; R201-E356 PolarHBondContact NH1-OE2 3.19Å; R201-E356 IonicContact NH2-OE2 3.61Å; R201-E356 PolarHBondContact NH2-OE2 3.18Å
202	G	92.4	Very high	93.7	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.4	-40.2	175.9	0	0	0	0	0	112.6	S199 F206	S199-G202 PolarHBondContact O-N 2.95Å; S199-G202 PolarHBondContact OG-N 3.27Å; G202-F206 WeakPolarHBondContact O-CB 3.47Å; G202-F206 PolarHBondContact O-N 3.01Å
203	L	94	Very high	93.7	Very high	11 Å²	11	53.4 Å²	53.4	6%	0.058	26%	0.259	C	S	.	.	H	α-helix	trans	-63.5	-49.3	175.2	177.2	64.6	0	0	0	112.2	A189 D190 H193 L198 S199 E200 R201 W205 F206 K207	A189-L203 HydrophobicContact CB-CD1 3.98Å; D190-L203 WeakPolarHBondContact OD1-CD1 3.45Å; D190-L203 VanDerWaalsContact OD1-CD2 3.31Å; D190-L203 WeakPolarHBondContact OD1-CD2 3.5Å; H193-L203 HydrophobicContact CB-CB 4.32Å; H193-L203 HydrophobicContact CB-CD1 4.45Å; H193-L203 HydrophobicContact CB-CD2 3.69Å; H193-L203 HydrophobicContact CB-CG 4.37Å; H193-L203 VanDerWaalsContact CD2-CD2 3.48Å; H193-L203 WeakPolarHBondContact CD2-CD2 3.22Å; L198-L203 HydrophobicContact CD2-CB 3.97Å; L198-L203 HydrophobicContact CD2-CD1 4.27Å; L198-L203 HydrophobicContact CG-CB 4.42Å; S199-L203 PolarHBondContact O-N 3.28Å; E200-L203 PolarHBondContact O-N 3.48Å; R201-L203 VanDerWaalsContact C-N 3.33Å; R201-L203 PolarHBondContact O-N 3.48Å; L203-W205 VanDerWaalsContact C-N 3.33Å; L203-W205 PolarHBondContact O-N 3.13Å; L203-F206 PolarHBondContact O-N 3.37Å; L203-K207 HydrophobicContact CD1-CD 4.31Å; L203-K207 HydrophobicContact CD1-CG 4.21Å; L203-K207 HydrophobicContact CG-CD 4.28Å; L203-K207 WeakPolarHBondContact O-CB 3.36Å; L203-K207 WeakPolarHBondContact O-CG 3.41Å; L203-K207 PolarHBondContact O-N 3.49Å
204	L	94.4	Very high	93.6	Very high	90 Å²	90	51.7 Å²	51.7	47%	0.471	25%	0.251	S	S	.	.	H	α-helix	trans	-59.5	-45.7	-179.3	-73.7	172.3	0	0	0	111.2	E200 R201 F206 K207 Q208	E200-L204 HydrophobicContact CG-CD1 4.21Å; E200-L204 VanDerWaalsContact O-CG 3.3Å; E200-L204 WeakPolarHBondContact O-CG 3.29Å; E200-L204 PolarHBondContact O-N 3.19Å; R201-L204 PolarHBondContact O-N 3.22Å; L204-F206 PolarHBondContact O-N 3.34Å; L204-K207 PolarHBondContact O-N 3.12Å; L204-Q208 WeakPolarHBondContact O-CB 3.04Å; L204-Q208 VanDerWaalsContact O-CG 3.28Å; L204-Q208 WeakPolarHBondContact O-CG 3.46Å; L204-Q208 PolarHBondContact O-N 3.29Å
205	W	93.7	Very high	93.4	Very high	16 Å²	16	53.2 Å²	53.2	6%	0.061	26%	0.26	C	S	.	.	H	α-helix	trans	-60.3	-45.3	175.3	174.8	86.4	0	0	0	111.8	L148 Y152 R201 L203 K207 Q208 S209 V351 E352 I353 P354 M357 L360	L148-W205 HydrophobicContact CD2-CE3 3.75Å; L148-W205 HydrophobicContact CD2-CZ3 3.98Å; L148-W205 HydrophobicContact CG-CZ3 4.39Å; Y152-W205 AromaticContact CD2-CH2 3.8Å; Y152-W205 HydrophobicContact CD2-CH2 3.8Å; Y152-W205 HydrophobicContact CD2-CZ3 4.09Å; Y152-W205 AromaticContact CE2-CH2 3.68Å; Y152-W205 HydrophobicContact CE2-CH2 3.68Å; Y152-W205 HydrophobicContact CE2-CZ3 4.37Å; Y152-W205 HydrophobicContact CG-CH2 4.32Å; R201-W205 PolarHBondContact O-N 2.89Å; L203-W205 VanDerWaalsContact C-N 3.33Å; L203-W205 PolarHBondContact O-N 3.13Å; W205-K207 PolarHBondContact O-N 2.76Å; W205-Q208 PolarHBondContact O-N 2.95Å; W205-S209 WeakPolarHBondContact O-CB 3.12Å; W205-S209 PolarHBondContact O-N 2.84Å; W205-S209 PolarHBondContact O-OG 3.46Å; W205-V351 HydrophobicContact CH2-CG1 4.36Å; W205-V351 HydrophobicContact CZ2-CG1 3.66Å; W205-E352 PolarHBondContact NE1-O 2.9Å; W205-I353 HydrophobicContact CH2-CG1 4.42Å; W205-I353 HydrophobicContact CZ2-CG1 3.72Å; W205-P354 VanDerWaalsContact CD1-CD 3.41Å; W205-M357 HydrophobicContact CB-SD 3.96Å; W205-M357 HydrophobicContact CD2-CE 3.87Å; W205-M357 HydrophobicContact CD2-SD 4.4Å; W205-M357 HydrophobicContact CE3-CE 4.11Å; W205-M357 HydrophobicContact CG-CE 4.07Å; W205-M357 HydrophobicContact CG-SD 4.08Å; W205-L360 HydrophobicContact CE3-CD1 3.83Å; W205-L360 HydrophobicContact CH2-CD1 3.26Å; W205-L360 HydrophobicContact CZ2-CD1 4.03Å; W205-L360 HydrophobicContact CZ3-CD1 3.16Å
206	F	94.4	Very high	93.3	Very high	1 Å²	1	55.6 Å²	55.6	0%	0.004	27%	0.272	C	S	.	.	H	α-helix	trans	-64	-43.4	-179.6	-174.1	-94.6	0	0	0	111.3	L148 Q151 Y152 Y155 E185 A189 G202 L203 L204 S209 H210	L148-F206 HydrophobicContact CD1-CB 3.99Å; L148-F206 HydrophobicContact CD1-CD2 3.78Å; L148-F206 HydrophobicContact CD1-CG 4.13Å; Q151-F206 HydrophobicContact CG-CE2 4.08Å; Q151-F206 HydrophobicContact CG-CZ 4.11Å; Y152-F206 HydrophobicContact CD2-CE2 4.37Å; Y155-F206 HydrophobicContact CD1-CE2 4.38Å; Y155-F206 HydrophobicContact CD2-CZ 4.46Å; Y155-F206 HydrophobicContact CG-CE2 4.24Å; Y155-F206 HydrophobicContact CG-CZ 4.11Å; E185-F206 HydrophobicContact CB-CE1 4.41Å; E185-F206 HydrophobicContact CB-CZ 4.23Å; A189-F206 HydrophobicContact CB-CD1 3.47Å; A189-F206 VanDerWaalsContact CB-CD1 3.47Å; A189-F206 HydrophobicContact CB-CE1 3.75Å; A189-F206 HydrophobicContact CB-CG 4.2Å; G202-F206 WeakPolarHBondContact O-CB 3.47Å; G202-F206 PolarHBondContact O-N 3.01Å; L203-F206 PolarHBondContact O-N 3.37Å; L204-F206 PolarHBondContact O-N 3.34Å; F206-S209 PolarHBondContact O-N 3.18Å; F206-H210 HydrophobicContact CE1-CB 4.44Å; F206-H210 WeakPolarHBondContact O-CB 2.96Å; F206-H210 PolarHBondContact O-N 2.57Å
207	K	94.9	Very high	93.3	Very high	69 Å²	69	49.6 Å²	49.6	30%	0.3	24%	0.24	S	C	.	.	H	α-helix	trans	-61.7	-44.4	176.6	-79.5	-174.6	169.2	178.6	0	112.7	D190 L203 L204 W205 T211	D190-K207 WeakPolarHBondContact OD1-CE 3.45Å; D190-K207 IonicContact OD1-NZ 3.8Å; D190-K207 PolarHBondContact OD1-NZ 3.49Å; D190-K207 WeakPolarHBondContact OD2-CE 3.21Å; D190-K207 IonicContact OD2-NZ 3.56Å; D190-K207 PolarHBondContact OD2-NZ 3.19Å; L203-K207 HydrophobicContact CD1-CD 4.31Å; L203-K207 HydrophobicContact CD1-CG 4.21Å; L203-K207 HydrophobicContact CG-CD 4.28Å; L203-K207 WeakPolarHBondContact O-CB 3.36Å; L203-K207 WeakPolarHBondContact O-CG 3.41Å; L203-K207 PolarHBondContact O-N 3.49Å; L204-K207 PolarHBondContact O-N 3.12Å; W205-K207 PolarHBondContact O-N 2.76Å; K207-T211 WeakPolarHBondContact O-CB 3.39Å; K207-T211 PolarHBondContact O-N 3.26Å; K207-T211 PolarHBondContact O-OG1 3.49Å
208	Q	94	Very high	93.4	Very high	125 Å²	125	48.8 Å²	48.8	58%	0.584	24%	0.237	S	C	*	.	H	α-helix	trans	-62.3	-50.3	176.8	-74.3	173.9	-5.7	0	0	110.8	L204 W205 H210 T211 M212	L204-Q208 WeakPolarHBondContact O-CB 3.04Å; L204-Q208 VanDerWaalsContact O-CG 3.28Å; L204-Q208 WeakPolarHBondContact O-CG 3.46Å; L204-Q208 PolarHBondContact O-N 3.29Å; W205-Q208 PolarHBondContact O-N 2.95Å; Q208-H210 PolarHBondContact O-N 3.09Å; Q208-T211 PolarHBondContact O-N 3.04Å; Q208-M212 WeakPolarHBondContact O-CG 3.24Å; Q208-M212 PolarHBondContact O-N 3.45Å
209	S	93	Very high	93.5	Very high	9 Å²	9	51 Å²	51	6%	0.063	25%	0.247	C	C	.	.	H	α-helix	trans	-57.8	-51.6	178	-58.5	0	0	0	0	110.8	W205 F206 T211 M212 T213	W205-S209 WeakPolarHBondContact O-CB 3.12Å; W205-S209 PolarHBondContact O-N 2.84Å; W205-S209 PolarHBondContact O-OG 3.46Å; F206-S209 PolarHBondContact O-N 3.18Å; S209-T211 PolarHBondContact O-N 3.29Å; S209-M212 PolarHBondContact O-N 3.48Å; S209-T213 WeakPolarHBondContact O-CG2 3.43Å; S209-T213 PolarHBondContact O-N 3.11Å; S209-T213 PolarHBondContact O-OG1 3.44Å
210	H	95.3	Very high	93.6	Very high	10 Å²	10	49.7 Å²	49.7	5%	0.046	24%	0.238	C	C	.	.	H	α-helix	trans	-55.6	-46.4	177.4	-179.8	-87.9	0	0	0	112.4	Y155 P182 F183 F186 F206 Q208 M212 T213 I214	Y155-H210 AromaticContact CE2-CD2 3.42Å; Y155-H210 VanDerWaalsContact CE2-CD2 3.42Å; Y155-H210 WeakPolarHBondContact CE2-CD2 3.46Å; Y155-H210 AromaticContact CZ-CD2 3.81Å; P182-H210 PolarHBondContact O-NE2 2.63Å; F183-H210 PolarHBondContact O-CE1 2.83Å; F186-H210 AromaticContact CD1-CE1 3.75Å; F206-H210 HydrophobicContact CE1-CB 4.44Å; F206-H210 WeakPolarHBondContact O-CB 2.96Å; F206-H210 PolarHBondContact O-N 2.57Å; Q208-H210 PolarHBondContact O-N 3.09Å; H210-M212 PolarHBondContact O-N 3.33Å; H210-T213 PolarHBondContact O-N 2.79Å; H210-T213 PolarHBondContact O-OG1 3.43Å; H210-I214 WeakPolarHBondContact O-CB 3.49Å; H210-I214 WeakPolarHBondContact O-CG2 3.34Å; H210-I214 PolarHBondContact O-N 2.9Å
211	T	94.1	Very high	93.6	Very high	77 Å²	77	43.8 Å²	43.8	47%	0.472	21%	0.21	S	C	.	.	H	α-helix	trans	-61.1	-45.3	179.4	-57.6	0	0	0	0	111.2	K207 Q208 S209 E215	K207-T211 WeakPolarHBondContact O-CB 3.39Å; K207-T211 PolarHBondContact O-N 3.26Å; K207-T211 PolarHBondContact O-OG1 3.49Å; Q208-T211 PolarHBondContact O-N 3.04Å; S209-T211 PolarHBondContact O-N 3.29Å; T211-E215 WeakPolarHBondContact O-CG 3.41Å
212	M	94	Very high	93.8	Very high	109 Å²	109	38.3 Å²	38.3	54%	0.537	19%	0.189	S	C	.	.	H	α-helix	trans	-65.9	-41.6	179.5	-69.9	174.6	60.3	0	0	112.6	Q208 S209 H210 N216	Q208-M212 WeakPolarHBondContact O-CG 3.24Å; Q208-M212 PolarHBondContact O-N 3.45Å; S209-M212 PolarHBondContact O-N 3.48Å; H210-M212 PolarHBondContact O-N 3.33Å; M212-N216 PolarHBondContact O-ND2 3.05Å
213	T	94.6	Very high	94	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-78.6	-37.7	-175.1	51.1	0	0	0	0	112	Y155 S209 H210 E215 N216 V347 F348 V351	Y155-T213 WeakPolarHBondContact OH-CB 3.48Å; Y155-T213 PolarHBondContact OH-OG1 3.4Å; S209-T213 WeakPolarHBondContact O-CG2 3.43Å; S209-T213 PolarHBondContact O-N 3.11Å; S209-T213 PolarHBondContact O-OG1 3.44Å; H210-T213 PolarHBondContact O-N 2.79Å; H210-T213 PolarHBondContact O-OG1 3.43Å; T213-E215 VanDerWaalsContact C-N 3.31Å; T213-E215 PolarHBondContact O-N 3.33Å; T213-N216 WeakPolarHBondContact O-CB 3.23Å; T213-N216 PolarHBondContact O-N 3.24Å; T213-V347 HydrophobicContact CG2-CG1 3.44Å; T213-V347 VanDerWaalsContact CG2-CG1 3.44Å; T213-F348 HydrophobicContact CG2-CD1 4.17Å; T213-F348 HydrophobicContact CG2-CE1 3.93Å; T213-F348 HydrophobicContact CG2-CZ 4.25Å; T213-V351 HydrophobicContact CG2-CG2 3.6Å
214	I	93.5	Very high	94.1	Very high	22 Å²	22	37.8 Å²	37.8	11%	0.113	19%	0.186	C	C	.	.	H	α-helix	trans	-68.7	-26.4	-174.5	-149.3	71.5	0	0	0	113.5	P182 F183 H210 N216 L217	P182-I214 HydrophobicContact CB-CD1 3.78Å; P182-I214 HydrophobicContact CG-CD1 3.91Å; P182-I214 WeakPolarHBondContact O-CD1 3.24Å; F183-I214 HydrophobicContact CD1-CD1 3.72Å; F183-I214 HydrophobicContact CD1-CG1 3.27Å; F183-I214 HydrophobicContact CE1-CD1 3.98Å; F183-I214 HydrophobicContact CE1-CG1 3.57Å; F183-I214 HydrophobicContact CG-CD1 4.19Å; F183-I214 HydrophobicContact CG-CG1 4.16Å; H210-I214 WeakPolarHBondContact O-CB 3.49Å; H210-I214 WeakPolarHBondContact O-CG2 3.34Å; H210-I214 PolarHBondContact O-N 2.9Å; I214-N216 PolarHBondContact O-N 3.21Å; I214-N216 VanDerWaalsContact O-N 3.17Å; I214-L217 HydrophobicContact CD1-CD1 4.25Å; I214-L217 PolarHBondContact O-N 2.87Å; I214-L217 VanDerWaalsContact O-N 3.11Å
215	E	90.5	Very high	94.2	Very high	139 Å²	139	33.9 Å²	33.9	65%	0.65	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-21.8	175.8	-74.2	-176	170.4	0	0	113.2	T211 T213 L217	T211-E215 WeakPolarHBondContact O-CG 3.41Å; T213-E215 VanDerWaalsContact C-N 3.31Å; T213-E215 PolarHBondContact O-N 3.33Å; E215-L217 VanDerWaalsContact C-N 3.29Å; E215-L217 PolarHBondContact O-N 3.48Å
216	N	91.2	Very high	94.3	Very high	62 Å²	62	33.1 Å²	33.1	33%	0.332	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-11	178.7	-75.1	-80.6	0	0	0	114.1	M212 T213 I214 K343 V347	M212-N216 PolarHBondContact O-ND2 3.05Å; T213-N216 WeakPolarHBondContact O-CB 3.23Å; T213-N216 PolarHBondContact O-N 3.24Å; I214-N216 PolarHBondContact O-N 3.21Å; I214-N216 VanDerWaalsContact O-N 3.17Å; N216-K343 PolarHBondContact O-NZ 3.09Å; N216-V347 HydrophobicContact CB-CG2 3.69Å; N216-V347 VanDerWaalsContact CG-CG2 3.46Å
217	L	93.1	Very high	94.4	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	19%	0.19	C	C	.	.	S	Bend	trans	-101	153.4	176.7	-64.4	-177.5	0	0	0	111.4	Y159 Y162 L163 L166 P182 F183 I214 E215	Y159-L217 HydrophobicContact CD2-CD1 3.51Å; Y159-L217 HydrophobicContact CD2-CG 4.16Å; Y159-L217 HydrophobicContact CE1-CD2 4.11Å; Y159-L217 HydrophobicContact CE1-CG 4.46Å; Y159-L217 HydrophobicContact CE2-CD1 3.38Å; Y159-L217 HydrophobicContact CE2-CD2 4.05Å; Y159-L217 HydrophobicContact CE2-CG 3.49Å; Y159-L217 VanDerWaalsContact CE2-CG 3.49Å; Y159-L217 HydrophobicContact CG-CD1 4.12Å; Y162-L217 HydrophobicContact CD1-CB 4.34Å; Y162-L217 HydrophobicContact CD1-CD1 3.74Å; Y162-L217 HydrophobicContact CD1-CD2 4.13Å; Y162-L217 HydrophobicContact CD1-CG 4.3Å; Y162-L217 HydrophobicContact CE1-CB 4.26Å; Y162-L217 HydrophobicContact CE1-CD1 4.39Å; Y162-L217 HydrophobicContact CG-CD1 4.27Å; L163-L217 HydrophobicContact CD2-CD2 3.51Å; L163-L217 HydrophobicContact CG-CD2 4.06Å; L166-L217 HydrophobicContact CD1-CD2 4.36Å; P182-L217 HydrophobicContact CB-CD1 4.46Å; P182-L217 HydrophobicContact CG-CD1 3.62Å; F183-L217 HydrophobicContact CE1-CB 4.48Å; F183-L217 HydrophobicContact CZ-CB 4.22Å; I214-L217 HydrophobicContact CD1-CD1 4.25Å; I214-L217 PolarHBondContact O-N 2.87Å; I214-L217 VanDerWaalsContact O-N 3.11Å; E215-L217 VanDerWaalsContact C-N 3.29Å; E215-L217 PolarHBondContact O-N 3.48Å
218	W	93.1	Very high	94.3	Very high	6 Å²	6	37.3 Å²	37.3	2%	0.023	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-86.2	128.7	171.6	-72.1	13.6	0	0	0	110.7	Y162 F170 Q319 W320 A323 L330 Y333 F337	Y162-W218 VanDerWaalsContact CE1-O 3.25Å; Y162-W218 WeakPolarHBondContact CE1-O 3.33Å; Y162-W218 VanDerWaalsContact CZ-O 3.31Å; Y162-W218 PolarHBondContact OH-O 3.41Å; F170-W218 HydrophobicContact CE1-CH2 4.1Å; F170-W218 HydrophobicContact CE1-CZ3 4.25Å; F170-W218 HydrophobicContact CE2-CE3 4.48Å; F170-W218 HydrophobicContact CE2-CZ3 4.32Å; F170-W218 AromaticContact CZ-CE3 3.94Å; F170-W218 HydrophobicContact CZ-CE3 3.94Å; F170-W218 AromaticContact CZ-CH2 3.63Å; F170-W218 HydrophobicContact CZ-CH2 3.63Å; F170-W218 HydrophobicContact CZ-CZ2 4.4Å; F170-W218 AromaticContact CZ-CZ3 3.44Å; F170-W218 HydrophobicContact CZ-CZ3 3.44Å; F170-W218 VanDerWaalsContact CZ-CZ3 3.44Å; W218-Q319 VanDerWaalsContact CA-OE1 3.25Å; W218-Q319 HydrophobicContact CD2-CB 4.1Å; W218-Q319 HydrophobicContact CG-CB 4.16Å; W218-W320 HydrophobicContact CB-CZ2 3.99Å; W218-W320 AromaticContact CE3-CD2 3.54Å; W218-W320 HydrophobicContact CE3-CD2 3.54Å; W218-W320 AromaticContact CE3-CE2 3.74Å; W218-W320 AromaticContact CE3-CE3 3.42Å; W218-W320 HydrophobicContact CE3-CE3 3.42Å; W218-W320 VanDerWaalsContact CE3-CE3 3.42Å; W218-W320 HydrophobicContact CE3-CG 4.28Å; W218-W320 AromaticContact CE3-CH2 3.71Å; W218-W320 HydrophobicContact CE3-CH2 3.71Å; W218-W320 AromaticContact CE3-CZ2 3.83Å; W218-W320 HydrophobicContact CE3-CZ2 3.83Å; W218-W320 AromaticContact CE3-CZ3 3.51Å; W218-W320 HydrophobicContact CE3-CZ3 3.51Å; W218-W320 AromaticContact CZ3-CD2 3.93Å; W218-W320 HydrophobicContact CZ3-CD2 3.93Å; W218-W320 AromaticContact CZ3-CE3 3.44Å; W218-W320 HydrophobicContact CZ3-CE3 3.44Å; W218-W320 VanDerWaalsContact CZ3-CE3 3.44Å; W218-W320 HydrophobicContact CZ3-CH2 4.29Å; W218-W320 AromaticContact CZ3-CZ3 3.64Å; W218-W320 HydrophobicContact CZ3-CZ3 3.64Å; W218-A323 HydrophobicContact CH2-CB 3.08Å; W218-A323 HydrophobicContact CZ2-CB 3.76Å; W218-A323 HydrophobicContact CZ3-CB 3.83Å; W218-L330 HydrophobicContact CH2-CD1 4.46Å; W218-Y333 AromaticContact CE2-CD1 3.97Å; W218-Y333 HydrophobicContact CH2-CD2 4.1Å; W218-Y333 HydrophobicContact CH2-CG 4.19Å; W218-Y333 AromaticContact CZ2-CD1 3.74Å; W218-Y333 HydrophobicContact CZ2-CD1 3.74Å; W218-Y333 AromaticContact CZ2-CD2 3.4Å; W218-Y333 HydrophobicContact CZ2-CD2 3.4Å; W218-Y333 HydrophobicContact CZ2-CE1 4.01Å; W218-Y333 AromaticContact CZ2-CE2 3.69Å; W218-Y333 HydrophobicContact CZ2-CE2 3.69Å; W218-Y333 AromaticContact CZ2-CG 3.42Å; W218-Y333 HydrophobicContact CZ2-CG 3.42Å; W218-Y333 VanDerWaalsContact CZ2-CG 3.42Å; W218-Y333 AromaticContact CZ2-CZ 3.99Å; W218-Y333 AromaticContact NE1-CD1 3.76Å; W218-Y333 AromaticContact NE1-CE1 3.55Å; W218-Y333 AromaticContact NE1-CZ 4Å; W218-F337 HydrophobicContact CD2-CZ 4.48Å; W218-F337 HydrophobicContact CG-CZ 4.28Å
219	K	94.8	Very high	94.3	Very high	48 Å²	48	33.3 Å²	33.3	21%	0.209	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-62.9	150.3	177.6	-66.9	-175.9	176.1	84.2	0	110.9	F183 M271 Y274 W320	F183-K219 HydrophobicContact CD1-CG 4.43Å; F183-K219 HydrophobicContact CE1-CG 3.86Å; F183-K219 HydrophobicContact CZ-CG 4.32Å; K219-M271 HydrophobicContact CD-CE 4.32Å; K219-M271 HydrophobicContact CD-SD 4.02Å; K219-Y274 HydrophobicContact CD-CD1 3.91Å; K219-Y274 HydrophobicContact CD-CD2 3.86Å; K219-Y274 HydrophobicContact CD-CG 3.44Å; K219-Y274 VanDerWaalsContact CD-CG 3.44Å; K219-W320 PolarHBondContact O-NE1 3.25Å
220	P	95.4	Very high	94.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-66.4	164	-178.3	28.9	-36.1	0	0	0	112.2	V69 V71 I223 S275	V69-P220 HydrophobicContact CB-CB 4.42Å; V69-P220 HydrophobicContact CG1-CB 3.98Å; V71-P220 HydrophobicContact CB-CB 4.29Å; V71-P220 HydrophobicContact CB-CG 4.31Å; V71-P220 HydrophobicContact CG2-CB 3.62Å; V71-P220 HydrophobicContact CG2-CG 3.88Å; P220-I223 HydrophobicContact CB-CG1 4.5Å; P220-I223 HydrophobicContact CG-CD1 3.95Å; P220-I223 HydrophobicContact CG-CG1 3.59Å; P220-S275 WeakPolarHBondContact O-CB 3.49Å; P220-S275 PolarHBondContact O-OG 3.4Å
221	H	93.9	Very high	94.1	Very high	8 Å²	8	40.3 Å²	40.3	4%	0.037	20%	0.195	C	C	.	.	S	Bend	trans	-78.7	-42.4	172.6	-63.2	83.1	0	0	0	110.7	K68 V69 H276 L305 F317 W320	K68-H221 HydrophobicContact CB-CB 4.18Å; V69-H221 PolarHBondContact N-ND1 3.18Å; V69-H221 PolarHBondContact O-N 3.26Å; H221-H276 PolarHBondContact O-N 3.04Å; H221-L305 HydrophobicContact CB-CD1 4.29Å; H221-L305 HydrophobicContact CB-CD2 4.48Å; H221-F317 HydrophobicContact CB-CE1 4.24Å; H221-F317 WeakPolarHBondContact O-CE1 3.46Å; H221-F317 VanDerWaalsContact O-CZ 3.26Å; H221-F317 WeakPolarHBondContact O-CZ 3.49Å; H221-W320 AromaticContact CE1-CD2 3.2Å; H221-W320 AromaticContact CE1-CE2 3.19Å; H221-W320 AromaticContact CE1-CE3 3.38Å; H221-W320 AromaticContact CE1-CG 3.86Å; H221-W320 AromaticContact CE1-CH2 3.63Å; H221-W320 AromaticContact CE1-CZ2 3.43Å; H221-W320 VanDerWaalsContact CE1-CZ2 3.43Å; H221-W320 WeakPolarHBondContact CE1-CZ2 3.45Å; H221-W320 AromaticContact CE1-CZ3 3.59Å; H221-W320 AromaticContact CE1-NE1 3.76Å; H221-W320 AromaticContact ND1-CE2 3.68Å; H221-W320 AromaticContact ND1-CZ2 3.81Å; H221-W320 AromaticContact ND1-NE1 3.94Å; H221-W320 AromaticContact NE2-CD1 3.88Å; H221-W320 AromaticContact NE2-CD2 3.28Å; H221-W320 VanDerWaalsContact NE2-CD2 3.28Å; H221-W320 AromaticContact NE2-CE2 3.69Å; H221-W320 AromaticContact NE2-CE3 3.57Å; H221-W320 AromaticContact NE2-CG 3.48Å; H221-W320 AromaticContact NE2-NE1 3.99Å
222	L	95.2	Very high	94	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	134.2	-177	178.8	63.7	0	0	0	109.9	L24 V69 I70 V71 V224 H276 I278 A300 L305	L24-L222 HydrophobicContact CD1-CD2 4.38Å; V69-L222 PolarHBondContact O-N 3.23Å; I70-L222 WeakPolarHBondContact CA-O 3.43Å; I70-L222 HydrophobicContact CD1-CD2 4.38Å; I70-L222 HydrophobicContact CG1-CB 4.29Å; I70-L222 HydrophobicContact CG1-CD2 4.46Å; I70-L222 HydrophobicContact CG2-CB 4.38Å; I70-L222 HydrophobicContact CG2-CD2 4.24Å; I70-L222 HydrophobicContact CG2-CG 4.34Å; V71-L222 PolarHBondContact N-O 3.46Å; L222-V224 HydrophobicContact CD2-CG2 4.14Å; L222-V224 HydrophobicContact CG-CG2 4.18Å; L222-H276 CarbonylContact C-O 3.25Å; L222-H276 WeakPolarHBondContact CA-O 3.36Å; L222-H276 HydrophobicContact CD1-CB 4.18Å; L222-I278 HydrophobicContact CD1-CB 4.48Å; L222-I278 HydrophobicContact CD1-CD1 3.79Å; L222-I278 HydrophobicContact CD1-CG1 3.85Å; L222-I278 HydrophobicContact CD2-CD1 4.08Å; L222-A300 HydrophobicContact CD2-CB 3.78Å; L222-L305 HydrophobicContact CB-CD1 4.35Å; L222-L305 HydrophobicContact CB-CD2 4.39Å
223	I	97.1	Very high	94	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	119.1	169.3	-59.6	174	0	0	0	107.6	V71 E73 P220 I268 M271 H276 I277 I278	V71-I223 CarbonylContact O-C 3.57Å; V71-I223 VanDerWaalsContact O-CA 3.29Å; V71-I223 WeakPolarHBondContact O-CA 3.27Å; E73-I223 HydrophobicContact CB-CG2 4.24Å; E73-I223 HydrophobicContact CG-CG2 3.86Å; P220-I223 HydrophobicContact CB-CG1 4.5Å; P220-I223 HydrophobicContact CG-CD1 3.95Å; P220-I223 HydrophobicContact CG-CG1 3.59Å; I223-I268 HydrophobicContact CG2-CD1 3.99Å; I223-M271 HydrophobicContact CD1-CB 3.81Å; I223-M271 HydrophobicContact CD1-CG 3.94Å; I223-M271 HydrophobicContact CD1-SD 4.47Å; I223-H276 PolarHBondContact N-O 2.88Å; I223-I277 HydrophobicContact CB-CG1 4.34Å; I223-I277 CarbonylContact O-C 3.57Å; I223-I277 VanDerWaalsContact O-CA 3.3Å; I223-I277 WeakPolarHBondContact O-CA 3.24Å; I223-I278 PolarHBondContact O-N 2.71Å
224	V	96.7	Very high	93.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	107.5	172	179.7	0	0	0	0	107.5	I70 V71 V72 E73 V83 L87 L222 I278 V280 I296	I70-V224 HydrophobicContact CG2-CG2 4.11Å; V71-V224 PolarHBondContact O-N 3.43Å; V72-V224 CarbonylContact C-O 3.43Å; V72-V224 WeakPolarHBondContact CA-O 2.99Å; V72-V224 HydrophobicContact CG1-CB 4.49Å; V72-V224 HydrophobicContact CG2-CB 4.3Å; E73-V224 PolarHBondContact N-O 3.23Å; V83-V224 HydrophobicContact CG1-CG1 4.45Å; L87-V224 HydrophobicContact CD1-CB 4.48Å; L87-V224 HydrophobicContact CD1-CG2 3.98Å; L222-V224 HydrophobicContact CD2-CG2 4.14Å; L222-V224 HydrophobicContact CG-CG2 4.18Å; V224-I278 CarbonylContact C-O 3.56Å; V224-I278 WeakPolarHBondContact CA-O 3.35Å; V224-V280 HydrophobicContact CG1-CG2 3.99Å; V224-I296 HydrophobicContact CG1-CG2 4.31Å
225	Y	96.7	Very high	93.8	Very high	8 Å²	8	40.5 Å²	40.5	3%	0.031	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	118.5	-178.5	174.8	-126	0	0	0	110.6	E73 R227 E260 L263 I268 I278 T279 V280	E73-Y225 HydrophobicContact CB-CD2 4.35Å; Y225-R227 HydrophobicContact CE1-CB 4.13Å; Y225-E260 PolarHBondContact OH-OE1 3.46Å; Y225-L263 HydrophobicContact CD2-CD2 4.34Å; Y225-L263 HydrophobicContact CD2-CG 4.44Å; Y225-L263 HydrophobicContact CE2-CD2 3.6Å; Y225-L263 HydrophobicContact CE2-CG 3.77Å; Y225-I268 HydrophobicContact CD1-CD1 4.46Å; Y225-I268 HydrophobicContact CD1-CG1 4.02Å; Y225-I268 HydrophobicContact CD2-CD1 4.19Å; Y225-I268 HydrophobicContact CD2-CG1 4.14Å; Y225-I268 HydrophobicContact CE1-CG1 4.38Å; Y225-I268 HydrophobicContact CG-CD1 3.89Å; Y225-I268 HydrophobicContact CG-CG1 3.87Å; Y225-I278 PolarHBondContact N-O 2.7Å; Y225-T279 HydrophobicContact CD1-CG2 3.94Å; Y225-T279 CarbonylContact O-C 3.47Å; Y225-T279 WeakPolarHBondContact O-CA 3.12Å; Y225-V280 PolarHBondContact O-N 2.64Å
226	I	95.8	Very high	93.9	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	108.1	178.6	-60.5	160.4	0	0	0	108.7	V72 E73 K80 V83 V280 A282 V287	V72-I226 HydrophobicContact CG1-CD1 3.59Å; V72-I226 HydrophobicContact CG1-CG1 4.35Å; E73-I226 PolarHBondContact O-N 2.88Å; K80-I226 VanDerWaalsContact CA-CD1 3.44Å; K80-I226 HydrophobicContact CB-CD1 3.85Å; V83-I226 HydrophobicContact CB-CD1 3.83Å; V83-I226 HydrophobicContact CG1-CD1 4.32Å; V83-I226 HydrophobicContact CG2-CD1 3.43Å; V83-I226 VanDerWaalsContact CG2-CD1 3.43Å; V83-I226 HydrophobicContact CG2-CG1 4.36Å; I226-V280 WeakPolarHBondContact CA-O 3.45Å; I226-V280 HydrophobicContact CG1-CB 4.45Å; I226-A282 HydrophobicContact CG2-CB 4.18Å; I226-V287 HydrophobicContact CG2-CG2 4.16Å
227	R	95.2	Very high	93.9	Very high	152 Å²	152	32.6 Å²	32.6	57%	0.574	15%	0.147	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.5	118	173.7	-176.7	174.6	-179.3	148.5	3.4	108.6	Y225 V280 A282	Y225-R227 HydrophobicContact CE1-CB 4.13Å; R227-V280 PolarHBondContact N-O 3.41Å; R227-A282 WeakPolarHBondContact O-CB 3.45Å; R227-A282 PolarHBondContact O-N 2.97Å
228	A	93.4	Very high	93.9	Very high	6 Å²	6	39.2 Å²	39.2	5%	0.05	18%	0.176	C	C	.	.			trans	-123.2	134.9	179.2	0	0	0	0	0	110.5	I233 A282	A228-I233 HydrophobicContact CB-CD1 4.2Å; A228-I233 HydrophobicContact CB-CG1 4.02Å; A228-A282 HydrophobicContact CB-CB 3.92Å
229	P	93.3	Very high	93.8	Very high	41 Å²	41	46.9 Å²	46.9	27%	0.266	21%	0.21	S	C	.	.			trans	-66	150.1	173.8	29	-34.3	0	0	0	110.7	E231 Q232 I233	P229-E231 VanDerWaalsContact C-N 3.25Å; P229-E231 PolarHBondContact O-N 3.05Å; P229-Q232 HydrophobicContact CG-CB 4.03Å; P229-Q232 VanDerWaalsContact CG-CD 3.49Å; P229-Q232 HydrophobicContact CG-CG 3.67Å; P229-Q232 PolarHBondContact O-N 3.31Å; P229-I233 PolarHBondContact O-N 3.41Å; P229-I233 VanDerWaalsContact O-N 3.11Å
230	I	92.9	Very high	93.5	Very high	34 Å²	34	49.7 Å²	49.7	17%	0.174	22%	0.219	C	C	.	.	H	α-helix	trans	-63.2	-35.6	-173	-53.5	167.3	0	0	0	111.1	Q232 I233 R234 L256 N257	I230-Q232 VanDerWaalsContact C-N 3.3Å; I230-Q232 PolarHBondContact O-N 3Å; I230-I233 WeakPolarHBondContact O-CB 3.39Å; I230-I233 PolarHBondContact O-N 2.95Å; I230-I233 VanDerWaalsContact O-N 3.12Å; I230-R234 HydrophobicContact CG2-CG 4.19Å; I230-R234 WeakPolarHBondContact O-CB 3.33Å; I230-R234 WeakPolarHBondContact O-CG 3.09Å; I230-R234 PolarHBondContact O-N 3.44Å; I230-L256 HydrophobicContact CG2-CD1 4.36Å; I230-N257 WeakPolarHBondContact CD1-ND2 3.49Å; I230-N257 WeakPolarHBondContact CD1-OD1 3.36Å
231	E	92.3	Very high	93.2	Very high	133 Å²	133	55.6 Å²	55.6	62%	0.621	25%	0.251	S	S	*	.	H	α-helix	trans	-58.3	-46.5	178.9	-61.7	79	-173.1	0	0	110.1	P229 R234 E235	P229-E231 VanDerWaalsContact C-N 3.25Å; P229-E231 PolarHBondContact O-N 3.05Å; E231-R234 PolarHBondContact O-N 3.49Å; E231-E235 WeakPolarHBondContact O-CG 3.48Å; E231-E235 PolarHBondContact O-N 2.97Å
232	Q	92	Very high	93	Very high	52 Å²	52	57.9 Å²	57.9	24%	0.243	26%	0.262	C	S	.	.	H	α-helix	trans	-65.7	-39.4	175.5	-71.4	-177.3	12.8	0	0	112.2	P229 I230 R234 E235 K236 A282	P229-Q232 HydrophobicContact CG-CB 4.03Å; P229-Q232 VanDerWaalsContact CG-CD 3.49Å; P229-Q232 HydrophobicContact CG-CG 3.67Å; P229-Q232 PolarHBondContact O-N 3.31Å; I230-Q232 VanDerWaalsContact C-N 3.3Å; I230-Q232 PolarHBondContact O-N 3Å; Q232-R234 VanDerWaalsContact C-N 3.33Å; Q232-R234 PolarHBondContact O-N 2.95Å; Q232-E235 PolarHBondContact O-N 2.94Å; Q232-K236 WeakPolarHBondContact O-CB 3.41Å; Q232-K236 VanDerWaalsContact O-CG 3.25Å; Q232-K236 WeakPolarHBondContact O-CG 3.41Å; Q232-K236 PolarHBondContact O-N 3.48Å; Q232-A282 PolarHBondContact NE2-O 3.43Å; Q232-A282 PolarHBondContact OE1-O 3.49Å
233	I	93.2	Very high	92.7	Very high	1 Å²	1	63 Å²	63	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-59.6	-46.4	176	-70.4	168.6	0	0	0	109.9	N75 I76 A77 A228 P229 I230 K236 I237 L256	N75-I233 HydrophobicContact CB-CD1 3.71Å; I76-I233 VanDerWaalsContact O-CG2 3.29Å; I76-I233 WeakPolarHBondContact O-CG2 3.5Å; A77-I233 HydrophobicContact CB-CG2 4.1Å; A228-I233 HydrophobicContact CB-CD1 4.2Å; A228-I233 HydrophobicContact CB-CG1 4.02Å; P229-I233 PolarHBondContact O-N 3.41Å; P229-I233 VanDerWaalsContact O-N 3.11Å; I230-I233 WeakPolarHBondContact O-CB 3.39Å; I230-I233 PolarHBondContact O-N 2.95Å; I230-I233 VanDerWaalsContact O-N 3.12Å; I233-K236 PolarHBondContact O-N 2.95Å; I233-I237 HydrophobicContact CG2-CD1 3.77Å; I233-I237 HydrophobicContact CG2-CG1 4.5Å; I233-I237 VanDerWaalsContact O-CG1 3.3Å; I233-I237 WeakPolarHBondContact O-CG1 3.41Å; I233-I237 PolarHBondContact O-N 3.48Å; I233-L256 HydrophobicContact CG2-CD1 3.93Å; I233-L256 HydrophobicContact CG2-CD2 4.42Å
234	R	92.6	Very high	92.4	Very high	51 Å²	51	66.1 Å²	66.1	19%	0.192	31%	0.307	C	S	.	.	H	α-helix	trans	-65.2	-41.5	178.3	-75.3	-64.9	-170.1	-169.7	-3.5	112.7	I230 E231 Q232 K236 I237 K238 L251 D253	I230-R234 HydrophobicContact CG2-CG 4.19Å; I230-R234 WeakPolarHBondContact O-CB 3.33Å; I230-R234 WeakPolarHBondContact O-CG 3.09Å; I230-R234 PolarHBondContact O-N 3.44Å; E231-R234 PolarHBondContact O-N 3.49Å; Q232-R234 VanDerWaalsContact C-N 3.33Å; Q232-R234 PolarHBondContact O-N 2.95Å; R234-K236 VanDerWaalsContact C-N 3.33Å; R234-K236 PolarHBondContact O-N 2.89Å; R234-I237 PolarHBondContact O-N 2.7Å; R234-K238 WeakPolarHBondContact O-CG 3.23Å; R234-K238 PolarHBondContact O-N 3.4Å; R234-L251 VanDerWaalsContact CZ-O 3.25Å; R234-L251 PolarHBondContact NH1-O 3.18Å; R234-L251 PolarHBondContact NH2-O 3.28Å; R234-D253 IonicContact CZ-OD1 3.73Å; R234-D253 IonicContact NE-OD1 2.67Å; R234-D253 PolarHBondContact NE-OD1 3.08Å; R234-D253 IonicContact NH2-OD1 3.22Å; R234-D253 PolarHBondContact NH2-OD1 2.79Å
235	E	92.7	Very high	92	Very high	109 Å²	109	66.7 Å²	66.7	51%	0.509	31%	0.31	S	S	.	.	H	α-helix	trans	-60.5	-43	172.7	-75.3	-179.9	-173	0	0	111.9	E231 Q232 K238 K239	E231-E235 WeakPolarHBondContact O-CG 3.48Å; E231-E235 PolarHBondContact O-N 2.97Å; Q232-E235 PolarHBondContact O-N 2.94Å; E235-K238 PolarHBondContact O-N 2.86Å; E235-K239 WeakPolarHBondContact O-CB 3.46Å; E235-K239 VanDerWaalsContact O-CG 3.32Å; E235-K239 WeakPolarHBondContact O-CG 3.13Å; E235-K239 PolarHBondContact O-N 3.4Å
236	K	92	Very high	91.6	Very high	31 Å²	31	68.6 Å²	68.6	14%	0.135	32%	0.322	C	S	.	.	H	α-helix	trans	-66.8	-38.6	177.3	-71.4	172.4	-173.6	177.3	0	112	A77 S78 Q232 I233 R234 K239 R240 Y288	A77-K236 HydrophobicContact CB-CB 4.1Å; A77-K236 WeakPolarHBondContact O-CD 3.48Å; S78-K236 PolarHBondContact O-NZ 3.4Å; Q232-K236 WeakPolarHBondContact O-CB 3.41Å; Q232-K236 VanDerWaalsContact O-CG 3.25Å; Q232-K236 WeakPolarHBondContact O-CG 3.41Å; Q232-K236 PolarHBondContact O-N 3.48Å; I233-K236 PolarHBondContact O-N 2.95Å; R234-K236 VanDerWaalsContact C-N 3.33Å; R234-K236 PolarHBondContact O-N 2.89Å; K236-K239 PolarHBondContact O-N 3.34Å; K236-R240 WeakPolarHBondContact O-CG 3.42Å; K236-R240 PolarHBondContact O-N 3.4Å; K236-Y288 HydrophobicContact CD-CE2 4.47Å
237	I	91.2	Very high	91.1	Very high	3 Å²	3	75 Å²	75	2%	0.015	36%	0.357	C	S	.	.	H	α-helix	trans	-59.4	-48.7	171.4	-68.6	158.7	0	0	0	110.2	A77 I233 R234 K239 R240 N241 E245 L251	A77-I237 HydrophobicContact CB-CG1 3.99Å; I233-I237 HydrophobicContact CG2-CD1 3.77Å; I233-I237 HydrophobicContact CG2-CG1 4.5Å; I233-I237 VanDerWaalsContact O-CG1 3.3Å; I233-I237 WeakPolarHBondContact O-CG1 3.41Å; I233-I237 PolarHBondContact O-N 3.48Å; R234-I237 PolarHBondContact O-N 2.7Å; I237-K239 PolarHBondContact O-N 2.97Å; I237-R240 PolarHBondContact O-N 3.03Å; I237-N241 PolarHBondContact O-N 3.32Å; I237-E245 HydrophobicContact CG2-CG 4.04Å; I237-L251 HydrophobicContact CD1-CD2 4.06Å
238	K	92.1	Very high	90.8	Very high	141 Å²	141	68.4 Å²	68.4	61%	0.613	34%	0.335	S	S	*	.	H	α-helix	trans	-60.9	-43.3	177.7	-71.8	174.7	-176.9	178.1	0	112.3	R234 E235 R240 N241	R234-K238 WeakPolarHBondContact O-CG 3.23Å; R234-K238 PolarHBondContact O-N 3.4Å; E235-K238 PolarHBondContact O-N 2.86Å; K238-R240 VanDerWaalsContact C-N 3.31Å; K238-R240 PolarHBondContact O-N 3.32Å; K238-N241 PolarHBondContact O-N 2.94Å; K238-N241 VanDerWaalsContact O-N 3.12Å
239	K	91.9	Very high	90.7	Very high	167 Å²	167	75.5 Å²	75.5	73%	0.726	36%	0.36	S	S	*	.	H	α-helix	trans	-63.7	-33.5	177.6	-75.3	176.1	-176	174.7	0	112.9	E235 K236 I237 N241	E235-K239 WeakPolarHBondContact O-CB 3.46Å; E235-K239 VanDerWaalsContact O-CG 3.32Å; E235-K239 WeakPolarHBondContact O-CG 3.13Å; E235-K239 PolarHBondContact O-N 3.4Å; K236-K239 PolarHBondContact O-N 3.34Å; I237-K239 PolarHBondContact O-N 2.97Å; K239-N241 PolarHBondContact O-N 3.48Å
240	R	89.1	Confident	90.6	Very high	106 Å²	106	74 Å²	74	40%	0.4	35%	0.35	S	S	.	.	H	α-helix	trans	-66.1	-24.6	174.9	-76.5	-175.5	-74	144.8	4.2	112.7	K236 I237 K238 I242 E245	K236-R240 WeakPolarHBondContact O-CG 3.42Å; K236-R240 PolarHBondContact O-N 3.4Å; I237-R240 PolarHBondContact O-N 3.03Å; K238-R240 VanDerWaalsContact C-N 3.31Å; K238-R240 PolarHBondContact O-N 3.32Å; R240-I242 VanDerWaalsContact C-N 3.27Å; R240-I242 HydrophobicContact CB-CG1 4.46Å; R240-I242 PolarHBondContact O-N 3.22Å; R240-E245 IonicContact CZ-OE1 3.18Å; R240-E245 IonicContact CZ-OE2 2.7Å; R240-E245 IonicContact NH1-OE1 3.14Å; R240-E245 PolarHBondContact NH1-OE1 3.5Å; R240-E245 IonicContact NH1-OE2 3.67Å; R240-E245 PolarHBondContact NH1-OE2 2.82Å; R240-E245 IonicContact NH2-OE1 2.71Å; R240-E245 PolarHBondContact NH2-OE1 2.77Å; R240-E245 IonicContact NH2-OE2 3.21Å
241	N	89	Confident	90.5	Very high	125 Å²	125	72.5 Å²	72.5	67%	0.668	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	38.8	171.4	-163.3	33.9	0	0	0	114.4	I237 K238 K239 P243	I237-N241 PolarHBondContact O-N 3.32Å; K238-N241 PolarHBondContact O-N 2.94Å; K238-N241 VanDerWaalsContact O-N 3.12Å; K239-N241 PolarHBondContact O-N 3.48Å; N241-P243 WeakPolarHBondContact O-CD 3.2Å
242	I	89.7	Confident	90.5	Very high	56 Å²	56	68.2 Å²	68.2	29%	0.287	33%	0.325	S	S	.	.			trans	-84.6	117.1	174.6	-60.8	179.1	0	0	0	108.1	R240 W244 E245 V246	R240-I242 VanDerWaalsContact C-N 3.27Å; R240-I242 HydrophobicContact CB-CG1 4.46Å; R240-I242 PolarHBondContact O-N 3.22Å; I242-W244 VanDerWaalsContact C-N 3.33Å; I242-W244 HydrophobicContact CG2-CD2 3.86Å; I242-W244 HydrophobicContact CG2-CG 4.12Å; I242-W244 HydrophobicContact CG2-CH2 4.49Å; I242-W244 HydrophobicContact CG2-CZ2 3.77Å; I242-W244 PolarHBondContact O-N 2.93Å; I242-E245 HydrophobicContact CB-CB 3.88Å; I242-E245 HydrophobicContact CG2-CB 4.01Å; I242-E245 PolarHBondContact O-N 3.22Å; I242-V246 WeakPolarHBondContact O-CG2 3.47Å; I242-V246 PolarHBondContact O-N 3.21Å; I242-V246 VanDerWaalsContact O-N 3.16Å
243	P	88.6	Confident	90.6	Very high	107 Å²	107	69.6 Å²	69.6	70%	0.695	33%	0.334	S	S	*	.	H	α-helix	trans	-55	-41.2	-168.1	-30	35.9	0	0	0	115.2	N241	N241-P243 WeakPolarHBondContact O-CD 3.2Å
244	W	89.4	Confident	90.7	Very high	66 Å²	66	75.8 Å²	75.8	25%	0.25	36%	0.363	C	S	.	.	H	α-helix	trans	-81.1	-19.2	-179.7	58.3	-107.1	0	0	0	113.8	C132 E133 W136 N137 I242 A248	C132-W244 HydrophobicContact CB-CH2 4.05Å; C132-W244 HydrophobicContact CB-CZ3 4.38Å; E133-W244 HydrophobicContact CB-CB 4.27Å; E133-W244 HydrophobicContact CB-CD2 3.89Å; E133-W244 HydrophobicContact CB-CE3 4.37Å; E133-W244 HydrophobicContact CB-CG 3.82Å; E133-W244 HydrophobicContact CG-CB 3.68Å; E133-W244 HydrophobicContact CG-CD2 4.3Å; E133-W244 HydrophobicContact CG-CG 3.73Å; W136-W244 AromaticContact CD1-CZ3 3.72Å; N137-W244 PolarHBondContact ND2-O 3.42Å; I242-W244 VanDerWaalsContact C-N 3.33Å; I242-W244 HydrophobicContact CG2-CD2 3.86Å; I242-W244 HydrophobicContact CG2-CG 4.12Å; I242-W244 HydrophobicContact CG2-CH2 4.49Å; I242-W244 HydrophobicContact CG2-CZ2 3.77Å; I242-W244 PolarHBondContact O-N 2.93Å; W244-A248 WeakPolarHBondContact O-CB 3.44Å; W244-A248 PolarHBondContact O-N 3.41Å
245	E	89.2	Confident	90.8	Very high	12 Å²	12	73.3 Å²	73.3	6%	0.056	35%	0.354	C	S	.	.	H	α-helix	trans	-85.1	-39	-178.2	-166.7	-174.4	-164.5	0	0	111	I237 R240 I242 N247 A248 L251	I237-E245 HydrophobicContact CG2-CG 4.04Å; R240-E245 IonicContact CZ-OE1 3.18Å; R240-E245 IonicContact CZ-OE2 2.7Å; R240-E245 IonicContact NH1-OE1 3.14Å; R240-E245 PolarHBondContact NH1-OE1 3.5Å; R240-E245 IonicContact NH1-OE2 3.67Å; R240-E245 PolarHBondContact NH1-OE2 2.82Å; R240-E245 IonicContact NH2-OE1 2.71Å; R240-E245 PolarHBondContact NH2-OE1 2.77Å; R240-E245 IonicContact NH2-OE2 3.21Å; I242-E245 HydrophobicContact CB-CB 3.88Å; I242-E245 HydrophobicContact CG2-CB 4.01Å; I242-E245 PolarHBondContact O-N 3.22Å; E245-N247 VanDerWaalsContact C-N 3.32Å; E245-N247 PolarHBondContact O-N 2.85Å; E245-A248 WeakPolarHBondContact O-CB 3.35Å; E245-A248 PolarHBondContact O-N 3.01Å; E245-L251 HydrophobicContact CG-CD2 3.98Å
246	V	87.7	Confident	90.9	Very high	48 Å²	48	68.1 Å²	68.1	29%	0.291	33%	0.329	S	S	.	.	H	α-helix	trans	-65	-37.6	-176.2	175.4	0	0	0	0	111.9	I242	I242-V246 WeakPolarHBondContact O-CG2 3.47Å; I242-V246 PolarHBondContact O-N 3.21Å; I242-V246 VanDerWaalsContact O-N 3.16Å
247	N	85.6	Confident	91.1	Very high	135 Å²	135	69.9 Å²	69.9	72%	0.722	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	21.5	-179.4	-60.7	-43.9	0	0	0	112.4	E245 R249	E245-N247 VanDerWaalsContact C-N 3.32Å; E245-N247 PolarHBondContact O-N 2.85Å; N247-R249 PolarHBondContact O-N 3.02Å
248	A	89.9	Confident	91.3	Very high	13 Å²	13	70.1 Å²	70.1	11%	0.107	34%	0.343	C	S	.	.			trans	-58.5	123.9	-179.3	0	0	0	0	0	111.3	W136 N137 W244 E245 N250 L251	W136-A248 HydrophobicContact CB-CB 3.87Å; N137-A248 WeakPolarHBondContact OD1-CA 3.35Å; W244-A248 WeakPolarHBondContact O-CB 3.44Å; W244-A248 PolarHBondContact O-N 3.41Å; E245-A248 WeakPolarHBondContact O-CB 3.35Å; E245-A248 PolarHBondContact O-N 3.01Å; A248-N250 PolarHBondContact O-N 2.66Å; A248-L251 HydrophobicContact CB-CB 3.58Å; A248-L251 HydrophobicContact CB-CD2 4.49Å
249	R	90.2	Very high	91.5	Very high	155 Å²	155	63.4 Å²	63.4	59%	0.585	31%	0.314	S	S	*	.	S	Bend	trans	-60.6	-43.8	-179.9	-178.7	-178.9	172.5	135.9	-5	112.8	W136 N137 N247 T252	W136-R249 PolarHBondContact O-N 3.4Å; W136-R249 VanDerWaalsContact O-N 3.12Å; N137-R249 PolarHBondContact OD1-N 3.16Å; N247-R249 PolarHBondContact O-N 3.02Å; R249-T252 WeakPolarHBondContact O-CG2 3.49Å
250	N	90.8	Very high	91.7	Very high	9 Å²	9	56.6 Å²	56.6	5%	0.048	28%	0.284	C	S	.	.	S	Bend	trans	-95.3	-11.8	-171.2	-60.6	-22.9	0	0	0	112.8	F135 W136 E138 Y197 A248 T252	F135-N250 PolarHBondContact O-ND2 2.68Å; W136-N250 HydrophobicContact CE3-CB 4.07Å; W136-N250 WeakPolarHBondContact O-CB 3.37Å; W136-N250 PolarHBondContact O-N 2.74Å; E138-N250 PolarHBondContact O-ND2 3.19Å; Y197-N250 HydrophobicContact CE1-CB 4.04Å; Y197-N250 HydrophobicContact CE2-CB 4.04Å; Y197-N250 WeakPolarHBondContact CE2-O 3.43Å; Y197-N250 WeakPolarHBondContact OH-CA 3.32Å; Y197-N250 PolarHBondContact OH-O 3.4Å; A248-N250 PolarHBondContact O-N 2.66Å; N250-T252 PolarHBondContact O-N 3.15Å
251	L	91.8	Very high	92	Very high	3 Å²	3	55.3 Å²	55.3	2%	0.016	29%	0.286	C	S	.	.			trans	-83.1	67.1	174	-169.5	63.9	0	0	0	109.4	I76 W136 R234 I237 E245 A248 F255 L256	I76-L251 HydrophobicContact CD1-CD1 3.81Å; W136-L251 HydrophobicContact CD2-CB 4.31Å; W136-L251 HydrophobicContact CE3-CB 3.84Å; W136-L251 HydrophobicContact CE3-CD1 4.2Å; W136-L251 HydrophobicContact CH2-CD1 3.88Å; W136-L251 HydrophobicContact CZ2-CD1 4.25Å; W136-L251 HydrophobicContact CZ3-CB 4.21Å; W136-L251 HydrophobicContact CZ3-CD1 3.84Å; R234-L251 VanDerWaalsContact CZ-O 3.25Å; R234-L251 PolarHBondContact NH1-O 3.18Å; R234-L251 PolarHBondContact NH2-O 3.28Å; I237-L251 HydrophobicContact CD1-CD2 4.06Å; E245-L251 HydrophobicContact CG-CD2 3.98Å; A248-L251 HydrophobicContact CB-CB 3.58Å; A248-L251 HydrophobicContact CB-CD2 4.49Å; L251-F255 HydrophobicContact CD1-CD1 4.36Å; L251-L256 HydrophobicContact CD1-CD2 3.99Å; L251-L256 HydrophobicContact CD1-CG 4.48Å
252	T	92.4	Very high	92.3	Very high	43 Å²	43	50 Å²	50	26%	0.264	26%	0.257	S	S	.	.			trans	-88.3	161.6	-177.1	60.6	0	0	0	0	111.8	R249 N250 E254 F255 L256	R249-T252 WeakPolarHBondContact O-CG2 3.49Å; N250-T252 PolarHBondContact O-N 3.15Å; T252-E254 PolarHBondContact O-N 3.38Å; T252-F255 PolarHBondContact O-N 2.91Å; T252-F255 PolarHBondContact OG1-N 3.21Å; T252-L256 WeakPolarHBondContact O-CG 2.98Å; T252-L256 PolarHBondContact O-N 3Å; T252-L256 VanDerWaalsContact O-N 3.13Å
253	D	93.6	Very high	92.5	Very high	80 Å²	80	47.3 Å²	47.3	43%	0.428	24%	0.243	S	C	.	.	H	α-helix	trans	-65.5	-30.7	174.1	-66.8	-19.5	0	0	0	111.1	R234 L256 N257	R234-D253 IonicContact CZ-OD1 3.73Å; R234-D253 IonicContact NE-OD1 2.67Å; R234-D253 PolarHBondContact NE-OD1 3.08Å; R234-D253 IonicContact NH2-OD1 3.22Å; R234-D253 PolarHBondContact NH2-OD1 2.79Å; D253-L256 PolarHBondContact O-N 3.42Å; D253-N257 WeakPolarHBondContact O-CB 3.41Å; D253-N257 PolarHBondContact O-N 3.43Å; D253-N257 PolarHBondContact O-ND2 3.09Å; D253-N257 VanDerWaalsContact O-ND2 3.11Å
254	E	94.8	Very high	92.7	Very high	131 Å²	131	42.9 Å²	42.9	61%	0.612	22%	0.217	S	C	*	.	H	α-helix	trans	-59.4	-46.4	172.3	-174	179.4	-177.6	0	0	111.5	T252 N257 A258	T252-E254 PolarHBondContact O-N 3.38Å; E254-N257 PolarHBondContact O-N 3.35Å; E254-A258 VanDerWaalsContact O-CB 3.26Å; E254-A258 WeakPolarHBondContact O-CB 3.24Å; E254-A258 PolarHBondContact O-N 2.97Å
255	F	95.4	Very high	92.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-45.8	177.1	177.2	-95.4	0	0	0	112.5	I76 W136 F188 A191 M192 C195 Y197 L251 T252 N257 A258 Y259	I76-F255 HydrophobicContact CD1-CE1 4.04Å; W136-F255 HydrophobicContact CH2-CD1 4.08Å; W136-F255 AromaticContact CH2-CE1 3.55Å; W136-F255 HydrophobicContact CH2-CE1 3.55Å; W136-F255 AromaticContact CH2-CZ 3.93Å; W136-F255 HydrophobicContact CH2-CZ 3.93Å; W136-F255 HydrophobicContact CZ3-CD1 4.14Å; W136-F255 HydrophobicContact CZ3-CE1 4.04Å; W136-F255 HydrophobicContact CZ3-CZ 4.44Å; F188-F255 HydrophobicContact CD2-CZ 4.09Å; F188-F255 HydrophobicContact CE1-CZ 4.22Å; F188-F255 HydrophobicContact CE2-CE1 4.02Å; F188-F255 AromaticContact CE2-CZ 3.6Å; F188-F255 HydrophobicContact CE2-CZ 3.6Å; F188-F255 HydrophobicContact CZ-CE1 4.3Å; F188-F255 AromaticContact CZ-CZ 3.68Å; F188-F255 HydrophobicContact CZ-CZ 3.68Å; A191-F255 HydrophobicContact CB-CD2 4.2Å; A191-F255 HydrophobicContact CB-CE2 3.76Å; A191-F255 HydrophobicContact CB-CZ 4.3Å; M192-F255 HydrophobicContact CG-CE2 3.96Å; C195-F255 HydrophobicContact CB-CD2 4.37Å; C195-F255 WeakPolarHBondContact SG-CA 3.47Å; Y197-F255 HydrophobicContact CD2-CD2 4.04Å; Y197-F255 HydrophobicContact CD2-CE2 4.33Å; Y197-F255 HydrophobicContact CE2-CB 4.28Å; Y197-F255 AromaticContact CE2-CD2 3.67Å; Y197-F255 HydrophobicContact CE2-CD2 3.67Å; Y197-F255 HydrophobicContact CE2-CE2 4.35Å; Y197-F255 HydrophobicContact CE2-CG 4.13Å; L251-F255 HydrophobicContact CD1-CD1 4.36Å; T252-F255 PolarHBondContact O-N 2.91Å; T252-F255 PolarHBondContact OG1-N 3.21Å; F255-N257 VanDerWaalsContact C-N 3.32Å; F255-N257 PolarHBondContact O-N 2.98Å; F255-A258 PolarHBondContact O-N 3.43Å; F255-Y259 WeakPolarHBondContact O-CB 3.06Å; F255-Y259 PolarHBondContact O-N 2.92Å
256	L	95.4	Very high	93	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.8	-40.9	179.7	-67.7	174.4	0	0	0	111.8	N75 I76 I230 I233 L251 T252 D253 E260	N75-L256 PolarHBondContact ND2-O 3.21Å; I76-L256 HydrophobicContact CB-CD2 4.18Å; I76-L256 HydrophobicContact CD1-CD2 4.23Å; I230-L256 HydrophobicContact CG2-CD1 4.36Å; I233-L256 HydrophobicContact CG2-CD1 3.93Å; I233-L256 HydrophobicContact CG2-CD2 4.42Å; L251-L256 HydrophobicContact CD1-CD2 3.99Å; L251-L256 HydrophobicContact CD1-CG 4.48Å; T252-L256 WeakPolarHBondContact O-CG 2.98Å; T252-L256 PolarHBondContact O-N 3Å; T252-L256 VanDerWaalsContact O-N 3.13Å; D253-L256 PolarHBondContact O-N 3.42Å; L256-E260 WeakPolarHBondContact O-CB 3.33Å; L256-E260 PolarHBondContact O-N 3.42Å
257	N	95.8	Very high	93.3	Very high	67 Å²	67	47.9 Å²	47.9	36%	0.358	24%	0.238	S	C	.	.	H	α-helix	trans	-64.1	-50.6	173.1	-85.6	-41.9	0	0	0	112.4	I230 D253 E254 F255 Y259 E260 D261	I230-N257 WeakPolarHBondContact CD1-ND2 3.49Å; I230-N257 WeakPolarHBondContact CD1-OD1 3.36Å; D253-N257 WeakPolarHBondContact O-CB 3.41Å; D253-N257 PolarHBondContact O-N 3.43Å; D253-N257 PolarHBondContact O-ND2 3.09Å; D253-N257 VanDerWaalsContact O-ND2 3.11Å; E254-N257 PolarHBondContact O-N 3.35Å; F255-N257 VanDerWaalsContact C-N 3.32Å; F255-N257 PolarHBondContact O-N 2.98Å; N257-Y259 PolarHBondContact O-N 3.33Å; N257-E260 PolarHBondContact O-N 3.21Å; N257-E260 VanDerWaalsContact O-N 3.15Å; N257-D261 WeakPolarHBondContact O-CB 3.19Å; N257-D261 VanDerWaalsContact O-CG 3.31Å; N257-D261 PolarHBondContact O-N 2.8Å
258	A	95.9	Very high	93.7	Very high	9 Å²	9	42.2 Å²	42.2	7%	0.074	21%	0.208	C	C	.	.	H	α-helix	trans	-56.3	-41.9	179.8	0	0	0	0	0	111.1	A191 K194 E254 F255 I262	A191-A258 HydrophobicContact CB-CB 4.24Å; K194-A258 HydrophobicContact CB-CB 4.28Å; K194-A258 HydrophobicContact CD-CB 3.9Å; E254-A258 VanDerWaalsContact O-CB 3.26Å; E254-A258 WeakPolarHBondContact O-CB 3.24Å; E254-A258 PolarHBondContact O-N 2.97Å; F255-A258 PolarHBondContact O-N 3.43Å; A258-I262 VanDerWaalsContact O-CD1 3.24Å; A258-I262 WeakPolarHBondContact O-CD1 3.26Å; A258-I262 VanDerWaalsContact O-CG1 3.24Å; A258-I262 WeakPolarHBondContact O-CG1 3.17Å; A258-I262 PolarHBondContact O-N 3.15Å
259	Y	96.4	Very high	93.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.5	-45.7	176.8	-176.7	-127.9	0	0	0	112.6	N75 A187 F188 A191 F255 N257 D261 I262 L263	N75-Y259 WeakPolarHBondContact OD1-CD1 3.25Å; A187-Y259 HydrophobicContact CB-CD2 4.38Å; A187-Y259 HydrophobicContact CB-CE2 4.03Å; F188-Y259 HydrophobicContact CB-CD2 4.28Å; F188-Y259 HydrophobicContact CB-CE2 3.85Å; F188-Y259 HydrophobicContact CD2-CD2 4.24Å; F188-Y259 HydrophobicContact CD2-CE1 4.48Å; F188-Y259 HydrophobicContact CD2-CE2 4.03Å; F188-Y259 HydrophobicContact CG-CE2 4.44Å; A191-Y259 HydrophobicContact CB-CD2 4.25Å; A191-Y259 HydrophobicContact CB-CG 4.44Å; F255-Y259 WeakPolarHBondContact O-CB 3.06Å; F255-Y259 PolarHBondContact O-N 2.92Å; N257-Y259 PolarHBondContact O-N 3.33Å; Y259-D261 VanDerWaalsContact C-N 3.34Å; Y259-D261 PolarHBondContact O-N 3.39Å; Y259-I262 PolarHBondContact O-N 3.01Å; Y259-L263 HydrophobicContact CE1-CD2 4.22Å; Y259-L263 WeakPolarHBondContact O-CB 3.42Å; Y259-L263 PolarHBondContact O-N 2.93Å
260	E	94.8	Very high	93.9	Very high	23 Å²	23	42.5 Å²	42.5	11%	0.107	22%	0.215	C	C	.	.	H	α-helix	trans	-59.1	-45.2	176.1	-167.3	66.6	-165.8	0	0	111.6	N75 Y225 L256 N257 I262 L263 G264	N75-E260 WeakPolarHBondContact CB-OE2 3.36Å; N75-E260 PolarHBondContact ND2-OE2 3.31Å; Y225-E260 PolarHBondContact OH-OE1 3.46Å; L256-E260 WeakPolarHBondContact O-CB 3.33Å; L256-E260 PolarHBondContact O-N 3.42Å; N257-E260 PolarHBondContact O-N 3.21Å; N257-E260 VanDerWaalsContact O-N 3.15Å; E260-I262 PolarHBondContact O-N 3.26Å; E260-L263 PolarHBondContact O-N 3.31Å; E260-G264 PolarHBondContact O-N 2.88Å
261	D	95.1	Very high	94.1	Very high	80 Å²	80	42.8 Å²	42.8	43%	0.428	22%	0.216	S	C	.	.	H	α-helix	trans	-60.9	-43.3	-179.1	-75.8	-21	0	0	0	111.9	N257 Y259 N265	N257-D261 WeakPolarHBondContact O-CB 3.19Å; N257-D261 VanDerWaalsContact O-CG 3.31Å; N257-D261 PolarHBondContact O-N 2.8Å; Y259-D261 VanDerWaalsContact C-N 3.34Å; Y259-D261 PolarHBondContact O-N 3.39Å; D261-N265 WeakPolarHBondContact O-CB 3.32Å; D261-N265 VanDerWaalsContact O-CG 3.28Å; D261-N265 PolarHBondContact O-N 2.85Å; D261-N265 PolarHBondContact O-ND2 3.43Å; D261-N265 VanDerWaalsContact O-ND2 3.11Å
262	I	95.5	Very high	94.1	Very high	12 Å²	12	46.4 Å²	46.4	6%	0.062	24%	0.236	C	C	.	.	H	α-helix	trans	-74.4	-39.9	-179.7	-60.6	157.4	0	0	0	110.3	F186 A187 D190 A191 K194 A258 Y259 E260 Y266 Y267	F186-I262 HydrophobicContact CE2-CG2 4.36Å; A187-I262 HydrophobicContact CB-CB 4.24Å; A187-I262 HydrophobicContact CB-CG2 3.65Å; D190-I262 HydrophobicContact CB-CD1 3.42Å; D190-I262 VanDerWaalsContact CB-CD1 3.42Å; D190-I262 HydrophobicContact CB-CG1 4.4Å; D190-I262 HydrophobicContact CB-CG2 4.27Å; A191-I262 HydrophobicContact CB-CD1 4.22Å; K194-I262 HydrophobicContact CD-CD1 3.91Å; A258-I262 VanDerWaalsContact O-CD1 3.24Å; A258-I262 WeakPolarHBondContact O-CD1 3.26Å; A258-I262 VanDerWaalsContact O-CG1 3.24Å; A258-I262 WeakPolarHBondContact O-CG1 3.17Å; A258-I262 PolarHBondContact O-N 3.15Å; Y259-I262 PolarHBondContact O-N 3.01Å; E260-I262 PolarHBondContact O-N 3.26Å; I262-Y266 WeakPolarHBondContact O-CA 3.47Å; I262-Y266 WeakPolarHBondContact O-CB 3.36Å; I262-Y266 PolarHBondContact O-N 3.49Å; I262-Y267 PolarHBondContact O-N 2.96Å
263	L	94.9	Very high	94.1	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.249	C	C	.	.	I	π-helix	trans	-62.5	-50.4	178.7	-171.1	64.2	0	0	0	110.6	A187 Y225 Y259 E260 Y267 I268	A187-L263 HydrophobicContact CB-CD1 4.47Å; Y225-L263 HydrophobicContact CD2-CD2 4.34Å; Y225-L263 HydrophobicContact CD2-CG 4.44Å; Y225-L263 HydrophobicContact CE2-CD2 3.6Å; Y225-L263 HydrophobicContact CE2-CG 3.77Å; Y259-L263 HydrophobicContact CE1-CD2 4.22Å; Y259-L263 WeakPolarHBondContact O-CB 3.42Å; Y259-L263 PolarHBondContact O-N 2.93Å; E260-L263 PolarHBondContact O-N 3.31Å; L263-Y267 HydrophobicContact CD1-CD1 3.61Å; L263-Y267 HydrophobicContact CD1-CE1 4.26Å; L263-Y267 HydrophobicContact CD1-CG 4.22Å; L263-Y267 WeakPolarHBondContact O-CB 3.25Å; L263-Y267 PolarHBondContact O-N 3.42Å; L263-I268 VanDerWaalsContact O-CG1 3.28Å; L263-I268 WeakPolarHBondContact O-CG1 3.44Å; L263-I268 PolarHBondContact O-N 3.11Å
264	G	92.7	Very high	94	Very high	15 Å²	15	51.2 Å²	51.2	16%	0.155	24%	0.243	C	C	.	.	I	π-helix	trans	-71.3	-56.4	179.3	0	0	0	0	0	113.6	E260 I268	E260-G264 PolarHBondContact O-N 2.88Å; G264-I268 WeakPolarHBondContact O-CB 3.26Å
265	N	91.5	Very high	93.9	Very high	93 Å²	93	45 Å²	45	50%	0.497	21%	0.214	S	C	.	.	I	π-helix	trans	-79.6	-29.8	-169.6	-55.6	-36.7	0	0	0	112.8	D261 E269	D261-N265 WeakPolarHBondContact O-CB 3.32Å; D261-N265 VanDerWaalsContact O-CG 3.28Å; D261-N265 PolarHBondContact O-N 2.85Å; D261-N265 PolarHBondContact O-ND2 3.43Å; D261-N265 VanDerWaalsContact O-ND2 3.11Å; N265-E269 WeakPolarHBondContact O-CB 3.48Å; N265-E269 VanDerWaalsContact O-CG 3.25Å; N265-E269 WeakPolarHBondContact O-CG 3.21Å; N265-E269 VanDerWaalsContact O-OE2 3.11Å
266	Y	92.2	Very high	93.8	Very high	135 Å²	135	47.2 Å²	47.2	53%	0.529	23%	0.225	S	C	.	.	I	π-helix	trans	-106.9	-53	-176.6	-172.9	-86.4	0	0	0	112.4	F186 I262 N270	F186-Y266 HydrophobicContact CD2-CD1 4.47Å; F186-Y266 HydrophobicContact CD2-CE1 4.35Å; F186-Y266 AromaticContact CE2-CD1 3.31Å; F186-Y266 HydrophobicContact CE2-CD1 3.31Å; F186-Y266 AromaticContact CE2-CE1 3.44Å; F186-Y266 HydrophobicContact CE2-CE1 3.44Å; F186-Y266 VanDerWaalsContact CE2-CE1 3.44Å; F186-Y266 AromaticContact CZ-CD1 3.57Å; F186-Y266 HydrophobicContact CZ-CD1 3.57Å; F186-Y266 AromaticContact CZ-CE1 3.69Å; F186-Y266 HydrophobicContact CZ-CE1 3.69Å; I262-Y266 WeakPolarHBondContact O-CA 3.47Å; I262-Y266 WeakPolarHBondContact O-CB 3.36Å; I262-Y266 PolarHBondContact O-N 3.49Å; Y266-N270 WeakPolarHBondContact CD1-ND2 3.43Å; Y266-N270 WeakPolarHBondContact CE1-ND2 3.47Å; Y266-N270 WeakPolarHBondContact O-CB 3.48Å; Y266-N270 PolarHBondContact O-N 3.44Å; Y266-N270 PolarHBondContact O-ND2 3.25Å
267	Y	94.5	Very high	93.8	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.008	23%	0.233	C	C	.	.	I	π-helix	trans	-69.4	-52.7	-174.8	169	-105.9	0	0	0	112.2	E73 F183 F186 I262 L263 N270 M271	E73-Y267 HydrophobicContact CG-CE1 4.01Å; F183-Y267 HydrophobicContact CB-CE2 3.69Å; F186-Y267 AromaticContact CE1-CD2 3.71Å; F186-Y267 HydrophobicContact CE1-CD2 3.71Å; F186-Y267 HydrophobicContact CE1-CG 4.49Å; F186-Y267 AromaticContact CZ-CD2 3.91Å; F186-Y267 HydrophobicContact CZ-CD2 3.91Å; F186-Y267 HydrophobicContact CZ-CG 4.32Å; I262-Y267 PolarHBondContact O-N 2.96Å; L263-Y267 HydrophobicContact CD1-CD1 3.61Å; L263-Y267 HydrophobicContact CD1-CE1 4.26Å; L263-Y267 HydrophobicContact CD1-CG 4.22Å; L263-Y267 WeakPolarHBondContact O-CB 3.25Å; L263-Y267 PolarHBondContact O-N 3.42Å; Y267-N270 PolarHBondContact O-N 2.91Å; Y267-M271 HydrophobicContact CD2-CG 3.96Å; Y267-M271 HydrophobicContact CE1-CG 4.47Å; Y267-M271 HydrophobicContact CE2-CE 3.69Å; Y267-M271 HydrophobicContact CE2-CG 3.5Å; Y267-M271 HydrophobicContact CE2-SD 4.5Å; Y267-M271 WeakPolarHBondContact O-CB 3.12Å; Y267-M271 PolarHBondContact O-N 3.11Å
268	I	94.1	Very high	93.8	Very high	17 Å²	17	46.8 Å²	46.8	9%	0.087	22%	0.222	C	C	.	.	I	π-helix	trans	-63.7	-47.9	-177.9	-70	-59.6	0	0	0	111.2	I223 Y225 L263 G264 N270 M271 D272 I277	I223-I268 HydrophobicContact CG2-CD1 3.99Å; Y225-I268 HydrophobicContact CD1-CD1 4.46Å; Y225-I268 HydrophobicContact CD1-CG1 4.02Å; Y225-I268 HydrophobicContact CD2-CD1 4.19Å; Y225-I268 HydrophobicContact CD2-CG1 4.14Å; Y225-I268 HydrophobicContact CE1-CG1 4.38Å; Y225-I268 HydrophobicContact CG-CD1 3.89Å; Y225-I268 HydrophobicContact CG-CG1 3.87Å; L263-I268 VanDerWaalsContact O-CG1 3.28Å; L263-I268 WeakPolarHBondContact O-CG1 3.44Å; L263-I268 PolarHBondContact O-N 3.11Å; G264-I268 WeakPolarHBondContact O-CB 3.26Å; I268-N270 VanDerWaalsContact C-N 3.3Å; I268-N270 PolarHBondContact O-N 3.5Å; I268-M271 PolarHBondContact O-N 3.31Å; I268-M271 VanDerWaalsContact O-N 3.15Å; I268-D272 PolarHBondContact O-N 2.99Å; I268-D272 VanDerWaalsContact O-N 3.14Å; I268-I277 HydrophobicContact CB-CD1 4.37Å; I268-I277 HydrophobicContact CD1-CD1 4.24Å; I268-I277 HydrophobicContact CD1-CG2 4.26Å; I268-I277 HydrophobicContact CG2-CD1 3.76Å; I268-I277 HydrophobicContact CG2-CG2 3.95Å; I268-I277 WeakPolarHBondContact O-CD1 3.47Å
269	E	92.1	Very high	93.7	Very high	130 Å²	130	51 Å²	51	61%	0.607	25%	0.247	S	C	*	.	H	α-helix	trans	-58.1	-40.7	176.7	-67.1	-171.5	-174.4	0	0	112.8	N265	N265-E269 WeakPolarHBondContact O-CB 3.48Å; N265-E269 VanDerWaalsContact O-CG 3.25Å; N265-E269 WeakPolarHBondContact O-CG 3.21Å; N265-E269 VanDerWaalsContact O-OE2 3.11Å
270	N	92.9	Very high	93.6	Very high	44 Å²	44	51.5 Å²	51.5	24%	0.235	25%	0.25	C	C	.	.	H	α-helix	trans	-72.8	-32.7	178.5	-75.3	-42.1	0	0	0	113	Y266 Y267 I268 R273	Y266-N270 WeakPolarHBondContact CD1-ND2 3.43Å; Y266-N270 WeakPolarHBondContact CE1-ND2 3.47Å; Y266-N270 WeakPolarHBondContact O-CB 3.48Å; Y266-N270 PolarHBondContact O-N 3.44Å; Y266-N270 PolarHBondContact O-ND2 3.25Å; Y267-N270 PolarHBondContact O-N 2.91Å; I268-N270 VanDerWaalsContact C-N 3.3Å; I268-N270 PolarHBondContact O-N 3.5Å; N270-R273 PolarHBondContact OD1-NH2 2.85Å
271	M	93.8	Very high	93.6	Very high	14 Å²	14	53.6 Å²	53.6	7%	0.069	26%	0.262	C	S	.	.	H	α-helix	trans	-75.7	-22.8	-179.4	-86.3	-60.6	-166.9	0	0	113.9	F183 K219 I223 Y267 I268 R273 Y274 S275 I277	F183-M271 HydrophobicContact CB-CE 3.4Å; F183-M271 VanDerWaalsContact CB-CE 3.4Å; F183-M271 HydrophobicContact CD1-CE 3.59Å; F183-M271 HydrophobicContact CD2-CE 4.46Å; F183-M271 HydrophobicContact CG-CE 3.58Å; K219-M271 HydrophobicContact CD-CE 4.32Å; K219-M271 HydrophobicContact CD-SD 4.02Å; I223-M271 HydrophobicContact CD1-CB 3.81Å; I223-M271 HydrophobicContact CD1-CG 3.94Å; I223-M271 HydrophobicContact CD1-SD 4.47Å; Y267-M271 HydrophobicContact CD2-CG 3.96Å; Y267-M271 HydrophobicContact CE1-CG 4.47Å; Y267-M271 HydrophobicContact CE2-CE 3.69Å; Y267-M271 HydrophobicContact CE2-CG 3.5Å; Y267-M271 HydrophobicContact CE2-SD 4.5Å; Y267-M271 WeakPolarHBondContact O-CB 3.12Å; Y267-M271 PolarHBondContact O-N 3.11Å; I268-M271 PolarHBondContact O-N 3.31Å; I268-M271 VanDerWaalsContact O-N 3.15Å; M271-R273 PolarHBondContact O-N 2.73Å; M271-R273 VanDerWaalsContact O-N 3.12Å; M271-Y274 PolarHBondContact O-N 3.17Å; M271-Y274 HydrophobicContact SD-CD2 4.19Å; M271-S275 PolarHBondContact O-N 3.5Å; M271-I277 HydrophobicContact CB-CD1 4.01Å
272	D	92.2	Very high	93.4	Very high	80 Å²	80	50.1 Å²	50.1	43%	0.428	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.9	177.2	-178.1	46.9	0	0	0	112.3	I268 Y274 S275 I277 K316	I268-D272 PolarHBondContact O-N 2.99Å; I268-D272 VanDerWaalsContact O-N 3.14Å; D272-Y274 PolarHBondContact O-N 2.81Å; D272-S275 WeakPolarHBondContact CA-O 3.29Å; D272-I277 HydrophobicContact CB-CD1 4.01Å; D272-I277 HydrophobicContact CB-CG1 4.45Å; D272-K316 WeakPolarHBondContact O-CE 3.19Å; D272-K316 PolarHBondContact O-NZ 3.24Å; D272-K316 IonicContact OD1-NZ 2.63Å; D272-K316 PolarHBondContact OD1-NZ 2.84Å; D272-K316 VanDerWaalsContact OD1-NZ 3.09Å
273	R	91.7	Very high	93.1	Very high	143 Å²	143	52.7 Å²	52.7	54%	0.54	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-22.9	172.6	-68.6	-172	-91.8	-171.9	-8.9	113.8	N270 M271 Y315 K316	N270-R273 PolarHBondContact OD1-NH2 2.85Å; M271-R273 PolarHBondContact O-N 2.73Å; M271-R273 VanDerWaalsContact O-N 3.12Å; R273-Y315 CarbonylContact O-C 3.59Å; R273-Y315 WeakPolarHBondContact O-CB 3.43Å; R273-K316 WeakPolarHBondContact O-CA 3.37Å; R273-K316 PolarHBondContact O-N 2.61Å; R273-K316 VanDerWaalsContact O-N 3.12Å
274	Y	92.1	Very high	92.8	Very high	80 Å²	80	57.9 Å²	57.9	31%	0.314	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-33.6	-172.5	-59	-73	0	0	0	113.8	K219 M271 D272 Y315 K316 F317	K219-Y274 HydrophobicContact CD-CD1 3.91Å; K219-Y274 HydrophobicContact CD-CD2 3.86Å; K219-Y274 HydrophobicContact CD-CG 3.44Å; K219-Y274 VanDerWaalsContact CD-CG 3.44Å; M271-Y274 PolarHBondContact O-N 3.17Å; M271-Y274 HydrophobicContact SD-CD2 4.19Å; D272-Y274 PolarHBondContact O-N 2.81Å; Y274-Y315 HydrophobicContact CE1-CD1 4.5Å; Y274-K316 WeakPolarHBondContact O-CA 3.49Å; Y274-F317 PolarHBondContact O-N 2.99Å
275	S	93.1	Very high	92.6	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.297	C	S	.	.	S	Bend	trans	-130.6	156.9	-172.8	-60.5	0	0	0	0	110	P220 M271 D272	P220-S275 WeakPolarHBondContact O-CB 3.49Å; P220-S275 PolarHBondContact O-OG 3.4Å; M271-S275 PolarHBondContact O-N 3.5Å; D272-S275 WeakPolarHBondContact CA-O 3.29Å
276	H	93.7	Very high	92.5	Very high	47 Å²	47	58.5 Å²	58.5	22%	0.218	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	147.2	165.8	-86.6	-64.5	0	0	0	110.3	H221 L222 I223 V303 D304 L305 K316 F317	H221-H276 PolarHBondContact O-N 3.04Å; L222-H276 CarbonylContact C-O 3.25Å; L222-H276 WeakPolarHBondContact CA-O 3.36Å; L222-H276 HydrophobicContact CD1-CB 4.18Å; I223-H276 PolarHBondContact N-O 2.88Å; H276-V303 HydrophobicContact CB-CG1 3.74Å; H276-D304 PolarHBondContact CD2-O 3.25Å; H276-D304 VanDerWaalsContact CD2-O 3.27Å; H276-D304 PolarHBondContact NE2-O 3.13Å; H276-L305 HydrophobicContact CB-CD2 3.97Å; H276-K316 PolarHBondContact CE1-NZ 3.32Å; H276-K316 PolarHBondContact ND1-NZ 3.07Å; H276-F317 HydrophobicContact CB-CZ 4.27Å; H276-F317 AromaticContact CD2-CE2 3.52Å; H276-F317 AromaticContact CD2-CZ 3.42Å; H276-F317 VanDerWaalsContact CD2-CZ 3.42Å; H276-F317 WeakPolarHBondContact CD2-CZ 3.37Å
277	I	94.9	Very high	92.3	Very high	35 Å²	35	52.1 Å²	52.1	18%	0.179	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	131.9	-178	-52.5	-169.9	0	0	0	109.2	I223 I268 M271 D272 T279	I223-I277 HydrophobicContact CB-CG1 4.34Å; I223-I277 CarbonylContact O-C 3.57Å; I223-I277 VanDerWaalsContact O-CA 3.3Å; I223-I277 WeakPolarHBondContact O-CA 3.24Å; I268-I277 HydrophobicContact CB-CD1 4.37Å; I268-I277 HydrophobicContact CD1-CD1 4.24Å; I268-I277 HydrophobicContact CD1-CG2 4.26Å; I268-I277 HydrophobicContact CG2-CD1 3.76Å; I268-I277 HydrophobicContact CG2-CG2 3.95Å; I268-I277 WeakPolarHBondContact O-CD1 3.47Å; M271-I277 HydrophobicContact CB-CD1 4.01Å; D272-I277 HydrophobicContact CB-CD1 4.01Å; D272-I277 HydrophobicContact CB-CG1 4.45Å; I277-T279 HydrophobicContact CG2-CG2 4.27Å
278	I	95.1	Very high	92	Very high	24 Å²	24	58 Å²	58	12%	0.123	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	119.4	168	-68	170.6	0	0	0	107.1	L222 I223 V224 Y225 V280 A300 V303	L222-I278 HydrophobicContact CD1-CB 4.48Å; L222-I278 HydrophobicContact CD1-CD1 3.79Å; L222-I278 HydrophobicContact CD1-CG1 3.85Å; L222-I278 HydrophobicContact CD2-CD1 4.08Å; I223-I278 PolarHBondContact O-N 2.71Å; V224-I278 CarbonylContact C-O 3.56Å; V224-I278 WeakPolarHBondContact CA-O 3.35Å; Y225-I278 PolarHBondContact N-O 2.7Å; I278-V280 HydrophobicContact CG2-CG2 4.2Å; I278-A300 HydrophobicContact CD1-CB 3.77Å; I278-V303 HydrophobicContact CD1-CG2 3.89Å; I278-V303 HydrophobicContact CG1-CG2 4.24Å
279	T	94.9	Very high	91.9	Very high	98 Å²	98	60.3 Å²	60.3	60%	0.601	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	122.7	174.1	56.3	0	0	0	0	110	Y225 I277	Y225-T279 HydrophobicContact CD1-CG2 3.94Å; Y225-T279 CarbonylContact O-C 3.47Å; Y225-T279 WeakPolarHBondContact O-CA 3.12Å; I277-T279 HydrophobicContact CG2-CG2 4.27Å
280	V	94.1	Very high	91.9	Very high	10 Å²	10	58.7 Å²	58.7	6%	0.061	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	118.8	175.7	-179.3	0	0	0	0	108.1	V224 Y225 I226 R227 I278 V285 I296	V224-V280 HydrophobicContact CG1-CG2 3.99Å; Y225-V280 PolarHBondContact O-N 2.64Å; I226-V280 WeakPolarHBondContact CA-O 3.45Å; I226-V280 HydrophobicContact CG1-CB 4.45Å; R227-V280 PolarHBondContact N-O 3.41Å; I278-V280 HydrophobicContact CG2-CG2 4.2Å; V280-V285 HydrophobicContact CG1-CB 4.02Å; V280-V285 HydrophobicContact CG1-CG1 4.17Å; V280-V285 HydrophobicContact CG1-CG2 4.19Å; V280-I296 HydrophobicContact CG1-CD1 3.87Å; V280-I296 HydrophobicContact CG1-CG1 4.35Å; V280-I296 HydrophobicContact CG2-CD1 4.04Å; V280-I296 HydrophobicContact CG2-CG1 4.05Å; V280-I296 HydrophobicContact CG2-CG2 4.09Å
281	D	93.8	Very high	91.8	Very high	67 Å²	67	62.2 Å²	62.2	36%	0.358	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	112.1	173.5	-169.6	-11.2	0	0	0	109.9	S283 T284 V285	D281-S283 PolarHBondContact O-N 2.75Å; D281-S283 VanDerWaalsContact OD1-CB 3.28Å; D281-S283 WeakPolarHBondContact OD1-CB 3.3Å; D281-S283 PolarHBondContact OD1-N 3.28Å; D281-S283 PolarHBondContact OD1-OG 2.9Å; D281-S283 PolarHBondContact OD2-OG 2.98Å; D281-T284 PolarHBondContact O-N 3.13Å; D281-T284 PolarHBondContact O-OG1 3.39Å; D281-V285 PolarHBondContact O-N 3.16Å
282	A	90.8	Very high	91.8	Very high	6 Å²	6	63.3 Å²	63.3	5%	0.05	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-5.9	179.1	0	0	0	0	0	113.1	I226 R227 A228 Q232 T284 V287	I226-A282 HydrophobicContact CG2-CB 4.18Å; R227-A282 WeakPolarHBondContact O-CB 3.45Å; R227-A282 PolarHBondContact O-N 2.97Å; A228-A282 HydrophobicContact CB-CB 3.92Å; Q232-A282 PolarHBondContact NE2-O 3.43Å; Q232-A282 PolarHBondContact OE1-O 3.49Å; A282-T284 VanDerWaalsContact C-N 3.35Å; A282-V287 HydrophobicContact CB-CG2 4.25Å
283	S	89.4	Confident	91.8	Very high	67 Å²	67	59.5 Å²	59.5	47%	0.469	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-32.5	168.8	72.6	0	0	0	0	112.3	D281	D281-S283 PolarHBondContact O-N 2.75Å; D281-S283 VanDerWaalsContact OD1-CB 3.28Å; D281-S283 WeakPolarHBondContact OD1-CB 3.3Å; D281-S283 PolarHBondContact OD1-N 3.28Å; D281-S283 PolarHBondContact OD1-OG 2.9Å; D281-S283 PolarHBondContact OD2-OG 2.98Å
284	T	89.6	Confident	91.8	Very high	109 Å²	109	56 Å²	56	67%	0.669	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-32.6	-178.8	51.8	0	0	0	0	113.1	D281 A282	D281-T284 PolarHBondContact O-N 3.13Å; D281-T284 PolarHBondContact O-OG1 3.39Å; A282-T284 VanDerWaalsContact C-N 3.35Å
285	V	87.7	Confident	91.9	Very high	32 Å²	32	55.9 Å²	55.9	19%	0.194	30%	0.298	C	S	.	.	S	Bend	trans	-108.1	125.2	-173.7	-177.1	0	0	0	0	109.9	V280 D281 V287 D292 I296	V280-V285 HydrophobicContact CG1-CB 4.02Å; V280-V285 HydrophobicContact CG1-CG1 4.17Å; V280-V285 HydrophobicContact CG1-CG2 4.19Å; D281-V285 PolarHBondContact O-N 3.16Å; V285-V287 PolarHBondContact O-N 3.47Å; V285-V287 VanDerWaalsContact O-N 3.17Å; V285-D292 HydrophobicContact CG1-CB 3.63Å; V285-I296 HydrophobicContact CG1-CD1 4.18Å
286	N	89.9	Confident	91.9	Very high	88 Å²	88	56.1 Å²	56.1	47%	0.471	30%	0.299	S	S	.	.			trans	-79.5	98.5	171.4	-175.8	7.7	0	0	0	110	Y288 D289 D292	N286-Y288 PolarHBondContact O-N 2.81Å; N286-Y288 PolarHBondContact OD1-N 3.42Å; N286-Y288 VanDerWaalsContact OD1-N 3.15Å; N286-D289 HydrophobicContact CB-CB 3.99Å; N286-D289 PolarHBondContact O-N 3Å; N286-D292 WeakPolarHBondContact CA-OD2 3.15Å; N286-D292 WeakPolarHBondContact CB-OD2 3.3Å; N286-D292 PolarHBondContact N-OD2 3.33Å
287	V	87.4	Confident	91.9	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.012	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-21	176.9	167	0	0	0	0	114.4	G79 N82 V83 I226 A282 V285 N293	G79-V287 VanDerWaalsContact O-CG1 3.24Å; G79-V287 WeakPolarHBondContact O-CG1 3.39Å; N82-V287 HydrophobicContact CB-CG1 4.49Å; N82-V287 PolarHBondContact ND2-O 3.1Å; V83-V287 HydrophobicContact CG2-CB 4.18Å; V83-V287 HydrophobicContact CG2-CG1 3.34Å; V83-V287 HydrophobicContact CG2-CG2 4.16Å; I226-V287 HydrophobicContact CG2-CG2 4.16Å; A282-V287 HydrophobicContact CB-CG2 4.25Å; V285-V287 PolarHBondContact O-N 3.47Å; V285-V287 VanDerWaalsContact O-N 3.17Å; V287-N293 PolarHBondContact O-ND2 3.42Å
288	Y	89.8	Confident	91.8	Very high	124 Å²	124	55.8 Å²	55.8	49%	0.486	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-7.7	178.2	-63.2	-76	0	0	0	114.6	N82 K236 N286	N82-Y288 HydrophobicContact CB-CD1 4.18Å; N82-Y288 HydrophobicContact CB-CE1 4.14Å; K236-Y288 HydrophobicContact CD-CE2 4.47Å; N286-Y288 PolarHBondContact O-N 2.81Å; N286-Y288 PolarHBondContact OD1-N 3.42Å; N286-Y288 VanDerWaalsContact OD1-N 3.15Å
289	D	92.2	Very high	91.6	Very high	66 Å²	66	58.1 Å²	58.1	35%	0.353	31%	0.31	S	S	.	.			trans	-87.2	137.2	177.5	-172.3	36	0	0	0	110.9	N286 D292 N293	N286-D289 HydrophobicContact CB-CB 3.99Å; N286-D289 PolarHBondContact O-N 3Å; D289-D292 HydrophobicContact CB-CB 4.19Å; D289-N293 PolarHBondContact O-N 2.94Å; D289-N293 PolarHBondContact O-ND2 2.94Å
290	D	90.6	Very high	91.5	Very high	97 Å²	97	53.5 Å²	53.5	52%	0.519	28%	0.282	S	S	.	.	H	α-helix	trans	-74.8	-32.5	-175	-76.7	-25.6	0	0	0	111.4	N86 N293 Y294	N86-D290 PolarHBondContact ND2-OD1 2.62Å; N86-D290 VanDerWaalsContact ND2-OD1 3.07Å; D290-N293 PolarHBondContact O-N 2.85Å; D290-Y294 WeakPolarHBondContact O-CB 3.28Å; D290-Y294 PolarHBondContact O-N 3.44Å
291	D	91.9	Very high	91.4	Very high	118 Å²	118	54.4 Å²	54.4	63%	0.631	29%	0.287	S	S	*	.	H	α-helix	trans	-66.6	-44.7	177.3	-70.4	-19.5	0	0	0	111.1	N293 Y294 I295	D291-N293 PolarHBondContact O-N 2.54Å; D291-Y294 WeakPolarHBondContact O-CB 3.34Å; D291-Y294 PolarHBondContact O-N 3.43Å; D291-I295 WeakPolarHBondContact O-CG1 3.5Å; D291-I295 PolarHBondContact O-N 2.87Å
292	D	92.6	Very high	91.1	Very high	36 Å²	36	58.7 Å²	58.7	19%	0.193	31%	0.305	C	S	.	.	H	α-helix	trans	-61.9	-42	174.3	-86.3	-15.5	0	0	0	112.3	V285 N286 D289 Y294 I295 I296	V285-D292 HydrophobicContact CG1-CB 3.63Å; N286-D292 WeakPolarHBondContact CA-OD2 3.15Å; N286-D292 WeakPolarHBondContact CB-OD2 3.3Å; N286-D292 PolarHBondContact N-OD2 3.33Å; D289-D292 HydrophobicContact CB-CB 4.19Å; D292-Y294 VanDerWaalsContact C-N 3.28Å; D292-Y294 PolarHBondContact O-N 3.27Å; D292-I295 PolarHBondContact O-N 2.82Å; D292-I296 WeakPolarHBondContact O-CG1 3.05Å; D292-I296 PolarHBondContact O-N 3.36Å
293	N	92.5	Very high	90.9	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-64.1	-34.2	174.8	-77.1	-55.5	0	0	0	112.3	N86 V287 D289 D290 D291 I296 A297	N86-N293 HydrophobicContact CB-CB 4.01Å; N86-N293 PolarHBondContact ND2-ND2 3.47Å; V287-N293 PolarHBondContact O-ND2 3.42Å; D289-N293 PolarHBondContact O-N 2.94Å; D289-N293 PolarHBondContact O-ND2 2.94Å; D290-N293 PolarHBondContact O-N 2.85Å; D291-N293 PolarHBondContact O-N 2.54Å; N293-I296 PolarHBondContact O-N 3.31Å; N293-A297 PolarHBondContact O-N 3.48Å
294	Y	92.5	Very high	90.7	Very high	69 Å²	69	58.5 Å²	58.5	27%	0.271	30%	0.299	S	S	.	.	H	α-helix	trans	-66.7	-39.7	173.8	179.6	-105	0	0	0	111.9	L26 H90 D290 D291 D292 I296 A297 Q298	L26-Y294 HydrophobicContact CD1-CE2 3.91Å; H90-Y294 AromaticContact CE1-CD2 3.98Å; H90-Y294 AromaticContact ND1-CD2 3.96Å; D290-Y294 WeakPolarHBondContact O-CB 3.28Å; D290-Y294 PolarHBondContact O-N 3.44Å; D291-Y294 WeakPolarHBondContact O-CB 3.34Å; D291-Y294 PolarHBondContact O-N 3.43Å; D292-Y294 VanDerWaalsContact C-N 3.28Å; D292-Y294 PolarHBondContact O-N 3.27Å; Y294-I296 PolarHBondContact O-N 2.75Å; Y294-A297 WeakPolarHBondContact O-CB 3.4Å; Y294-A297 PolarHBondContact O-N 3.39Å; Y294-A297 VanDerWaalsContact O-N 3.14Å; Y294-Q298 HydrophobicContact CD1-CG 4.35Å; Y294-Q298 VanDerWaalsContact CE1-CD 3.47Å; Y294-Q298 HydrophobicContact CE1-CG 3.98Å; Y294-Q298 VanDerWaalsContact CZ-NE2 3.33Å; Y294-Q298 PolarHBondContact O-N 2.73Å; Y294-Q298 PolarHBondContact OH-NE2 3.24Å; Y294-Q298 VanDerWaalsContact OH-NE2 3.17Å
295	I	93.3	Very high	90.5	Very high	79 Å²	79	53.5 Å²	53.5	41%	0.405	27%	0.268	S	S	.	.	H	α-helix	trans	-61.7	-42.7	173.5	-65.3	166.2	0	0	0	110.9	D291 D292 A297 Q298 N299	D291-I295 WeakPolarHBondContact O-CG1 3.5Å; D291-I295 PolarHBondContact O-N 2.87Å; D292-I295 PolarHBondContact O-N 2.82Å; I295-A297 VanDerWaalsContact C-N 3.27Å; I295-A297 PolarHBondContact O-N 3.23Å; I295-Q298 PolarHBondContact O-N 3.04Å; I295-N299 VanDerWaalsContact O-CG 3.27Å; I295-N299 PolarHBondContact O-N 3.45Å
296	I	93.5	Very high	89.8	Confident	5 Å²	5	53.1 Å²	53.1	3%	0.026	27%	0.265	C	S	.	.	H	α-helix	trans	-59.4	-42.2	174.4	-61	166.8	0	0	0	110.4	V83 L87 V224 V280 V285 D292 N293 Y294 N299 A300	V83-I296 HydrophobicContact CG1-CD1 4.28Å; L87-I296 HydrophobicContact CD2-CG2 4.12Å; V224-I296 HydrophobicContact CG1-CG2 4.31Å; V280-I296 HydrophobicContact CG1-CD1 3.87Å; V280-I296 HydrophobicContact CG1-CG1 4.35Å; V280-I296 HydrophobicContact CG2-CD1 4.04Å; V280-I296 HydrophobicContact CG2-CG1 4.05Å; V280-I296 HydrophobicContact CG2-CG2 4.09Å; V285-I296 HydrophobicContact CG1-CD1 4.18Å; D292-I296 WeakPolarHBondContact O-CG1 3.05Å; D292-I296 PolarHBondContact O-N 3.36Å; N293-I296 PolarHBondContact O-N 3.31Å; Y294-I296 PolarHBondContact O-N 2.75Å; I296-N299 PolarHBondContact O-N 3.29Å; I296-A300 WeakPolarHBondContact O-CB 3.43Å; I296-A300 PolarHBondContact O-N 2.9Å
297	A	93.4	Very high	89	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64.9	-40.1	177.5	0	0	0	0	0	112.3	L26 L87 H90 F91 N293 Y294 I295 A300 T301	L26-A297 HydrophobicContact CD2-CB 3.74Å; L87-A297 HydrophobicContact CD2-CB 3.91Å; H90-A297 HydrophobicContact CB-CB 3.91Å; F91-A297 HydrophobicContact CE2-CB 4.43Å; F91-A297 HydrophobicContact CZ-CB 4.04Å; F91-A297 WeakPolarHBondContact CZ-O 3.42Å; N293-A297 PolarHBondContact O-N 3.48Å; Y294-A297 WeakPolarHBondContact O-CB 3.4Å; Y294-A297 PolarHBondContact O-N 3.39Å; Y294-A297 VanDerWaalsContact O-N 3.14Å; I295-A297 VanDerWaalsContact C-N 3.27Å; I295-A297 PolarHBondContact O-N 3.23Å; A297-A300 PolarHBondContact O-N 3.33Å; A297-T301 WeakPolarHBondContact O-CG2 3.49Å; A297-T301 PolarHBondContact O-N 3.43Å
298	Q	92.1	Very high	88	Confident	75 Å²	75	55.2 Å²	55.2	35%	0.35	27%	0.273	S	S	.	.	H	α-helix	trans	-62.6	-47.7	173.4	-74.9	-172	-23.8	0	0	111.9	L26 Y294 I295 A300 T301 E302	L26-Q298 HydrophobicContact CD1-CG 3.95Å; Y294-Q298 HydrophobicContact CD1-CG 4.35Å; Y294-Q298 VanDerWaalsContact CE1-CD 3.47Å; Y294-Q298 HydrophobicContact CE1-CG 3.98Å; Y294-Q298 VanDerWaalsContact CZ-NE2 3.33Å; Y294-Q298 PolarHBondContact O-N 2.73Å; Y294-Q298 PolarHBondContact OH-NE2 3.24Å; Y294-Q298 VanDerWaalsContact OH-NE2 3.17Å; I295-Q298 PolarHBondContact O-N 3.04Å; Q298-A300 PolarHBondContact O-N 2.83Å; Q298-A300 VanDerWaalsContact O-N 3.16Å; Q298-T301 PolarHBondContact O-N 3.38Å; Q298-T301 PolarHBondContact O-OG1 3.04Å; Q298-E302 PolarHBondContact O-N 3.43Å
299	N	92.7	Very high	87.2	Confident	73 Å²	73	59.7 Å²	59.7	39%	0.39	29%	0.289	S	S	.	.	H	α-helix	trans	-58.7	-33.8	176.6	-66.7	-14.8	0	0	0	111.5	I295 I296 E302	I295-N299 VanDerWaalsContact O-CG 3.27Å; I295-N299 PolarHBondContact O-N 3.45Å; I296-N299 PolarHBondContact O-N 3.29Å; N299-E302 PolarHBondContact O-N 3.44Å
300	A	92.6	Very high	86.5	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.008	28%	0.282	C	S	.	.	H	α-helix	trans	-71.5	-23.8	175.8	0	0	0	0	0	114.3	L24 F91 L222 I278 I296 A297 Q298	L24-A300 HydrophobicContact CD1-CB 4.34Å; F91-A300 HydrophobicContact CE2-CB 4.35Å; F91-A300 HydrophobicContact CZ-CB 3.9Å; L222-A300 HydrophobicContact CD2-CB 3.78Å; I278-A300 HydrophobicContact CD1-CB 3.77Å; I296-A300 WeakPolarHBondContact O-CB 3.43Å; I296-A300 PolarHBondContact O-N 2.9Å; A297-A300 PolarHBondContact O-N 3.33Å; Q298-A300 PolarHBondContact O-N 2.83Å; Q298-A300 VanDerWaalsContact O-N 3.16Å
301	T	90.5	Very high	85.8	Confident	29 Å²	29	60.9 Å²	60.9	18%	0.178	29%	0.292	C	S	.	.	H	α-helix	trans	-77.5	-22.8	173.2	64	0	0	0	0	113.4	T23 L24 L26 F91 A297 Q298 V303	T23-T301 VanDerWaalsContact CB-O 3.25Å; T23-T301 WeakPolarHBondContact CB-O 3.37Å; L24-T301 HydrophobicContact CB-CG2 4.07Å; L24-T301 WeakPolarHBondContact O-CB 3.45Å; L24-T301 WeakPolarHBondContact O-CG2 3.35Å; L26-T301 HydrophobicContact CD2-CG2 4.24Å; L26-T301 HydrophobicContact CG-CG2 3.91Å; F91-T301 HydrophobicContact CE1-CG2 3.72Å; F91-T301 HydrophobicContact CZ-CG2 4.35Å; A297-T301 WeakPolarHBondContact O-CG2 3.49Å; A297-T301 PolarHBondContact O-N 3.43Å; Q298-T301 PolarHBondContact O-N 3.38Å; Q298-T301 PolarHBondContact O-OG1 3.04Å; T301-V303 VanDerWaalsContact C-N 3.25Å; T301-V303 PolarHBondContact O-N 3.12Å
302	E	88.3	Confident	84.8	Confident	156 Å²	156	64.9 Å²	64.9	73%	0.729	30%	0.299	S	S	*	.	H	α-helix	trans	-74	-19.1	176.5	-61.9	-177.4	172	0	0	112.7	Q298 N299	Q298-E302 PolarHBondContact O-N 3.43Å; N299-E302 PolarHBondContact O-N 3.44Å
303	V	87.6	Confident	84	Confident	29 Å²	29	69.9 Å²	69.9	18%	0.176	33%	0.325	C	S	.	.	S	Bend	trans	-75.3	126.4	-179.4	-175.7	0	0	0	0	111.3	H276 I278 T301 L305	H276-V303 HydrophobicContact CB-CG1 3.74Å; I278-V303 HydrophobicContact CD1-CG2 3.89Å; I278-V303 HydrophobicContact CG1-CG2 4.24Å; T301-V303 VanDerWaalsContact C-N 3.25Å; T301-V303 PolarHBondContact O-N 3.12Å; V303-L305 HydrophobicContact CB-CD2 4.44Å; V303-L305 HydrophobicContact CG1-CD2 3.71Å; V303-L305 HydrophobicContact CG1-CG 4.28Å; V303-L305 PolarHBondContact O-N 2.72Å
304	D	85.1	Confident	83.6	Confident	41 Å²	41	72.6 Å²	72.6	22%	0.219	34%	0.34	C	S	.	.			trans	-71.4	97.8	171.5	-179	-2.5	0	0	0	110.4	H276 D306 G307 R309	H276-D304 PolarHBondContact CD2-O 3.25Å; H276-D304 VanDerWaalsContact CD2-O 3.27Å; H276-D304 PolarHBondContact NE2-O 3.13Å; D304-D306 WeakPolarHBondContact OD1-CB 3.44Å; D304-D306 PolarHBondContact OD1-N 2.67Å; D304-G307 PolarHBondContact OD1-N 3.19Å; D304-R309 IonicContact OD2-NE 3.41Å
305	L	85	Confident	83.4	Confident	4 Å²	4	76.2 Å²	76.2	2%	0.021	35%	0.354	C	S	.	.			trans	-94.8	7	175.6	-61	-174.8	0	0	0	113.3	L24 K68 H221 L222 H276 V303 F317	L24-L305 HydrophobicContact CD1-CD1 3.79Å; L24-L305 HydrophobicContact CD2-CD1 4.32Å; L24-L305 HydrophobicContact CG-CD1 3.79Å; K68-L305 HydrophobicContact CG-CD1 4.18Å; H221-L305 HydrophobicContact CB-CD1 4.29Å; H221-L305 HydrophobicContact CB-CD2 4.48Å; L222-L305 HydrophobicContact CB-CD1 4.35Å; L222-L305 HydrophobicContact CB-CD2 4.39Å; H276-L305 HydrophobicContact CB-CD2 3.97Å; V303-L305 HydrophobicContact CB-CD2 4.44Å; V303-L305 HydrophobicContact CG1-CD2 3.71Å; V303-L305 HydrophobicContact CG1-CG 4.28Å; V303-L305 PolarHBondContact O-N 2.72Å; L305-F317 HydrophobicContact CD2-CE2 4.48Å; L305-F317 HydrophobicContact CD2-CZ 3.95Å
306	D	71.9	Confident	83.2	Confident	24 Å²	24	73.5 Å²	73.5	13%	0.128	34%	0.339	C	S	.	.	S	Bend	trans	-89.6	-28.3	-177.1	-62.9	-39.1	0	0	0	111.8	Y21 G22 T23 K68 D304 E308	Y21-D306 WeakPolarHBondContact CA-OD1 3.46Å; Y21-D306 HydrophobicContact CD1-CB 4.24Å; G22-D306 WeakPolarHBondContact CA-OD2 3.5Å; G22-D306 PolarHBondContact N-OD1 3.12Å; G22-D306 PolarHBondContact N-OD2 3.31Å; T23-D306 PolarHBondContact N-OD2 3.35Å; K68-D306 IonicContact NZ-OD1 3.25Å; K68-D306 PolarHBondContact NZ-OD1 3.06Å; D304-D306 WeakPolarHBondContact OD1-CB 3.44Å; D304-D306 PolarHBondContact OD1-N 2.67Å; D306-E308 HydrophobicContact CB-CG 4.11Å; D306-E308 PolarHBondContact O-N 3.12Å
307	G	73.8	Confident	83	Confident	5 Å²	5	73.6 Å²	73.6	5%	0.052	34%	0.34	C	S	.	.			trans	69.5	18.7	178.2	0	0	0	0	0	113.2	D304 R309 L310	D304-G307 PolarHBondContact OD1-N 3.19Å; G307-R309 PolarHBondContact O-N 3.06Å; G307-L310 VanDerWaalsContact CA-CD1 3.45Å; G307-L310 WeakPolarHBondContact O-CB 3.44Å; G307-L310 PolarHBondContact O-N 3.11Å; G307-L310 VanDerWaalsContact O-N 3.1Å
308	E	65.8	Low	82.7	Confident	128 Å²	128	76.7 Å²	76.7	60%	0.598	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-34.6	177.8	-69.3	-165.1	150.5	0	0	111.8	Y21 D306 L310	Y21-E308 WeakPolarHBondContact CB-OE1 3.21Å; Y21-E308 HydrophobicContact CD1-CG 3.63Å; Y21-E308 HydrophobicContact CE1-CG 4.33Å; Y21-E308 HydrophobicContact CG-CG 4.02Å; D306-E308 HydrophobicContact CB-CG 4.11Å; D306-E308 PolarHBondContact O-N 3.12Å; E308-L310 VanDerWaalsContact C-N 3.3Å
309	R	72.7	Confident	82.4	Confident	219 Å²	219	76 Å²	76	83%	0.826	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-8.7	179.2	-60.2	178.3	-177.1	176.4	4.3	113.2	D304 G307	D304-R309 IonicContact OD2-NE 3.41Å; G307-R309 PolarHBondContact O-N 3.06Å
310	L	78.9	Confident	82.2	Confident	39 Å²	39	73 Å²	73	20%	0.204	34%	0.336	C	S	.	.	S	Bend	trans	-78.6	135.9	-177.5	-58.1	172.6	0	0	0	110.3	G307 E308 D314 K316 F317	G307-L310 VanDerWaalsContact CA-CD1 3.45Å; G307-L310 WeakPolarHBondContact O-CB 3.44Å; G307-L310 PolarHBondContact O-N 3.11Å; G307-L310 VanDerWaalsContact O-N 3.1Å; E308-L310 VanDerWaalsContact C-N 3.3Å; L310-D314 HydrophobicContact CB-CB 4.08Å; L310-D314 WeakPolarHBondContact CD2-OD2 3.14Å; L310-K316 HydrophobicContact CD1-CB 3.8Å; L310-K316 HydrophobicContact CD1-CD 4.46Å; L310-K316 HydrophobicContact CD1-CG 3.93Å; L310-K316 HydrophobicContact CD2-CB 4.35Å; L310-K316 HydrophobicContact CD2-CD 4.38Å; L310-F317 HydrophobicContact CD1-CD2 4.01Å
311	M	75.7	Confident	81.8	Confident	148 Å²	148	75.6 Å²	75.6	73%	0.729	35%	0.345	S	S	*	.			trans	-63.5	159.8	172.9	-63.9	-64.2	-81.4	0	0	110.5	D313 D314 R321	M311-D313 PolarHBondContact O-N 3.44Å; M311-D314 WeakPolarHBondContact O-CB 3.47Å; M311-D314 PolarHBondContact O-N 2.99Å; M311-R321 PolarHBondContact O-NH1 2.92Å
312	R	71	Confident	81.4	Confident	203 Å²	203	78.1 Å²	78.1	77%	0.766	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-34.5	-179.9	-175.8	178.1	176	-179	-3.4	112.6
313	D	75	Confident	81.1	Confident	140 Å²	140	70.7 Å²	70.7	75%	0.749	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	2.4	-174.7	-56	-27.9	0	0	0	113.1	M311	M311-D313 PolarHBondContact O-N 3.44Å
314	D	84.6	Confident	80.6	Confident	58 Å²	58	71.4 Å²	71.4	31%	0.31	33%	0.325	S	S	.	.			trans	-67.6	138.6	173.7	-155.7	-38.4	0	0	0	110.1	L310 M311 K316 R321	L310-D314 HydrophobicContact CB-CB 4.08Å; L310-D314 WeakPolarHBondContact CD2-OD2 3.14Å; M311-D314 WeakPolarHBondContact O-CB 3.47Å; M311-D314 PolarHBondContact O-N 2.99Å; D314-K316 VanDerWaalsContact C-N 3.29Å; D314-K316 WeakPolarHBondContact OD1-CB 3.25Å; D314-K316 PolarHBondContact OD1-N 3.02Å; D314-R321 PolarHBondContact O-NH2 3.2Å
315	Y	87.6	Confident	80.2	Confident	145 Å²	145	76.4 Å²	76.4	57%	0.569	34%	0.341	S	S	*	.			trans	-79.7	-17	176.8	-67.8	-78.3	0	0	0	112.1	R273 Y274 F317 L318	R273-Y315 CarbonylContact O-C 3.59Å; R273-Y315 WeakPolarHBondContact O-CB 3.43Å; Y274-Y315 HydrophobicContact CE1-CD1 4.5Å; Y315-F317 PolarHBondContact O-N 2.9Å; Y315-L318 HydrophobicContact CD1-CD2 4.49Å; Y315-L318 WeakPolarHBondContact O-CB 3.04Å; Y315-L318 PolarHBondContact O-N 3.14Å
316	K	89.7	Confident	80.1	Confident	21 Å²	21	82 Å²	82	9%	0.091	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	126.6	-178.8	-170.6	162.9	-68.8	-167.4	0	110.7	D272 R273 Y274 H276 L310 D314 L318 R321	D272-K316 WeakPolarHBondContact O-CE 3.19Å; D272-K316 PolarHBondContact O-NZ 3.24Å; D272-K316 IonicContact OD1-NZ 2.63Å; D272-K316 PolarHBondContact OD1-NZ 2.84Å; D272-K316 VanDerWaalsContact OD1-NZ 3.09Å; R273-K316 WeakPolarHBondContact O-CA 3.37Å; R273-K316 PolarHBondContact O-N 2.61Å; R273-K316 VanDerWaalsContact O-N 3.12Å; Y274-K316 WeakPolarHBondContact O-CA 3.49Å; H276-K316 PolarHBondContact CE1-NZ 3.32Å; H276-K316 PolarHBondContact ND1-NZ 3.07Å; L310-K316 HydrophobicContact CD1-CB 3.8Å; L310-K316 HydrophobicContact CD1-CD 4.46Å; L310-K316 HydrophobicContact CD1-CG 3.93Å; L310-K316 HydrophobicContact CD2-CB 4.35Å; L310-K316 HydrophobicContact CD2-CD 4.38Å; D314-K316 VanDerWaalsContact C-N 3.29Å; D314-K316 WeakPolarHBondContact OD1-CB 3.25Å; D314-K316 PolarHBondContact OD1-N 3.02Å; K316-L318 PolarHBondContact O-N 3.15Å; K316-R321 PolarHBondContact O-NE 2.98Å; K316-R321 VanDerWaalsContact O-NE 3.1Å; K316-R321 PolarHBondContact O-NH2 2.83Å
317	F	88.8	Confident	80.4	Confident	8 Å²	8	83.6 Å²	83.6	4%	0.035	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	24.3	-177.2	-48.9	-44.1	0	0	0	115.8	H221 Y274 H276 L305 L310 Y315 Q319 W320 R321	H221-F317 HydrophobicContact CB-CE1 4.24Å; H221-F317 WeakPolarHBondContact O-CE1 3.46Å; H221-F317 VanDerWaalsContact O-CZ 3.26Å; H221-F317 WeakPolarHBondContact O-CZ 3.49Å; Y274-F317 PolarHBondContact O-N 2.99Å; H276-F317 HydrophobicContact CB-CZ 4.27Å; H276-F317 AromaticContact CD2-CE2 3.52Å; H276-F317 AromaticContact CD2-CZ 3.42Å; H276-F317 VanDerWaalsContact CD2-CZ 3.42Å; H276-F317 WeakPolarHBondContact CD2-CZ 3.37Å; L305-F317 HydrophobicContact CD2-CE2 4.48Å; L305-F317 HydrophobicContact CD2-CZ 3.95Å; L310-F317 HydrophobicContact CD1-CD2 4.01Å; Y315-F317 PolarHBondContact O-N 2.9Å; F317-Q319 VanDerWaalsContact C-N 3.31Å; F317-Q319 PolarHBondContact O-N 2.93Å; F317-W320 HydrophobicContact CB-CB 4.31Å; F317-W320 PolarHBondContact O-N 2.88Å; F317-W320 VanDerWaalsContact O-N 3.07Å; F317-R321 HydrophobicContact CB-CG 4.17Å; F317-R321 WeakPolarHBondContact O-CG 3.42Å; F317-R321 PolarHBondContact O-N 3.28Å
318	L	86.9	Confident	80.8	Confident	65 Å²	65	90.7 Å²	90.7	34%	0.34	41%	0.406	S	S	.	.	H	α-helix	trans	-53.1	-47	-172	-178.2	63.3	0	0	0	112.7	Y315 K316 L322	Y315-L318 HydrophobicContact CD1-CD2 4.49Å; Y315-L318 WeakPolarHBondContact O-CB 3.04Å; Y315-L318 PolarHBondContact O-N 3.14Å; K316-L318 PolarHBondContact O-N 3.15Å; L318-L322 HydrophobicContact CD1-CD1 3.92Å; L318-L322 HydrophobicContact CD1-CG 4.16Å; L318-L322 HydrophobicContact CG-CD1 3.95Å; L318-L322 WeakPolarHBondContact O-CB 3.48Å; L318-L322 WeakPolarHBondContact O-CG 2.88Å; L318-L322 PolarHBondContact O-N 3.24Å
319	Q	87.2	Confident	81.8	Confident	61 Å²	61	86.2 Å²	86.2	29%	0.285	39%	0.389	S	S	.	.	H	α-helix	trans	-63.9	-44.4	179	-70.2	167	-29.8	0	0	112.2	W218 F317 A323	W218-Q319 VanDerWaalsContact CA-OE1 3.25Å; W218-Q319 HydrophobicContact CD2-CB 4.1Å; W218-Q319 HydrophobicContact CG-CB 4.16Å; F317-Q319 VanDerWaalsContact C-N 3.31Å; F317-Q319 PolarHBondContact O-N 2.93Å; Q319-A323 WeakPolarHBondContact O-CB 3.23Å; Q319-A323 PolarHBondContact O-N 3.39Å
320	W	88.5	Confident	82.4	Confident	10 Å²	10	75.9 Å²	75.9	4%	0.038	35%	0.35	C	S	.	.	H	α-helix	trans	-63.9	-48.3	178	-62.6	104.4	0	0	0	111.8	V69 L166 L169 F170 W218 K219 H221 F317 L322 A323 L324	V69-W320 HydrophobicContact CB-CZ2 4.33Å; V69-W320 HydrophobicContact CG2-CH2 3.58Å; V69-W320 HydrophobicContact CG2-CZ2 3.62Å; L166-W320 HydrophobicContact CD2-CH2 4.11Å; L166-W320 HydrophobicContact CD2-CZ2 4.46Å; L169-W320 HydrophobicContact CD2-CH2 3.65Å; L169-W320 HydrophobicContact CD2-CZ3 3.91Å; F170-W320 HydrophobicContact CE2-CH2 4.32Å; F170-W320 HydrophobicContact CE2-CZ3 4.2Å; F170-W320 HydrophobicContact CZ-CZ3 4.36Å; W218-W320 HydrophobicContact CB-CZ2 3.99Å; W218-W320 AromaticContact CE3-CD2 3.54Å; W218-W320 HydrophobicContact CE3-CD2 3.54Å; W218-W320 AromaticContact CE3-CE2 3.74Å; W218-W320 AromaticContact CE3-CE3 3.42Å; W218-W320 HydrophobicContact CE3-CE3 3.42Å; W218-W320 VanDerWaalsContact CE3-CE3 3.42Å; W218-W320 HydrophobicContact CE3-CG 4.28Å; W218-W320 AromaticContact CE3-CH2 3.71Å; W218-W320 HydrophobicContact CE3-CH2 3.71Å; W218-W320 AromaticContact CE3-CZ2 3.83Å; W218-W320 HydrophobicContact CE3-CZ2 3.83Å; W218-W320 AromaticContact CE3-CZ3 3.51Å; W218-W320 HydrophobicContact CE3-CZ3 3.51Å; W218-W320 AromaticContact CZ3-CD2 3.93Å; W218-W320 HydrophobicContact CZ3-CD2 3.93Å; W218-W320 AromaticContact CZ3-CE3 3.44Å; W218-W320 HydrophobicContact CZ3-CE3 3.44Å; W218-W320 VanDerWaalsContact CZ3-CE3 3.44Å; W218-W320 HydrophobicContact CZ3-CH2 4.29Å; W218-W320 AromaticContact CZ3-CZ3 3.64Å; W218-W320 HydrophobicContact CZ3-CZ3 3.64Å; K219-W320 PolarHBondContact O-NE1 3.25Å; H221-W320 AromaticContact CE1-CD2 3.2Å; H221-W320 AromaticContact CE1-CE2 3.19Å; H221-W320 AromaticContact CE1-CE3 3.38Å; H221-W320 AromaticContact CE1-CG 3.86Å; H221-W320 AromaticContact CE1-CH2 3.63Å; H221-W320 AromaticContact CE1-CZ2 3.43Å; H221-W320 VanDerWaalsContact CE1-CZ2 3.43Å; H221-W320 WeakPolarHBondContact CE1-CZ2 3.45Å; H221-W320 AromaticContact CE1-CZ3 3.59Å; H221-W320 AromaticContact CE1-NE1 3.76Å; H221-W320 AromaticContact ND1-CE2 3.68Å; H221-W320 AromaticContact ND1-CZ2 3.81Å; H221-W320 AromaticContact ND1-NE1 3.94Å; H221-W320 AromaticContact NE2-CD1 3.88Å; H221-W320 AromaticContact NE2-CD2 3.28Å; H221-W320 VanDerWaalsContact NE2-CD2 3.28Å; H221-W320 AromaticContact NE2-CE2 3.69Å; H221-W320 AromaticContact NE2-CE3 3.57Å; H221-W320 AromaticContact NE2-CG 3.48Å; H221-W320 AromaticContact NE2-NE1 3.99Å; F317-W320 HydrophobicContact CB-CB 4.31Å; F317-W320 PolarHBondContact O-N 2.88Å; F317-W320 VanDerWaalsContact O-N 3.07Å; W320-L322 PolarHBondContact O-N 3.37Å; W320-A323 PolarHBondContact O-N 3.36Å; W320-L324 WeakPolarHBondContact O-CB 3.41Å; W320-L324 VanDerWaalsContact O-CG 3.3Å; W320-L324 WeakPolarHBondContact O-CG 3.28Å; W320-L324 PolarHBondContact O-N 3.12Å
321	R	83.7	Confident	82.7	Confident	54 Å²	54	75.8 Å²	75.8	20%	0.204	35%	0.351	C	S	.	.	H	α-helix	trans	-60.6	-43.9	178.1	-70	-170.1	-65	146.3	5.3	111.8	M311 D314 K316 F317 R325	M311-R321 PolarHBondContact O-NH1 2.92Å; D314-R321 PolarHBondContact O-NH2 3.2Å; K316-R321 PolarHBondContact O-NE 2.98Å; K316-R321 VanDerWaalsContact O-NE 3.1Å; K316-R321 PolarHBondContact O-NH2 2.83Å; F317-R321 HydrophobicContact CB-CG 4.17Å; F317-R321 WeakPolarHBondContact O-CG 3.42Å; F317-R321 PolarHBondContact O-N 3.28Å; R321-R325 WeakPolarHBondContact O-CB 3.46Å; R321-R325 PolarHBondContact O-N 2.98Å; R321-R325 VanDerWaalsContact O-N 3.12Å
322	L	82.2	Confident	83.3	Confident	82 Å²	82	73.4 Å²	73.4	43%	0.429	34%	0.341	S	S	.	.	H	α-helix	trans	-66.1	-41.4	178.6	-72.9	174.7	0	0	0	112.1	L318 W320 R325 Y326	L318-L322 HydrophobicContact CD1-CD1 3.92Å; L318-L322 HydrophobicContact CD1-CG 4.16Å; L318-L322 HydrophobicContact CG-CD1 3.95Å; L318-L322 WeakPolarHBondContact O-CB 3.48Å; L318-L322 WeakPolarHBondContact O-CG 2.88Å; L318-L322 PolarHBondContact O-N 3.24Å; W320-L322 PolarHBondContact O-N 3.37Å; L322-R325 PolarHBondContact O-N 2.63Å; L322-Y326 VanDerWaalsContact O-CD2 3.25Å; L322-Y326 WeakPolarHBondContact O-CD2 3.3Å; L322-Y326 PolarHBondContact O-N 3.01Å
323	A	81.8	Confident	84.2	Confident	1 Å²	1	68.2 Å²	68.2	1%	0.008	32%	0.322	C	S	.	.	H	α-helix	trans	-70.2	-40	-179.6	0	0	0	0	0	113.1	W218 Q319 W320 R325 Y326 L330	W218-A323 HydrophobicContact CH2-CB 3.08Å; W218-A323 HydrophobicContact CZ2-CB 3.76Å; W218-A323 HydrophobicContact CZ3-CB 3.83Å; Q319-A323 WeakPolarHBondContact O-CB 3.23Å; Q319-A323 PolarHBondContact O-N 3.39Å; W320-A323 PolarHBondContact O-N 3.36Å; A323-R325 PolarHBondContact O-N 2.58Å; A323-Y326 CarbonylContact O-C 3.56Å; A323-Y326 PolarHBondContact O-N 2.84Å; A323-Y326 VanDerWaalsContact O-O 3.05Å; A323-L330 HydrophobicContact CB-CD1 4.08Å
324	L	76.8	Confident	84.9	Confident	44 Å²	44	61.7 Å²	61.7	23%	0.23	29%	0.287	C	S	.	.	H	α-helix	trans	-66.4	-27.4	175.1	-68.1	173.2	0	0	0	112	M60 W320	M60-L324 WeakPolarHBondContact CE-O 2.91Å; W320-L324 WeakPolarHBondContact O-CB 3.41Å; W320-L324 VanDerWaalsContact O-CG 3.3Å; W320-L324 WeakPolarHBondContact O-CG 3.28Å; W320-L324 PolarHBondContact O-N 3.12Å
325	R	77	Confident	85.1	Confident	146 Å²	146	59.9 Å²	59.9	55%	0.551	28%	0.277	S	S	*	.	H	α-helix	trans	-70.7	-30.3	174.8	-170.9	174	-175.9	172	3.2	113.4	R321 L322 A323	R321-R325 WeakPolarHBondContact O-CB 3.46Å; R321-R325 PolarHBondContact O-N 2.98Å; R321-R325 VanDerWaalsContact O-N 3.12Å; L322-R325 PolarHBondContact O-N 2.63Å; A323-R325 PolarHBondContact O-N 2.58Å
326	Y	82.2	Confident	85.2	Confident	122 Å²	122	54.2 Å²	54.2	48%	0.478	26%	0.263	S	S	.	.			trans	-122.4	101.1	-173.3	-60.6	-66.6	0	0	0	111.5	L322 A323 H328 S329 L330	L322-Y326 VanDerWaalsContact O-CD2 3.25Å; L322-Y326 WeakPolarHBondContact O-CD2 3.3Å; L322-Y326 PolarHBondContact O-N 3.01Å; A323-Y326 CarbonylContact O-C 3.56Å; A323-Y326 PolarHBondContact O-N 2.84Å; A323-Y326 VanDerWaalsContact O-O 3.05Å; Y326-H328 PolarHBondContact O-N 2.92Å; Y326-H328 VanDerWaalsContact O-N 3.11Å; Y326-S329 WeakPolarHBondContact O-CA 3.33Å; Y326-S329 WeakPolarHBondContact O-CB 3.48Å; Y326-S329 PolarHBondContact O-N 2.85Å; Y326-L330 PolarHBondContact O-N 2.88Å
327	P	79.6	Confident	85.3	Confident	57 Å²	57	53.3 Å²	53.3	37%	0.37	26%	0.259	S	S	.	.	H	α-helix	trans	-52.9	-38.8	-177	-22.7	26.1	0	0	0	114.2	M60 S329 L330 T331	M60-P327 HydrophobicContact CE-CB 4.35Å; M60-P327 HydrophobicContact CE-CG 4.03Å; M60-P327 HydrophobicContact CG-CB 4.45Å; M60-P327 HydrophobicContact SD-CB 3.48Å; M60-P327 WeakPolarHBondContact SD-CB 3.38Å; M60-P327 HydrophobicContact SD-CG 3.48Å; M60-P327 WeakPolarHBondContact SD-CG 3.29Å; P327-S329 VanDerWaalsContact C-N 3.34Å; P327-S329 PolarHBondContact O-N 2.83Å; P327-L330 PolarHBondContact O-N 3.43Å; P327-T331 PolarHBondContact O-N 3.33Å; P327-T331 VanDerWaalsContact O-N 3.13Å; P327-T331 PolarHBondContact O-OG1 3.28Å
328	H	82.2	Confident	85.4	Confident	154 Å²	154	52.9 Å²	52.9	71%	0.713	26%	0.257	S	S	*	.	H	α-helix	trans	-65.4	-37.1	178.2	-65.5	-64.6	0	0	0	112.5	Y326 T331 N332	Y326-H328 PolarHBondContact O-N 2.92Å; Y326-H328 VanDerWaalsContact O-N 3.11Å; H328-T331 PolarHBondContact O-N 2.9Å; H328-N332 VanDerWaalsContact O-CG 3.26Å; H328-N332 PolarHBondContact O-N 3.11Å; H328-N332 PolarHBondContact O-ND2 3.41Å
329	S	85.4	Confident	85.6	Confident	34 Å²	34	51.6 Å²	51.6	24%	0.238	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-50.7	175.9	-171	0	0	0	0	109.8	Y326 P327 T331 N332 Y333	Y326-S329 WeakPolarHBondContact O-CA 3.33Å; Y326-S329 WeakPolarHBondContact O-CB 3.48Å; Y326-S329 PolarHBondContact O-N 2.85Å; P327-S329 VanDerWaalsContact C-N 3.34Å; P327-S329 PolarHBondContact O-N 2.83Å; S329-T331 VanDerWaalsContact C-N 3.3Å; S329-T331 PolarHBondContact O-N 2.88Å; S329-N332 WeakPolarHBondContact O-CB 3.39Å; S329-N332 PolarHBondContact O-N 2.91Å; S329-Y333 WeakPolarHBondContact O-CD2 3.48Å; S329-Y333 PolarHBondContact O-N 2.99Å; S329-Y333 VanDerWaalsContact OG-CE2 3.27Å; S329-Y333 WeakPolarHBondContact OG-CE2 3.29Å
330	L	85.9	Confident	85.5	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-57.3	-41.5	179	-165.3	73.8	0	0	0	112.6	T59 M60 F63 F170 W218 A323 Y326 P327 Y333 R334	T59-L330 HydrophobicContact CG2-CD2 3.68Å; T59-L330 HydrophobicContact CG2-CG 3.69Å; M60-L330 HydrophobicContact CB-CD2 4.34Å; M60-L330 HydrophobicContact CG-CD2 3.55Å; F63-L330 HydrophobicContact CD2-CD2 4.37Å; F63-L330 HydrophobicContact CE2-CD1 4.47Å; F63-L330 HydrophobicContact CE2-CD2 4.21Å; F63-L330 HydrophobicContact CZ-CD1 4.29Å; F170-L330 HydrophobicContact CD1-CD1 4.23Å; F170-L330 HydrophobicContact CE1-CD1 3.59Å; F170-L330 HydrophobicContact CE1-CG 4.26Å; F170-L330 HydrophobicContact CZ-CD1 4.38Å; W218-L330 HydrophobicContact CH2-CD1 4.46Å; A323-L330 HydrophobicContact CB-CD1 4.08Å; Y326-L330 PolarHBondContact O-N 2.88Å; P327-L330 PolarHBondContact O-N 3.43Å; L330-Y333 PolarHBondContact O-N 3.38Å; L330-R334 WeakPolarHBondContact O-CB 3.48Å; L330-R334 PolarHBondContact O-N 3.33Å
331	T	86	Confident	85.5	Confident	37 Å²	37	52.8 Å²	52.8	23%	0.227	26%	0.257	C	S	.	.	H	α-helix	trans	-64.9	-42.1	174.8	-61.7	0	0	0	0	112.4	P327 H328 S329 Y333 R334 L335	P327-T331 PolarHBondContact O-N 3.33Å; P327-T331 VanDerWaalsContact O-N 3.13Å; P327-T331 PolarHBondContact O-OG1 3.28Å; H328-T331 PolarHBondContact O-N 2.9Å; S329-T331 VanDerWaalsContact C-N 3.3Å; S329-T331 PolarHBondContact O-N 2.88Å; T331-Y333 PolarHBondContact O-N 2.82Å; T331-R334 WeakPolarHBondContact O-CB 3.35Å; T331-R334 PolarHBondContact O-N 3.49Å; T331-L335 WeakPolarHBondContact O-CG 3.35Å; T331-L335 PolarHBondContact O-N 3.12Å
332	N	87.9	Confident	85.7	Confident	98 Å²	98	53.8 Å²	53.8	52%	0.524	27%	0.266	S	S	.	.	H	α-helix	trans	-63.2	-42.1	177.2	-71.2	-16.3	0	0	0	112	H328 S329 L335 G336	H328-N332 VanDerWaalsContact O-CG 3.26Å; H328-N332 PolarHBondContact O-N 3.11Å; H328-N332 PolarHBondContact O-ND2 3.41Å; S329-N332 WeakPolarHBondContact O-CB 3.39Å; S329-N332 PolarHBondContact O-N 2.91Å; N332-L335 WeakPolarHBondContact O-CB 3.43Å; N332-L335 PolarHBondContact O-N 3.3Å; N332-G336 PolarHBondContact O-N 2.95Å
333	Y	89.2	Confident	86.1	Confident	94 Å²	94	51.5 Å²	51.5	37%	0.369	25%	0.252	S	S	.	.	H	α-helix	trans	-66.5	-40	175.5	-76.6	-72.4	0	0	0	112.3	W218 S329 L330 T331 L335 G336 F337	W218-Y333 AromaticContact CE2-CD1 3.97Å; W218-Y333 HydrophobicContact CH2-CD2 4.1Å; W218-Y333 HydrophobicContact CH2-CG 4.19Å; W218-Y333 AromaticContact CZ2-CD1 3.74Å; W218-Y333 HydrophobicContact CZ2-CD1 3.74Å; W218-Y333 AromaticContact CZ2-CD2 3.4Å; W218-Y333 HydrophobicContact CZ2-CD2 3.4Å; W218-Y333 HydrophobicContact CZ2-CE1 4.01Å; W218-Y333 AromaticContact CZ2-CE2 3.69Å; W218-Y333 HydrophobicContact CZ2-CE2 3.69Å; W218-Y333 AromaticContact CZ2-CG 3.42Å; W218-Y333 HydrophobicContact CZ2-CG 3.42Å; W218-Y333 VanDerWaalsContact CZ2-CG 3.42Å; W218-Y333 AromaticContact CZ2-CZ 3.99Å; W218-Y333 AromaticContact NE1-CD1 3.76Å; W218-Y333 AromaticContact NE1-CE1 3.55Å; W218-Y333 AromaticContact NE1-CZ 4Å; S329-Y333 WeakPolarHBondContact O-CD2 3.48Å; S329-Y333 PolarHBondContact O-N 2.99Å; S329-Y333 VanDerWaalsContact OG-CE2 3.27Å; S329-Y333 WeakPolarHBondContact OG-CE2 3.29Å; L330-Y333 PolarHBondContact O-N 3.38Å; T331-Y333 PolarHBondContact O-N 2.82Å; Y333-L335 VanDerWaalsContact C-N 3.34Å; Y333-L335 PolarHBondContact O-N 3.16Å; Y333-G336 PolarHBondContact O-N 2.82Å; Y333-G336 VanDerWaalsContact O-N 3.17Å; Y333-F337 HydrophobicContact CD1-CE2 4.24Å; Y333-F337 HydrophobicContact CD1-CZ 4.23Å; Y333-F337 HydrophobicContact CG-CE2 4.49Å; Y333-F337 WeakPolarHBondContact O-CD2 3.44Å; Y333-F337 WeakPolarHBondContact O-CG 3.37Å; Y333-F337 PolarHBondContact O-N 3.15Å
334	R	89.4	Confident	86.6	Confident	3 Å²	3	51.4 Å²	51.4	1%	0.011	25%	0.252	C	S	.	.	H	α-helix	trans	-57	-46.5	172.2	178.1	178.9	169.3	-143.6	-4.5	112.1	Y42 D55 T59 R62 F170 N171 L330 T331 G336 S338	Y42-R334 PolarHBondContact OH-NH2 3.33Å; Y42-R334 VanDerWaalsContact OH-NH2 3.08Å; D55-R334 IonicContact OD2-CZ 3.81Å; D55-R334 IonicContact OD2-NH1 2.91Å; D55-R334 PolarHBondContact OD2-NH1 3.22Å; D55-R334 IonicContact OD2-NH2 3.93Å; D55-R334 PolarHBondContact OD2-NH2 3.14Å; T59-R334 HydrophobicContact CG2-CB 4.13Å; T59-R334 HydrophobicContact CG2-CG 4.43Å; T59-R334 VanDerWaalsContact OG1-CD 3.23Å; T59-R334 WeakPolarHBondContact OG1-CD 3.27Å; R62-R334 VanDerWaalsContact NH1-NE 3.2Å; F170-R334 HydrophobicContact CB-CB 4.16Å; F170-R334 HydrophobicContact CB-CG 4.04Å; F170-R334 HydrophobicContact CD1-CB 3.92Å; F170-R334 HydrophobicContact CG-CB 4.47Å; N171-R334 PolarHBondContact OD1-NE 3.16Å; N171-R334 PolarHBondContact OD1-NH2 3.14Å; N171-R334 VanDerWaalsContact OD1-NH2 3.09Å; L330-R334 WeakPolarHBondContact O-CB 3.48Å; L330-R334 PolarHBondContact O-N 3.33Å; T331-R334 WeakPolarHBondContact O-CB 3.35Å; T331-R334 PolarHBondContact O-N 3.49Å; R334-G336 VanDerWaalsContact C-N 3.32Å; R334-G336 PolarHBondContact O-N 2.91Å; R334-S338 WeakPolarHBondContact O-CB 3.47Å; R334-S338 PolarHBondContact O-N 3.3Å; R334-S338 PolarHBondContact O-OG 3.26Å
335	L	88.8	Confident	87.2	Confident	21 Å²	21	50.3 Å²	50.3	11%	0.11	25%	0.247	C	C	.	.	H	α-helix	trans	-58.4	-46.3	175.6	-72	173	0	0	0	110.6	T47 Y49 T331 N332 Y333 S338 N339	T47-L335 HydrophobicContact CG2-CD2 3.69Å; Y49-L335 HydrophobicContact CD2-CD1 3.9Å; T331-L335 WeakPolarHBondContact O-CG 3.35Å; T331-L335 PolarHBondContact O-N 3.12Å; N332-L335 WeakPolarHBondContact O-CB 3.43Å; N332-L335 PolarHBondContact O-N 3.3Å; Y333-L335 VanDerWaalsContact C-N 3.34Å; Y333-L335 PolarHBondContact O-N 3.16Å; L335-S338 PolarHBondContact O-N 2.59Å; L335-N339 PolarHBondContact O-N 2.79Å
336	G	90.2	Very high	87.9	Confident	26 Å²	26	50.9 Å²	50.9	27%	0.268	25%	0.249	S	C	.	.	H	α-helix	trans	-61.2	-48.9	178.2	0	0	0	0	0	113.6	N332 Y333 R334 S338 N339 K343	N332-G336 PolarHBondContact O-N 2.95Å; Y333-G336 PolarHBondContact O-N 2.82Å; Y333-G336 VanDerWaalsContact O-N 3.17Å; R334-G336 VanDerWaalsContact C-N 3.32Å; R334-G336 PolarHBondContact O-N 2.91Å; G336-S338 VanDerWaalsContact C-N 3.33Å; G336-S338 PolarHBondContact O-N 2.87Å; G336-N339 CarbonylContact O-C 3.6Å; G336-N339 PolarHBondContact O-N 3.43Å; G336-K343 WeakPolarHBondContact O-CB 3.33Å
337	F	91.5	Very high	88.4	Confident	1 Å²	1	45.5 Å²	45.5	0%	0.004	23%	0.229	C	C	.	.	H	α-helix	trans	-71	-28.3	179.9	-62.9	-47.5	0	0	0	113.2	L163 L166 F170 W218 Y333 N339	L163-F337 HydrophobicContact CD2-CD1 4.02Å; L163-F337 HydrophobicContact CD2-CE1 4.41Å; L166-F337 HydrophobicContact CB-CB 4.39Å; L166-F337 HydrophobicContact CB-CD1 4.2Å; L166-F337 HydrophobicContact CB-CD2 4.2Å; L166-F337 HydrophobicContact CB-CG 4.03Å; L166-F337 HydrophobicContact CD1-CD1 3.95Å; L166-F337 HydrophobicContact CD1-CE1 3.56Å; L166-F337 HydrophobicContact CD1-CE2 4.21Å; L166-F337 HydrophobicContact CD1-CG 4.45Å; L166-F337 HydrophobicContact CD1-CZ 3.72Å; F170-F337 AromaticContact CD2-CD2 3.92Å; F170-F337 HydrophobicContact CD2-CD2 3.92Å; F170-F337 HydrophobicContact CD2-CE2 4.35Å; F170-F337 HydrophobicContact CE1-CD2 4.31Å; F170-F337 HydrophobicContact CE1-CE2 4.3Å; F170-F337 AromaticContact CE2-CD2 3.71Å; F170-F337 HydrophobicContact CE2-CD2 3.71Å; F170-F337 AromaticContact CE2-CE2 3.66Å; F170-F337 HydrophobicContact CE2-CE2 3.66Å; F170-F337 HydrophobicContact CG-CD2 4.28Å; F170-F337 AromaticContact CZ-CD2 3.89Å; F170-F337 HydrophobicContact CZ-CD2 3.89Å; F170-F337 AromaticContact CZ-CE2 3.61Å; F170-F337 HydrophobicContact CZ-CE2 3.61Å; W218-F337 HydrophobicContact CD2-CZ 4.48Å; W218-F337 HydrophobicContact CG-CZ 4.28Å; Y333-F337 HydrophobicContact CD1-CE2 4.24Å; Y333-F337 HydrophobicContact CD1-CZ 4.23Å; Y333-F337 HydrophobicContact CG-CE2 4.49Å; Y333-F337 WeakPolarHBondContact O-CD2 3.44Å; Y333-F337 WeakPolarHBondContact O-CG 3.37Å; Y333-F337 PolarHBondContact O-N 3.15Å; F337-N339 VanDerWaalsContact C-N 3.3Å
338	S	90.9	Very high	89	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-71.6	-27.1	175	-60.7	0	0	0	0	112.1	G46 N171 R334 L335 G336 A340 N406	G46-S338 VanDerWaalsContact CA-O 3.29Å; G46-S338 WeakPolarHBondContact CA-O 3.21Å; N171-S338 PolarHBondContact ND2-OG 2.96Å; R334-S338 WeakPolarHBondContact O-CB 3.47Å; R334-S338 PolarHBondContact O-N 3.3Å; R334-S338 PolarHBondContact O-OG 3.26Å; L335-S338 PolarHBondContact O-N 2.59Å; G336-S338 VanDerWaalsContact C-N 3.33Å; G336-S338 PolarHBondContact O-N 2.87Å; S338-A340 PolarHBondContact O-N 2.86Å; S338-N406 PolarHBondContact O-ND2 3.3Å; S338-N406 PolarHBondContact O-OD1 3.4Å
339	N	90.5	Very high	89.3	Confident	38 Å²	38	39.3 Å²	39.3	20%	0.203	20%	0.198	C	C	.	.			trans	-97.3	69.9	174.6	-67.6	-21.8	0	0	0	110.5	G46 T47 L335 G336 F337 H341 D342 K343	G46-N339 WeakPolarHBondContact CA-OD1 3.33Å; T47-N339 PolarHBondContact N-OD1 2.93Å; T47-N339 VanDerWaalsContact O-CG 3.31Å; T47-N339 PolarHBondContact O-ND2 3.25Å; T47-N339 PolarHBondContact O-OD1 3.49Å; T47-N339 VanDerWaalsContact O-OD1 3.05Å; L335-N339 PolarHBondContact O-N 2.79Å; G336-N339 CarbonylContact O-C 3.6Å; G336-N339 PolarHBondContact O-N 3.43Å; F337-N339 VanDerWaalsContact C-N 3.3Å; N339-H341 VanDerWaalsContact C-N 3.28Å; N339-H341 PolarHBondContact O-N 2.93Å; N339-D342 PolarHBondContact O-N 3.44Å; N339-K343 WeakPolarHBondContact O-CB 3.36Å; N339-K343 PolarHBondContact O-N 3.41Å
340	A	86.8	Confident	89.4	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.7	-39.7	-174	0	0	0	0	0	113.1	W160 S338 K343 F344 N406 F407	W160-A340 HydrophobicContact CH2-CB 3.88Å; W160-A340 HydrophobicContact CZ2-CB 4.4Å; W160-A340 HydrophobicContact CZ3-CB 4.12Å; S338-A340 PolarHBondContact O-N 2.86Å; A340-K343 PolarHBondContact O-N 3.31Å; A340-F344 WeakPolarHBondContact O-CB 3.39Å; A340-F344 PolarHBondContact O-N 2.77Å; A340-N406 WeakPolarHBondContact CA-OD1 3.29Å; A340-N406 WeakPolarHBondContact CB-OD1 3.09Å; A340-N406 PolarHBondContact N-OD1 3.4Å; A340-F407 HydrophobicContact CB-CD1 3.93Å; A340-F407 HydrophobicContact CB-CD2 3.94Å; A340-F407 HydrophobicContact CB-CE1 3.42Å; A340-F407 VanDerWaalsContact CB-CE1 3.42Å; A340-F407 HydrophobicContact CB-CE2 3.44Å; A340-F407 VanDerWaalsContact CB-CE2 3.44Å; A340-F407 HydrophobicContact CB-CG 4.18Å; A340-F407 HydrophobicContact CB-CZ 3.15Å
341	H	87	Confident	89.6	Confident	96 Å²	96	41.1 Å²	41.1	44%	0.444	21%	0.214	S	C	.	.	H	α-helix	trans	-58.7	-57.4	179.8	-174.3	89.5	0	0	0	111.5	N339 K343 F344 T345	N339-H341 VanDerWaalsContact C-N 3.28Å; N339-H341 PolarHBondContact O-N 2.93Å; H341-K343 PolarHBondContact O-N 3.04Å; H341-F344 PolarHBondContact O-N 2.75Å; H341-T345 WeakPolarHBondContact O-CB 3.3Å; H341-T345 WeakPolarHBondContact O-CG2 3.24Å; H341-T345 PolarHBondContact O-N 3.25Å; H341-T345 PolarHBondContact O-OG1 2.95Å
342	D	88.2	Confident	89.5	Confident	74 Å²	74	47.1 Å²	47.1	40%	0.396	24%	0.239	S	C	.	.	H	α-helix	trans	-62.6	-41.3	178.5	173.1	47	0	0	0	111.7	N339 F344 T345 R346	N339-D342 PolarHBondContact O-N 3.44Å; D342-F344 VanDerWaalsContact C-N 3.31Å; D342-F344 PolarHBondContact O-N 2.86Å; D342-T345 WeakPolarHBondContact CA-OG1 3.44Å; D342-T345 PolarHBondContact O-OG1 2.98Å; D342-R346 WeakPolarHBondContact O-CB 3.01Å; D342-R346 PolarHBondContact O-N 3.2Å; D342-R346 IonicContact OD1-CZ 2.62Å; D342-R346 IonicContact OD1-NE 2.77Å; D342-R346 IonicContact OD1-NH2 2.68Å; D342-R346 PolarHBondContact OD1-NH2 3.09Å; D342-R346 IonicContact OD2-CZ 3.18Å; D342-R346 IonicContact OD2-NH2 2.98Å; D342-R346 PolarHBondContact OD2-NH2 3.02Å
343	K	90.4	Very high	89.4	Confident	34 Å²	34	44.2 Å²	44.2	15%	0.148	22%	0.224	C	C	.	.	H	α-helix	trans	-64.9	-35.5	178.6	-174.8	60.8	177.7	172.2	0	112.4	L163 N216 G336 N339 A340 H341 V347	L163-K343 HydrophobicContact CD2-CG 3.97Å; N216-K343 PolarHBondContact O-NZ 3.09Å; G336-K343 WeakPolarHBondContact O-CB 3.33Å; N339-K343 WeakPolarHBondContact O-CB 3.36Å; N339-K343 PolarHBondContact O-N 3.41Å; A340-K343 PolarHBondContact O-N 3.31Å; H341-K343 PolarHBondContact O-N 3.04Å; K343-V347 WeakPolarHBondContact O-CG2 3.25Å
344	F	92.1	Very high	89.2	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-78.2	-50.4	178.2	-174.2	-88.2	0	0	0	111.7	L156 Y159 W160 L163 A340 H341 D342 R346 V347 F348 L411 P412 Y415	L156-F344 HydrophobicContact CB-CZ 4.35Å; L156-F344 HydrophobicContact CD2-CE2 4.46Å; L156-F344 HydrophobicContact CD2-CZ 3.69Å; Y159-F344 AromaticContact CD1-CD2 3.72Å; Y159-F344 HydrophobicContact CD1-CD2 3.72Å; Y159-F344 AromaticContact CD1-CE2 3.89Å; Y159-F344 HydrophobicContact CD1-CE2 3.89Å; Y159-F344 HydrophobicContact CE1-CD2 4.02Å; W160-F344 HydrophobicContact CE3-CB 3.98Å; W160-F344 HydrophobicContact CE3-CD1 4.48Å; W160-F344 AromaticContact CE3-CD2 3.55Å; W160-F344 HydrophobicContact CE3-CD2 3.55Å; W160-F344 HydrophobicContact CE3-CE2 4.09Å; W160-F344 AromaticContact CE3-CG 3.76Å; W160-F344 HydrophobicContact CE3-CG 3.76Å; W160-F344 HydrophobicContact CZ3-CB 3.63Å; W160-F344 HydrophobicContact CZ3-CD1 4.39Å; W160-F344 HydrophobicContact CZ3-CD2 4.08Å; W160-F344 AromaticContact CZ3-CG 3.79Å; W160-F344 HydrophobicContact CZ3-CG 3.79Å; L163-F344 HydrophobicContact CD1-CB 4.14Å; L163-F344 HydrophobicContact CD1-CD2 4.19Å; A340-F344 WeakPolarHBondContact O-CB 3.39Å; A340-F344 PolarHBondContact O-N 2.77Å; H341-F344 PolarHBondContact O-N 2.75Å; D342-F344 VanDerWaalsContact C-N 3.31Å; D342-F344 PolarHBondContact O-N 2.86Å; F344-R346 VanDerWaalsContact C-N 3.33Å; F344-R346 PolarHBondContact O-N 3.1Å; F344-V347 PolarHBondContact O-N 3.48Å; F344-V347 VanDerWaalsContact O-N 3.09Å; F344-F348 AromaticContact CD1-CD2 3.95Å; F344-F348 HydrophobicContact CD1-CD2 3.95Å; F344-F348 AromaticContact CD2-CD2 3.72Å; F344-F348 HydrophobicContact CD2-CD2 3.72Å; F344-F348 AromaticContact CD2-CE2 3.74Å; F344-F348 HydrophobicContact CD2-CE2 3.74Å; F344-F348 HydrophobicContact CE1-CB 4.22Å; F344-F348 AromaticContact CE1-CD2 3.71Å; F344-F348 HydrophobicContact CE1-CD2 3.71Å; F344-F348 HydrophobicContact CE1-CE2 4.38Å; F344-F348 HydrophobicContact CE1-CG 4.13Å; F344-F348 AromaticContact CE2-CD2 3.49Å; F344-F348 HydrophobicContact CE2-CD2 3.49Å; F344-F348 VanDerWaalsContact CE2-CD2 3.49Å; F344-F348 AromaticContact CE2-CE2 3.34Å; F344-F348 HydrophobicContact CE2-CE2 3.34Å; F344-F348 HydrophobicContact CE2-CG 4.49Å; F344-F348 HydrophobicContact CE2-CZ 4.23Å; F344-F348 AromaticContact CG-CD2 3.97Å; F344-F348 HydrophobicContact CG-CD2 3.97Å; F344-F348 HydrophobicContact CG-CE2 4.44Å; F344-F348 AromaticContact CZ-CD2 3.48Å; F344-F348 HydrophobicContact CZ-CD2 3.48Å; F344-F348 VanDerWaalsContact CZ-CD2 3.48Å; F344-F348 AromaticContact CZ-CE2 3.7Å; F344-F348 HydrophobicContact CZ-CE2 3.7Å; F344-F348 HydrophobicContact CZ-CG 4.08Å; F344-F348 HydrophobicContact CZ-CZ 4.44Å; F344-F348 PolarHBondContact O-N 3.43Å; F344-L411 HydrophobicContact CD1-CD2 4.18Å; F344-L411 HydrophobicContact CD2-CD2 4.25Å; F344-L411 HydrophobicContact CE1-CD2 3.66Å; F344-L411 HydrophobicContact CE2-CD2 3.7Å; F344-L411 HydrophobicContact CG-CD2 4.45Å; F344-L411 HydrophobicContact CZ-CD2 3.37Å; F344-P412 HydrophobicContact CD1-CG 4.16Å; F344-Y415 HydrophobicContact CD1-CD2 4.33Å; F344-Y415 HydrophobicContact CD1-CE2 4.17Å; F344-Y415 HydrophobicContact CE1-CD1 4.3Å; F344-Y415 AromaticContact CE1-CD2 3.77Å; F344-Y415 HydrophobicContact CE1-CD2 3.77Å; F344-Y415 HydrophobicContact CE1-CE1 4.44Å; F344-Y415 AromaticContact CE1-CE2 3.94Å; F344-Y415 HydrophobicContact CE1-CE2 3.94Å; F344-Y415 AromaticContact CE1-CG 3.95Å; F344-Y415 HydrophobicContact CE1-CG 3.95Å
345	T	91	Very high	88.7	Confident	20 Å²	20	50.4 Å²	50.4	12%	0.123	26%	0.262	C	S	.	.	H	α-helix	trans	-61.6	-41.4	-178.8	54.9	0	0	0	0	111.3	H341 D342 V347 F348 D349 P412 Y415	H341-T345 WeakPolarHBondContact O-CB 3.3Å; H341-T345 WeakPolarHBondContact O-CG2 3.24Å; H341-T345 PolarHBondContact O-N 3.25Å; H341-T345 PolarHBondContact O-OG1 2.95Å; D342-T345 WeakPolarHBondContact CA-OG1 3.44Å; D342-T345 PolarHBondContact O-OG1 2.98Å; T345-V347 PolarHBondContact O-N 3.17Å; T345-V347 VanDerWaalsContact O-N 3.12Å; T345-F348 PolarHBondContact O-N 3.2Å; T345-D349 WeakPolarHBondContact O-CB 3.32Å; T345-D349 PolarHBondContact O-N 2.83Å; T345-P412 HydrophobicContact CG2-CB 4.24Å; T345-P412 HydrophobicContact CG2-CG 3.8Å; T345-Y415 HydrophobicContact CG2-CE2 4.29Å
346	R	90.5	Very high	88.2	Confident	158 Å²	158	56.2 Å²	56.2	60%	0.596	29%	0.289	S	S	*	.	H	α-helix	trans	-56.4	-32.1	176.3	-174.4	178.9	-57.2	173.1	7.8	113.5	D342 F344	D342-R346 WeakPolarHBondContact O-CB 3.01Å; D342-R346 PolarHBondContact O-N 3.2Å; D342-R346 IonicContact OD1-CZ 2.62Å; D342-R346 IonicContact OD1-NE 2.77Å; D342-R346 IonicContact OD1-NH2 2.68Å; D342-R346 PolarHBondContact OD1-NH2 3.09Å; D342-R346 IonicContact OD2-CZ 3.18Å; D342-R346 IonicContact OD2-NH2 2.98Å; D342-R346 PolarHBondContact OD2-NH2 3.02Å; F344-R346 VanDerWaalsContact C-N 3.33Å; F344-R346 PolarHBondContact O-N 3.1Å
347	V	92.2	Very high	87.8	Confident	10 Å²	10	55.1 Å²	55.1	6%	0.061	28%	0.277	C	S	.	.	H	α-helix	trans	-85.5	-47.3	-178.2	172.5	0	0	0	0	110.9	T213 N216 K343 F344 T345	T213-V347 HydrophobicContact CG2-CG1 3.44Å; T213-V347 VanDerWaalsContact CG2-CG1 3.44Å; N216-V347 HydrophobicContact CB-CG2 3.69Å; N216-V347 VanDerWaalsContact CG-CG2 3.46Å; K343-V347 WeakPolarHBondContact O-CG2 3.25Å; F344-V347 PolarHBondContact O-N 3.48Å; F344-V347 VanDerWaalsContact O-N 3.09Å; T345-V347 PolarHBondContact O-N 3.17Å; T345-V347 VanDerWaalsContact O-N 3.12Å
348	F	92.1	Very high	87.3	Confident	1 Å²	1	60.4 Å²	60.4	0%	0.004	31%	0.305	C	S	.	.	H	α-helix	trans	-90	-12.3	-173.6	-73.6	-81.2	0	0	0	114.9	Y155 L156 Y159 T213 F344 T345 V351 Y415	Y155-F348 HydrophobicContact CD1-CE1 4.14Å; Y155-F348 HydrophobicContact CD1-CZ 4.34Å; Y155-F348 AromaticContact CE1-CE1 3.64Å; Y155-F348 HydrophobicContact CE1-CE1 3.64Å; Y155-F348 AromaticContact CE1-CZ 3.72Å; Y155-F348 HydrophobicContact CE1-CZ 3.72Å; L156-F348 HydrophobicContact CD2-CD1 3.44Å; L156-F348 VanDerWaalsContact CD2-CD1 3.44Å; L156-F348 HydrophobicContact CD2-CD2 4.31Å; L156-F348 HydrophobicContact CD2-CE1 3.27Å; L156-F348 HydrophobicContact CD2-CE2 4.19Å; L156-F348 HydrophobicContact CD2-CG 3.97Å; L156-F348 HydrophobicContact CD2-CZ 3.69Å; Y159-F348 AromaticContact CD1-CE2 3.61Å; Y159-F348 HydrophobicContact CD1-CE2 3.61Å; Y159-F348 HydrophobicContact CD1-CZ 4.26Å; Y159-F348 HydrophobicContact CD2-CE2 4.04Å; Y159-F348 AromaticContact CD2-CZ 4Å; Y159-F348 HydrophobicContact CD2-CZ 4Å; Y159-F348 AromaticContact CE1-CE2 3.79Å; Y159-F348 HydrophobicContact CE1-CE2 3.79Å; Y159-F348 HydrophobicContact CE2-CE2 4.25Å; Y159-F348 HydrophobicContact CE2-CZ 4.45Å; Y159-F348 AromaticContact CG-CE2 3.73Å; Y159-F348 HydrophobicContact CG-CE2 3.73Å; Y159-F348 AromaticContact CG-CZ 3.91Å; Y159-F348 HydrophobicContact CG-CZ 3.91Å; T213-F348 HydrophobicContact CG2-CD1 4.17Å; T213-F348 HydrophobicContact CG2-CE1 3.93Å; T213-F348 HydrophobicContact CG2-CZ 4.25Å; F344-F348 AromaticContact CD1-CD2 3.95Å; F344-F348 HydrophobicContact CD1-CD2 3.95Å; F344-F348 AromaticContact CD2-CD2 3.72Å; F344-F348 HydrophobicContact CD2-CD2 3.72Å; F344-F348 AromaticContact CD2-CE2 3.74Å; F344-F348 HydrophobicContact CD2-CE2 3.74Å; F344-F348 HydrophobicContact CE1-CB 4.22Å; F344-F348 AromaticContact CE1-CD2 3.71Å; F344-F348 HydrophobicContact CE1-CD2 3.71Å; F344-F348 HydrophobicContact CE1-CE2 4.38Å; F344-F348 HydrophobicContact CE1-CG 4.13Å; F344-F348 AromaticContact CE2-CD2 3.49Å; F344-F348 HydrophobicContact CE2-CD2 3.49Å; F344-F348 VanDerWaalsContact CE2-CD2 3.49Å; F344-F348 AromaticContact CE2-CE2 3.34Å; F344-F348 HydrophobicContact CE2-CE2 3.34Å; F344-F348 HydrophobicContact CE2-CG 4.49Å; F344-F348 HydrophobicContact CE2-CZ 4.23Å; F344-F348 AromaticContact CG-CD2 3.97Å; F344-F348 HydrophobicContact CG-CD2 3.97Å; F344-F348 HydrophobicContact CG-CE2 4.44Å; F344-F348 AromaticContact CZ-CD2 3.48Å; F344-F348 HydrophobicContact CZ-CD2 3.48Å; F344-F348 VanDerWaalsContact CZ-CD2 3.48Å; F344-F348 AromaticContact CZ-CE2 3.7Å; F344-F348 HydrophobicContact CZ-CE2 3.7Å; F344-F348 HydrophobicContact CZ-CG 4.08Å; F344-F348 HydrophobicContact CZ-CZ 4.44Å; F344-F348 PolarHBondContact O-N 3.43Å; T345-F348 PolarHBondContact O-N 3.2Å; F348-V351 HydrophobicContact CD1-CG2 4.19Å; F348-V351 PolarHBondContact O-N 2.82Å; F348-Y415 HydrophobicContact CB-CD1 4.29Å; F348-Y415 HydrophobicContact CB-CE1 3.41Å; F348-Y415 VanDerWaalsContact CB-CE1 3.41Å; F348-Y415 WeakPolarHBondContact CB-OH 3.42Å; F348-Y415 HydrophobicContact CG-CE1 4.45Å; F348-Y415 PolarHBondContact O-OH 3.34Å
349	D	89.2	Confident	86.6	Confident	79 Å²	79	61 Å²	61	42%	0.422	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-23.5	169.7	-73.4	-22.5	0	0	0	110.8	T345 V351 Y415	T345-D349 WeakPolarHBondContact O-CB 3.32Å; T345-D349 PolarHBondContact O-N 2.83Å; D349-V351 VanDerWaalsContact C-N 3.29Å; D349-Y415 PolarHBondContact N-OH 3.06Å; D349-Y415 PolarHBondContact OD1-OH 2.91Å
350	A	88.3	Confident	86	Confident	63 Å²	63	59.3 Å²	59.3	52%	0.521	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-8.3	173.5	0	0	0	0	0	113.6	E352	A350-E352 PolarHBondContact O-N 2.8Å
351	V	88.8	Confident	85.1	Confident	10 Å²	10	61.8 Å²	61.8	6%	0.061	31%	0.314	C	S	.	.			trans	-87.8	107.4	176.8	178.7	0	0	0	0	108.6	W205 T213 F348 D349	W205-V351 HydrophobicContact CH2-CG1 4.36Å; W205-V351 HydrophobicContact CZ2-CG1 3.66Å; T213-V351 HydrophobicContact CG2-CG2 3.6Å; F348-V351 HydrophobicContact CD1-CG2 4.19Å; F348-V351 PolarHBondContact O-N 2.82Å; D349-V351 VanDerWaalsContact C-N 3.29Å
352	E	85.5	Confident	84.4	Confident	163 Å²	163	58.5 Å²	58.5	76%	0.762	30%	0.298	S	S	*	.	P	Polyproline II helix	trans	-94.8	130.9	175.8	-64.9	-176.2	173.8	0	0	110.4	W205 A350 P354	W205-E352 PolarHBondContact NE1-O 2.9Å; A350-E352 PolarHBondContact O-N 2.8Å; E352-P354 WeakPolarHBondContact O-CD 3.45Å
353	I	84.5	Confident	83.9	Confident	38 Å²	38	58.5 Å²	58.5	20%	0.195	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-93	117.2	174.3	-58.8	171.9	0	0	0	107.2	W205 M355 M357 L360 T361	W205-I353 HydrophobicContact CH2-CG1 4.42Å; W205-I353 HydrophobicContact CZ2-CG1 3.72Å; I353-M355 PolarHBondContact O-N 3.08Å; I353-M357 HydrophobicContact CG2-CE 3.8Å; I353-L360 HydrophobicContact CD1-CB 4.48Å; I353-L360 HydrophobicContact CG2-CB 4.25Å; I353-T361 HydrophobicContact CG2-CG2 4.5Å
354	P	85	Confident	83.4	Confident	46 Å²	46	64.7 Å²	64.7	30%	0.299	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-61.8	130.2	178.5	-22.2	32.6	0	0	0	111.2	W205 E352 E356 M357	W205-P354 VanDerWaalsContact CD1-CD 3.41Å; E352-P354 WeakPolarHBondContact O-CD 3.45Å; P354-E356 PolarHBondContact O-N 3.22Å; P354-E356 VanDerWaalsContact O-N 3.1Å; P354-M357 WeakPolarHBondContact O-CB 3.37Å; P354-M357 PolarHBondContact O-N 3.44Å; P354-M357 VanDerWaalsContact O-N 3.08Å
355	M	79.4	Confident	83.2	Confident	181 Å²	181	71 Å²	71	89%	0.892	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-24.6	-177.9	-66.6	-174.1	-66.6	0	0	114.2	I353 M357	I353-M355 PolarHBondContact O-N 3.08Å; M355-M357 VanDerWaalsContact C-N 3.32Å
356	E	78.3	Confident	83	Confident	143 Å²	143	70 Å²	70	67%	0.668	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-8.7	-179.1	-57.4	173.1	170.8	0	0	113.6	R201 P354 N358	R201-E356 IonicContact CZ-OE2 2.95Å; R201-E356 VanDerWaalsContact CZ-OE2 3.28Å; R201-E356 IonicContact NH1-OE2 3.14Å; R201-E356 PolarHBondContact NH1-OE2 3.19Å; R201-E356 IonicContact NH2-OE2 3.61Å; R201-E356 PolarHBondContact NH2-OE2 3.18Å; P354-E356 PolarHBondContact O-N 3.22Å; P354-E356 VanDerWaalsContact O-N 3.1Å; E356-N358 PolarHBondContact O-N 2.85Å
357	M	82.7	Confident	82.8	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.01	34%	0.336	C	S	.	.			trans	-85.9	110.2	-177.8	-171.3	173.5	71.1	0	0	109.1	L148 W205 I353 P354 M355 E359 L360 T361	L148-M357 HydrophobicContact CD2-CE 3.92Å; L148-M357 HydrophobicContact CD2-SD 4.21Å; W205-M357 HydrophobicContact CB-SD 3.96Å; W205-M357 HydrophobicContact CD2-CE 3.87Å; W205-M357 HydrophobicContact CD2-SD 4.4Å; W205-M357 HydrophobicContact CE3-CE 4.11Å; W205-M357 HydrophobicContact CG-CE 4.07Å; W205-M357 HydrophobicContact CG-SD 4.08Å; I353-M357 HydrophobicContact CG2-CE 3.8Å; P354-M357 WeakPolarHBondContact O-CB 3.37Å; P354-M357 PolarHBondContact O-N 3.44Å; P354-M357 VanDerWaalsContact O-N 3.08Å; M355-M357 VanDerWaalsContact C-N 3.32Å; M357-E359 WeakPolarHBondContact CE-O 3.39Å; M357-E359 HydrophobicContact CG-CB 4.29Å; M357-E359 WeakPolarHBondContact CG-O 3.31Å; M357-E359 PolarHBondContact O-N 3.02Å; M357-L360 HydrophobicContact CE-CB 4.18Å; M357-L360 HydrophobicContact CE-CD1 3.79Å; M357-L360 HydrophobicContact CE-CG 4.36Å; M357-T361 WeakPolarHBondContact O-CG2 3.39Å; M357-T361 PolarHBondContact O-OG1 3.09Å; M357-T361 VanDerWaalsContact O-OG1 3.06Å
358	N	79.3	Confident	82.6	Confident	113 Å²	113	70.4 Å²	70.4	60%	0.604	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-28.6	179	-67.8	-10	0	0	0	112.1	G145 E356 T361	G145-N358 WeakPolarHBondContact CA-O 3.42Å; E356-N358 PolarHBondContact O-N 2.85Å; N358-T361 PolarHBondContact O-OG1 3.32Å
359	E	77.7	Confident	82.6	Confident	11 Å²	11	73.6 Å²	73.6	5%	0.051	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	130.7	174	-57.1	114.2	143.1	0	0	110.2	G145 L148 S199 M357 T361	G145-E359 WeakPolarHBondContact O-CA 3.35Å; L148-E359 HydrophobicContact CB-CB 3.82Å; L148-E359 HydrophobicContact CD2-CB 4.14Å; S199-E359 WeakPolarHBondContact CB-OE1 3.5Å; S199-E359 PolarHBondContact N-OE1 2.76Å; S199-E359 VanDerWaalsContact N-OE1 3.09Å; S199-E359 PolarHBondContact OG-OE1 2.95Å; S199-E359 PolarHBondContact OG-OE2 2.86Å; M357-E359 WeakPolarHBondContact CE-O 3.39Å; M357-E359 HydrophobicContact CG-CB 4.29Å; M357-E359 WeakPolarHBondContact CG-O 3.31Å; M357-E359 PolarHBondContact O-N 3.02Å; E359-T361 VanDerWaalsContact C-N 3.34Å; E359-T361 PolarHBondContact O-N 3.08Å
360	L	77.5	Confident	82.6	Confident	3 Å²	3	70 Å²	70	2%	0.016	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	-27.6	-171	-65.5	166.7	0	0	0	117.6	G145 L148 Y152 W205 I353 M357 Y362	G145-L360 PolarHBondContact O-N 3.23Å; L148-L360 HydrophobicContact CB-CG 4.04Å; L148-L360 HydrophobicContact CD2-CD1 3.41Å; L148-L360 VanDerWaalsContact CD2-CD1 3.41Å; L148-L360 HydrophobicContact CD2-CG 3.73Å; L148-L360 HydrophobicContact CG-CD1 3.62Å; L148-L360 HydrophobicContact CG-CD2 4.26Å; L148-L360 HydrophobicContact CG-CG 3.67Å; Y152-L360 HydrophobicContact CD1-CD2 3.91Å; Y152-L360 HydrophobicContact CG-CD1 4.43Å; Y152-L360 HydrophobicContact CG-CD2 4.05Å; W205-L360 HydrophobicContact CE3-CD1 3.83Å; W205-L360 HydrophobicContact CH2-CD1 3.26Å; W205-L360 HydrophobicContact CZ2-CD1 4.03Å; W205-L360 HydrophobicContact CZ3-CD1 3.16Å; I353-L360 HydrophobicContact CD1-CB 4.48Å; I353-L360 HydrophobicContact CG2-CB 4.25Å; M357-L360 HydrophobicContact CE-CB 4.18Å; M357-L360 HydrophobicContact CE-CD1 3.79Å; M357-L360 HydrophobicContact CE-CG 4.36Å; L360-Y362 PolarHBondContact O-N 3.31Å
361	T	67.8	Low	82.6	Confident	53 Å²	53	68 Å²	68	33%	0.325	34%	0.339	S	S	.	.			trans	-69.6	112.1	-179.1	52.1	0	0	0	0	111	I353 M357 N358 E359	I353-T361 HydrophobicContact CG2-CG2 4.5Å; M357-T361 WeakPolarHBondContact O-CG2 3.39Å; M357-T361 PolarHBondContact O-OG1 3.09Å; M357-T361 VanDerWaalsContact O-OG1 3.06Å; N358-T361 PolarHBondContact O-OG1 3.32Å; E359-T361 VanDerWaalsContact C-N 3.34Å; E359-T361 PolarHBondContact O-N 3.08Å
362	Y	71.3	Confident	82.6	Confident	26 Å²	26	69.7 Å²	69.7	10%	0.102	35%	0.354	C	S	.	.			trans	-70.8	129	155.8	-80.8	-92.9	0	0	0	108.1	K146 Y149 L360 Y364 A366	K146-Y362 PolarHBondContact NZ-OH 3.16Å; Y149-Y362 AromaticContact CD2-CE2 3.42Å; Y149-Y362 HydrophobicContact CD2-CE2 3.42Å; Y149-Y362 VanDerWaalsContact CD2-CE2 3.42Å; Y149-Y362 AromaticContact CD2-CZ 3.94Å; Y149-Y362 WeakPolarHBondContact CE1-OH 3.33Å; Y149-Y362 HydrophobicContact CE2-CD2 4.36Å; Y149-Y362 AromaticContact CE2-CE2 3.15Å; Y149-Y362 HydrophobicContact CE2-CE2 3.15Å; Y149-Y362 AromaticContact CE2-CZ 3.51Å; Y149-Y362 WeakPolarHBondContact CE2-OH 3.42Å; Y149-Y362 HydrophobicContact CG-CE2 4.43Å; Y149-Y362 AromaticContact CZ-CZ 3.9Å; Y149-Y362 PolarHBondContact OH-OH 2.71Å; L360-Y362 PolarHBondContact O-N 3.31Å; Y362-Y364 PolarHBondContact O-N 3.38Å; Y362-A366 HydrophobicContact CD1-CB 3.74Å
363	T	77.9	Confident	82.9	Confident	75 Å²	75	62.1 Å²	62.1	46%	0.46	32%	0.319	S	S	.	.			trans	-58	143.9	163.4	59.6	0	0	0	0	107.8	E365 A366 Q367	T363-E365 PolarHBondContact O-N 3.06Å; T363-E365 VanDerWaalsContact O-N 3.13Å; T363-A366 WeakPolarHBondContact O-CA 3.26Å; T363-A366 WeakPolarHBondContact O-CB 3.06Å; T363-A366 PolarHBondContact O-N 3.4Å; T363-A366 WeakPolarHBondContact OG1-CB 2.87Å; T363-A366 PolarHBondContact OG1-N 3.02Å; T363-Q367 PolarHBondContact O-N 3.09Å; T363-Q367 VanDerWaalsContact O-N 3.09Å
364	Y	81.4	Confident	83	Confident	164 Å²	164	61.2 Å²	61.2	64%	0.643	32%	0.315	S	S	*	.	H	α-helix	trans	-50.1	-39.9	175.5	179.1	-96.3	0	0	0	111	Y362 A366 Q367 E368	Y362-Y364 PolarHBondContact O-N 3.38Å; Y364-A366 PolarHBondContact O-N 2.81Å; Y364-Q367 PolarHBondContact O-N 2.84Å; Y364-E368 HydrophobicContact CD1-CG 3.93Å; Y364-E368 HydrophobicContact CE1-CG 3.49Å; Y364-E368 VanDerWaalsContact CE1-CG 3.49Å; Y364-E368 HydrophobicContact CE2-CG 4.3Å; Y364-E368 HydrophobicContact CG-CG 4.49Å; Y364-E368 WeakPolarHBondContact O-CG 3.3Å; Y364-E368 PolarHBondContact O-N 3.09Å; Y364-E368 PolarHBondContact OH-OE1 3.18Å
365	E	87.1	Confident	83.1	Confident	131 Å²	131	64.8 Å²	64.8	61%	0.612	33%	0.327	S	S	*	.	H	α-helix	trans	-57.5	-45.1	173.8	-61.6	-178.6	172.1	0	0	113.3	T363 Q367 E368 L369	T363-E365 PolarHBondContact O-N 3.06Å; T363-E365 VanDerWaalsContact O-N 3.13Å; E365-Q367 VanDerWaalsContact C-N 3.34Å; E365-Q367 PolarHBondContact O-N 3.29Å; E365-E368 PolarHBondContact O-N 3.32Å; E365-L369 WeakPolarHBondContact O-CB 3.46Å; E365-L369 VanDerWaalsContact O-CG 3.24Å; E365-L369 WeakPolarHBondContact O-CG 3.42Å; E365-L369 PolarHBondContact O-N 2.92Å
366	A	86.9	Confident	83.5	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-64.1	-41	178.5	0	0	0	0	0	112	Y126 A127 Y362 T363 Y364 L369 Q370	Y126-A366 HydrophobicContact CD2-CB 3.74Å; Y126-A366 HydrophobicContact CE2-CB 3.74Å; A127-A366 HydrophobicContact CB-CB 3.76Å; Y362-A366 HydrophobicContact CD1-CB 3.74Å; T363-A366 WeakPolarHBondContact O-CA 3.26Å; T363-A366 WeakPolarHBondContact O-CB 3.06Å; T363-A366 PolarHBondContact O-N 3.4Å; T363-A366 WeakPolarHBondContact OG1-CB 2.87Å; T363-A366 PolarHBondContact OG1-N 3.02Å; Y364-A366 PolarHBondContact O-N 2.81Å; A366-L369 PolarHBondContact O-N 3.08Å; A366-Q370 WeakPolarHBondContact O-CB 3.42Å; A366-Q370 WeakPolarHBondContact O-CG 3.48Å; A366-Q370 PolarHBondContact O-N 3.23Å
367	Q	85.6	Confident	83.8	Confident	75 Å²	75	56.6 Å²	56.6	35%	0.35	29%	0.289	S	S	.	.	H	α-helix	trans	-65.5	-43.5	177.4	-171.1	178.8	30.6	0	0	111.4	T363 Y364 E365 Q370 G371 W417	T363-Q367 PolarHBondContact O-N 3.09Å; T363-Q367 VanDerWaalsContact O-N 3.09Å; Y364-Q367 PolarHBondContact O-N 2.84Å; E365-Q367 VanDerWaalsContact C-N 3.34Å; E365-Q367 PolarHBondContact O-N 3.29Å; Q367-Q370 PolarHBondContact O-N 3.23Å; Q367-G371 PolarHBondContact O-N 3.07Å; Q367-W417 PolarHBondContact NE2-O 3.35Å
368	E	88.7	Confident	84	Confident	100 Å²	100	59.6 Å²	59.6	47%	0.467	31%	0.308	S	S	.	.	H	α-helix	trans	-62.8	-41.8	176	-73.6	-64.6	119.2	0	0	111.7	Y364 E365 G371 A372	Y364-E368 HydrophobicContact CD1-CG 3.93Å; Y364-E368 HydrophobicContact CE1-CG 3.49Å; Y364-E368 VanDerWaalsContact CE1-CG 3.49Å; Y364-E368 HydrophobicContact CE2-CG 4.3Å; Y364-E368 HydrophobicContact CG-CG 4.49Å; Y364-E368 WeakPolarHBondContact O-CG 3.3Å; Y364-E368 PolarHBondContact O-N 3.09Å; Y364-E368 PolarHBondContact OH-OE1 3.18Å; E365-E368 PolarHBondContact O-N 3.32Å; E368-G371 PolarHBondContact O-N 3.48Å; E368-A372 VanDerWaalsContact O-CB 3.23Å; E368-A372 WeakPolarHBondContact O-CB 3.39Å; E368-A372 PolarHBondContact O-N 2.82Å
369	L	91.4	Very high	84.2	Confident	69 Å²	69	56.8 Å²	56.8	36%	0.361	29%	0.29	S	S	.	.	H	α-helix	trans	-64.3	-43.3	176.8	-72.4	173	0	0	0	112.1	L123 P124 Y126 A127 E365 A366 A372 A373	L123-L369 HydrophobicContact CD2-CB 3.84Å; P124-L369 HydrophobicContact CG-CD1 3.72Å; Y126-L369 HydrophobicContact CE2-CD1 4.44Å; Y126-L369 WeakPolarHBondContact OH-CD1 3.48Å; A127-L369 HydrophobicContact CB-CD1 4.46Å; E365-L369 WeakPolarHBondContact O-CB 3.46Å; E365-L369 VanDerWaalsContact O-CG 3.24Å; E365-L369 WeakPolarHBondContact O-CG 3.42Å; E365-L369 PolarHBondContact O-N 2.92Å; A366-L369 PolarHBondContact O-N 3.08Å; L369-A372 PolarHBondContact O-N 2.93Å; L369-A373 WeakPolarHBondContact O-CB 2.78Å; L369-A373 PolarHBondContact O-N 3.06Å
370	Q	89.2	Confident	84.6	Confident	2 Å²	2	57 Å²	57	1%	0.009	29%	0.292	C	S	.	.	H	α-helix	trans	-63.5	-44.8	174.7	-76	178.4	-10	0	0	111.8	L123 A127 Y129 A366 Q367 A373 I374 W417	L123-Q370 HydrophobicContact CD1-CG 3.96Å; L123-Q370 HydrophobicContact CD2-CG 4.36Å; A127-Q370 WeakPolarHBondContact O-CG 3.32Å; A127-Q370 PolarHBondContact O-NE2 3.04Å; Y129-Q370 HydrophobicContact CE1-CG 4.37Å; A366-Q370 WeakPolarHBondContact O-CB 3.42Å; A366-Q370 WeakPolarHBondContact O-CG 3.48Å; A366-Q370 PolarHBondContact O-N 3.23Å; Q367-Q370 PolarHBondContact O-N 3.23Å; Q370-A373 PolarHBondContact O-N 2.94Å; Q370-I374 WeakPolarHBondContact O-CG1 3.41Å; Q370-I374 PolarHBondContact O-N 2.95Å; Q370-W417 HydrophobicContact CB-CE3 4.29Å; Q370-W417 HydrophobicContact CB-CZ3 3.86Å; Q370-W417 HydrophobicContact CG-CZ3 4.41Å
371	G	88.2	Confident	84.8	Confident	22 Å²	22	60.4 Å²	60.4	23%	0.227	31%	0.314	C	S	.	.	H	α-helix	trans	-60.8	-46.3	176.3	0	0	0	0	0	111.6	Q367 E368 I374 H375	Q367-G371 PolarHBondContact O-N 3.07Å; E368-G371 PolarHBondContact O-N 3.48Å; G371-I374 PolarHBondContact O-N 2.86Å; G371-H375 WeakPolarHBondContact O-CB 2.99Å; G371-H375 PolarHBondContact O-CD2 3.17Å; G371-H375 PolarHBondContact O-N 3.1Å
372	A	90	Very high	85.5	Confident	45 Å²	45	61 Å²	61	37%	0.372	32%	0.315	S	S	.	.	H	α-helix	trans	-60.4	-46.6	175.1	0	0	0	0	0	111.7	E368 L369 I374 H375 M376	E368-A372 VanDerWaalsContact O-CB 3.23Å; E368-A372 WeakPolarHBondContact O-CB 3.39Å; E368-A372 PolarHBondContact O-N 2.82Å; L369-A372 PolarHBondContact O-N 2.93Å; A372-I374 VanDerWaalsContact C-N 3.27Å; A372-I374 PolarHBondContact O-N 3.15Å; A372-H375 PolarHBondContact O-N 2.81Å; A372-H375 VanDerWaalsContact O-N 3.14Å; A372-M376 WeakPolarHBondContact O-CG 3.36Å; A372-M376 PolarHBondContact O-N 3Å
373	A	90.4	Very high	86	Confident	4 Å²	4	63.3 Å²	63.3	3%	0.033	33%	0.333	C	S	.	.	H	α-helix	trans	-60.1	-38.3	177.4	0	0	0	0	0	112	H119 L123 L369 Q370	H119-A373 HydrophobicContact CB-CB 4.04Å; L123-A373 HydrophobicContact CD2-CB 4.21Å; L369-A373 WeakPolarHBondContact O-CB 2.78Å; L369-A373 PolarHBondContact O-N 3.06Å; Q370-A373 PolarHBondContact O-N 2.94Å
374	I	87.7	Confident	86.1	Confident	19 Å²	19	61 Å²	61	10%	0.097	32%	0.32	C	S	.	.	H	α-helix	trans	-67.6	-46.3	173.6	-71.9	166.7	0	0	0	111.3	Q370 G371 A372 M376 D377 T380 W417	Q370-I374 WeakPolarHBondContact O-CG1 3.41Å; Q370-I374 PolarHBondContact O-N 2.95Å; G371-I374 PolarHBondContact O-N 2.86Å; A372-I374 VanDerWaalsContact C-N 3.27Å; A372-I374 PolarHBondContact O-N 3.15Å; I374-M376 PolarHBondContact O-N 2.98Å; I374-D377 WeakPolarHBondContact O-CB 3.25Å; I374-D377 PolarHBondContact O-N 3.32Å; I374-T380 HydrophobicContact CG2-CG2 3.76Å; I374-T380 PolarHBondContact O-OG1 2.91Å; I374-W417 HydrophobicContact CD1-CH2 2.95Å; I374-W417 HydrophobicContact CD1-CZ2 3.06Å; I374-W417 HydrophobicContact CD1-CZ3 3.78Å; I374-W417 HydrophobicContact CG1-CH2 4.28Å
375	H	86.6	Confident	86	Confident	121 Å²	121	54.1 Å²	54.1	56%	0.56	30%	0.296	S	S	*	.	H	α-helix	trans	-64.8	-20.2	-178.8	-78.8	-61.5	0	0	0	113.5	G371 A372 D377 C381	G371-H375 WeakPolarHBondContact O-CB 2.99Å; G371-H375 PolarHBondContact O-CD2 3.17Å; G371-H375 PolarHBondContact O-N 3.1Å; A372-H375 PolarHBondContact O-N 2.81Å; A372-H375 VanDerWaalsContact O-N 3.14Å; H375-D377 PolarHBondContact O-N 3.34Å; H375-C381 PolarHBondContact O-SG 3.25Å
376	M	87.2	Confident	85.8	Confident	136 Å²	136	53.9 Å²	53.9	67%	0.67	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-23.2	169.2	-69.4	177.3	-161.9	0	0	112.5	A372 I374 P378	A372-M376 WeakPolarHBondContact O-CG 3.36Å; A372-M376 PolarHBondContact O-N 3Å; I374-M376 PolarHBondContact O-N 2.98Å; M376-P378 WeakPolarHBondContact O-CD 3.4Å
377	D	85.9	Confident	85.7	Confident	17 Å²	17	54.1 Å²	54.1	9%	0.091	29%	0.292	C	S	.	.	S	Bend	trans	-75	121.1	177.4	-167	-43.2	0	0	0	111.3	F114 I374 H375 R379 T380 C381	F114-D377 HydrophobicContact CZ-CB 4.49Å; I374-D377 WeakPolarHBondContact O-CB 3.25Å; I374-D377 PolarHBondContact O-N 3.32Å; H375-D377 PolarHBondContact O-N 3.34Å; D377-R379 VanDerWaalsContact CG-NE 3.32Å; D377-R379 PolarHBondContact O-N 3.06Å; D377-R379 WeakPolarHBondContact OD1-CB 3.5Å; D377-R379 WeakPolarHBondContact OD1-CG 3.24Å; D377-R379 IonicContact OD1-CZ 3.67Å; D377-R379 PolarHBondContact OD1-N 3.27Å; D377-R379 IonicContact OD1-NE 3.48Å; D377-R379 PolarHBondContact OD1-NE 2.98Å; D377-R379 IonicContact OD1-NH2 3.81Å; D377-R379 IonicContact OD2-CZ 3.85Å; D377-R379 IonicContact OD2-NE 3.28Å; D377-R379 PolarHBondContact OD2-NE 2.99Å; D377-R379 IonicContact OD2-NH2 2.9Å; D377-R379 PolarHBondContact OD2-NH2 2.76Å; D377-T380 HydrophobicContact CB-CG2 4.45Å; D377-T380 PolarHBondContact O-N 2.92Å; D377-T380 PolarHBondContact O-OG1 3.18Å; D377-C381 PolarHBondContact O-N 3.4Å; D377-C381 PolarHBondContact O-SG 2.86Å
378	P	85.5	Confident	85.7	Confident	64 Å²	64	54.6 Å²	54.6	42%	0.416	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-20.6	178.9	-26.3	35.2	0	0	0	115.2	M376 T380 N387 K389	M376-P378 WeakPolarHBondContact O-CD 3.4Å; P378-T380 VanDerWaalsContact C-N 3.32Å; P378-N387 PolarHBondContact O-ND2 2.98Å; P378-K389 HydrophobicContact CB-CD 4.28Å
379	R	85.3	Confident	85.5	Confident	55 Å²	55	56.5 Å²	56.5	21%	0.208	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-26.6	177.4	-66.6	171.9	-74.5	-158.6	1.5	113	V110 F114 D377 N387 F390	V110-R379 HydrophobicContact CB-CB 4.33Å; V110-R379 HydrophobicContact CG1-CB 4.24Å; F114-R379 VanDerWaalsContact CB-CZ 3.43Å; F114-R379 VanDerWaalsContact CD1-CZ 3.42Å; F114-R379 VanDerWaalsContact CG-CZ 3.44Å; F114-R379 VanDerWaalsContact CG-NH2 3.28Å; D377-R379 VanDerWaalsContact CG-NE 3.32Å; D377-R379 PolarHBondContact O-N 3.06Å; D377-R379 WeakPolarHBondContact OD1-CB 3.5Å; D377-R379 WeakPolarHBondContact OD1-CG 3.24Å; D377-R379 IonicContact OD1-CZ 3.67Å; D377-R379 PolarHBondContact OD1-N 3.27Å; D377-R379 IonicContact OD1-NE 3.48Å; D377-R379 PolarHBondContact OD1-NE 2.98Å; D377-R379 IonicContact OD1-NH2 3.81Å; D377-R379 IonicContact OD2-CZ 3.85Å; D377-R379 IonicContact OD2-NE 3.28Å; D377-R379 PolarHBondContact OD2-NE 2.99Å; D377-R379 IonicContact OD2-NH2 2.9Å; D377-R379 PolarHBondContact OD2-NH2 2.76Å; R379-N387 PolarHBondContact O-ND2 3.22Å; R379-F390 HydrophobicContact CB-CE2 4.22Å; R379-F390 HydrophobicContact CB-CZ 4.46Å; R379-F390 HydrophobicContact CG-CE1 4.32Å; R379-F390 HydrophobicContact CG-CE2 3.72Å; R379-F390 HydrophobicContact CG-CZ 3.48Å; R379-F390 VanDerWaalsContact CG-CZ 3.48Å
380	T	84.7	Confident	85.1	Confident	16 Å²	16	56.9 Å²	56.9	10%	0.098	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-13.3	-169.3	64.1	0	0	0	0	113.3	Y107 V110 F114 I374 D377 P378 I382	Y107-T380 HydrophobicContact CD1-CG2 4.32Å; Y107-T380 HydrophobicContact CE1-CG2 4.01Å; V110-T380 HydrophobicContact CG1-CG2 4.06Å; F114-T380 HydrophobicContact CE1-CG2 3.88Å; F114-T380 HydrophobicContact CZ-CG2 4.03Å; I374-T380 HydrophobicContact CG2-CG2 3.76Å; I374-T380 PolarHBondContact O-OG1 2.91Å; D377-T380 HydrophobicContact CB-CG2 4.45Å; D377-T380 PolarHBondContact O-N 2.92Å; D377-T380 PolarHBondContact O-OG1 3.18Å; P378-T380 VanDerWaalsContact C-N 3.32Å; T380-I382 PolarHBondContact O-N 2.87Å; T380-I382 VanDerWaalsContact O-N 3.14Å
381	C	82.3	Confident	84.8	Confident	73 Å²	73	58.5 Å²	58.5	49%	0.493	31%	0.314	S	S	.	.	S	Bend	trans	-52.7	-36.1	178.6	-56.6	0	0	0	0	112.6	H375 D377	H375-C381 PolarHBondContact O-SG 3.25Å; D377-C381 PolarHBondContact O-N 3.4Å; D377-C381 PolarHBondContact O-SG 2.86Å
382	I	82.8	Confident	84.8	Confident	67 Å²	67	60.6 Å²	60.6	34%	0.344	33%	0.325	S	S	.	.	S	Bend	trans	-116.5	144.5	175.3	-60.8	170.6	0	0	0	107.1	T380 Y386 N387 P388	T380-I382 PolarHBondContact O-N 2.87Å; T380-I382 VanDerWaalsContact O-N 3.14Å; I382-Y386 WeakPolarHBondContact CG2-O 3.14Å; I382-N387 HydrophobicContact CB-CB 4.21Å; I382-N387 HydrophobicContact CG2-CB 4.35Å; I382-P388 HydrophobicContact CD1-CG 4.38Å
383	P	82.1	Confident	84.7	Confident	74 Å²	74	64.1 Å²	64.1	48%	0.481	34%	0.337	S	S	.	.			trans	-46.5	129.9	173	-29.8	35.4	0	0	0	111	A385 Y386 N387	P383-A385 PolarHBondContact O-N 2.95Å; P383-A385 VanDerWaalsContact O-N 3.08Å; P383-Y386 HydrophobicContact CB-CD2 3.99Å; P383-Y386 CarbonylContact O-C 3.33Å; P383-Y386 PolarHBondContact O-N 3.2Å; P383-N387 PolarHBondContact O-N 3.28Å
384	P	78.5	Confident	84.6	Confident	27 Å²	27	69.3 Å²	69.3	18%	0.175	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-59.1	-33.9	-164.6	-28.1	36.2	0	0	0	114.1	N109 V110 Y386 N387	N109-P384 WeakPolarHBondContact O-CB 3.28Å; N109-P384 VanDerWaalsContact O-CG 3.26Å; N109-P384 WeakPolarHBondContact O-CG 3.38Å; V110-P384 HydrophobicContact CB-CB 4.48Å; V110-P384 HydrophobicContact CB-CG 4.44Å; V110-P384 HydrophobicContact CG1-CB 3.85Å; V110-P384 HydrophobicContact CG1-CG 3.38Å; P384-Y386 PolarHBondContact O-N 3.16Å; P384-N387 PolarHBondContact O-N 3.04Å
385	A	79.2	Confident	84.6	Confident	18 Å²	18	71.3 Å²	71.3	15%	0.149	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-62.7	-23.1	176	0	0	0	0	0	113.8	P383 I402 A403	P383-A385 PolarHBondContact O-N 2.95Å; P383-A385 VanDerWaalsContact O-N 3.08Å; A385-I402 HydrophobicContact CB-CG2 4.19Å; A385-I402 WeakPolarHBondContact O-CD1 3.33Å; A385-A403 HydrophobicContact CB-CB 3.99Å
386	Y	83.9	Confident	84.5	Confident	127 Å²	127	67.4 Å²	67.4	50%	0.498	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-120	13.5	-174.9	-52.9	-58.4	0	0	0	112.4	I382 P383 P384 P388 I396 I402	I382-Y386 WeakPolarHBondContact CG2-O 3.14Å; P383-Y386 HydrophobicContact CB-CD2 3.99Å; P383-Y386 CarbonylContact O-C 3.33Å; P383-Y386 PolarHBondContact O-N 3.2Å; P384-Y386 PolarHBondContact O-N 3.16Å; Y386-P388 WeakPolarHBondContact O-CD 3.46Å; Y386-I396 HydrophobicContact CD1-CG2 4.11Å; Y386-I402 HydrophobicContact CE1-CG2 4.39Å
387	N	85.1	Confident	84.6	Confident	6 Å²	6	66.9 Å²	66.9	3%	0.032	35%	0.352	C	S	.	.			trans	-81.2	107.3	-177.2	-169.1	-23.3	0	0	0	110.3	P378 R379 I382 P383 P384 K389 F390 K391	P378-N387 PolarHBondContact O-ND2 2.98Å; R379-N387 PolarHBondContact O-ND2 3.22Å; I382-N387 HydrophobicContact CB-CB 4.21Å; I382-N387 HydrophobicContact CG2-CB 4.35Å; P383-N387 PolarHBondContact O-N 3.28Å; P384-N387 PolarHBondContact O-N 3.04Å; N387-K389 PolarHBondContact O-N 3.18Å; N387-K389 VanDerWaalsContact OD1-CB 3.27Å; N387-K389 WeakPolarHBondContact OD1-CB 3.44Å; N387-K389 PolarHBondContact OD1-N 3.27Å; N387-K389 VanDerWaalsContact OD1-N 3.14Å; N387-F390 HydrophobicContact CB-CD2 4.35Å; N387-F390 PolarHBondContact O-N 2.67Å; N387-F390 VanDerWaalsContact O-N 3.12Å; N387-K391 PolarHBondContact O-N 3.04Å
388	P	85.4	Confident	84.6	Confident	85 Å²	85	73 Å²	73	55%	0.552	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-11.7	-174.9	30.7	-36.6	0	0	0	113.1	I382 Y386 F390 K391 I396	I382-P388 HydrophobicContact CD1-CG 4.38Å; Y386-P388 WeakPolarHBondContact O-CD 3.46Å; P388-F390 VanDerWaalsContact C-N 3.33Å; P388-K391 CarbonylContact C-O 3.52Å; P388-K391 WeakPolarHBondContact CA-O 3.43Å; P388-I396 HydrophobicContact CB-CD1 4.32Å
389	K	84.8	Confident	84.4	Confident	139 Å²	139	72.7 Å²	72.7	60%	0.604	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-29.8	175.1	-170.4	174.3	-178.8	177.5	0	112.5	P378 N387	P378-K389 HydrophobicContact CB-CD 4.28Å; N387-K389 PolarHBondContact O-N 3.18Å; N387-K389 VanDerWaalsContact OD1-CB 3.27Å; N387-K389 WeakPolarHBondContact OD1-CB 3.44Å; N387-K389 PolarHBondContact OD1-N 3.27Å; N387-K389 VanDerWaalsContact OD1-N 3.14Å
390	F	83	Confident	83.9	Confident	78 Å²	78	75.1 Å²	75.1	34%	0.342	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-16.5	-174.8	-59.1	-77.4	0	0	0	113.3	E111 R379 N387 P388	E111-F390 VanDerWaalsContact O-CD1 3.28Å; E111-F390 WeakPolarHBondContact O-CD1 3.25Å; E111-F390 WeakPolarHBondContact O-CG 3.42Å; R379-F390 HydrophobicContact CB-CE2 4.22Å; R379-F390 HydrophobicContact CB-CZ 4.46Å; R379-F390 HydrophobicContact CG-CE1 4.32Å; R379-F390 HydrophobicContact CG-CE2 3.72Å; R379-F390 HydrophobicContact CG-CZ 3.48Å; R379-F390 VanDerWaalsContact CG-CZ 3.48Å; N387-F390 HydrophobicContact CB-CD2 4.35Å; N387-F390 PolarHBondContact O-N 2.67Å; N387-F390 VanDerWaalsContact O-N 3.12Å; P388-F390 VanDerWaalsContact C-N 3.33Å
391	K	82.9	Confident	83.2	Confident	35 Å²	35	81.6 Å²	81.6	15%	0.152	42%	0.419	C	S	.	.	S	Bend	trans	-124	136.5	-179.2	-61.1	-66.4	179.5	-177.7	0	109.9	E111 N387 P388 E395 I396 I402	E111-K391 WeakPolarHBondContact OE2-CE 3.34Å; E111-K391 IonicContact OE2-NZ 2.67Å; E111-K391 PolarHBondContact OE2-NZ 2.86Å; N387-K391 PolarHBondContact O-N 3.04Å; P388-K391 CarbonylContact C-O 3.52Å; P388-K391 WeakPolarHBondContact CA-O 3.43Å; K391-E395 WeakPolarHBondContact CD-OE1 3.48Å; K391-E395 VanDerWaalsContact CD-OE2 3.25Å; K391-E395 WeakPolarHBondContact CD-OE2 3.28Å; K391-E395 IonicContact NZ-OE1 2.82Å; K391-E395 PolarHBondContact NZ-OE1 3.43Å; K391-I396 HydrophobicContact CB-CD1 4.06Å; K391-I396 HydrophobicContact CB-CG1 3.86Å; K391-I402 HydrophobicContact CB-CD1 4.2Å; K391-I402 HydrophobicContact CD-CD1 4.15Å; K391-I402 HydrophobicContact CD-CG1 4.4Å; K391-I402 HydrophobicContact CG-CD1 4.13Å
392	S	86.9	Confident	82.8	Confident	66 Å²	66	79.1 Å²	79.1	46%	0.462	40%	0.4	S	S	.	.			trans	-66.7	150.2	175.6	75.9	0	0	0	0	110.1	L394 E395 I396	S392-L394 PolarHBondContact O-N 3.46Å; S392-E395 WeakPolarHBondContact O-CB 3.07Å; S392-E395 PolarHBondContact O-N 3.43Å; S392-E395 WeakPolarHBondContact OG-CB 3.45Å; S392-E395 PolarHBondContact OG-N 3.14Å; S392-E395 VanDerWaalsContact OG-N 3.15Å; S392-I396 PolarHBondContact O-N 3.04Å
393	I	88	Confident	82.5	Confident	120 Å²	120	78 Å²	78	62%	0.615	40%	0.401	S	S	*	.	H	α-helix	trans	-59.7	-31.9	178.1	-159.3	160.6	0	0	0	112.1	I396 M397	I393-I396 PolarHBondContact O-N 3.38Å; I393-M397 HydrophobicContact CG1-CG 4.44Å; I393-M397 HydrophobicContact CG1-SD 4.14Å; I393-M397 WeakPolarHBondContact O-CB 3.09Å; I393-M397 VanDerWaalsContact O-CG 3.26Å; I393-M397 WeakPolarHBondContact O-CG 3.37Å; I393-M397 PolarHBondContact O-N 3.41Å
394	L	88.8	Confident	82.3	Confident	113 Å²	113	78.2 Å²	78.2	59%	0.592	40%	0.395	S	S	*	.	H	α-helix	trans	-65.2	-41.5	174.7	-67	176.1	0	0	0	111.7	S392 M397 F398	S392-L394 PolarHBondContact O-N 3.46Å; L394-M397 PolarHBondContact O-N 3.05Å; L394-F398 HydrophobicContact CD2-CD2 4.13Å; L394-F398 HydrophobicContact CD2-CE2 3.95Å; L394-F398 WeakPolarHBondContact O-CB 3.19Å; L394-F398 WeakPolarHBondContact O-CD2 3.37Å; L394-F398 PolarHBondContact O-N 3.22Å
395	E	87.1	Confident	82.4	Confident	60 Å²	60	79.1 Å²	79.1	28%	0.28	40%	0.401	S	S	.	.	H	α-helix	trans	-63.3	-48.5	175.8	-154.4	-173.3	159.2	0	0	109.9	K391 S392 M397 F398 N399 I402	K391-E395 WeakPolarHBondContact CD-OE1 3.48Å; K391-E395 VanDerWaalsContact CD-OE2 3.25Å; K391-E395 WeakPolarHBondContact CD-OE2 3.28Å; K391-E395 IonicContact NZ-OE1 2.82Å; K391-E395 PolarHBondContact NZ-OE1 3.43Å; S392-E395 WeakPolarHBondContact O-CB 3.07Å; S392-E395 PolarHBondContact O-N 3.43Å; S392-E395 WeakPolarHBondContact OG-CB 3.45Å; S392-E395 PolarHBondContact OG-N 3.14Å; S392-E395 VanDerWaalsContact OG-N 3.15Å; E395-M397 VanDerWaalsContact C-N 3.31Å; E395-M397 PolarHBondContact O-N 3.49Å; E395-F398 PolarHBondContact O-N 3.41Å; E395-N399 HydrophobicContact CG-CB 4.05Å; E395-N399 WeakPolarHBondContact O-CA 3.47Å; E395-N399 WeakPolarHBondContact O-CB 3.44Å; E395-N399 PolarHBondContact O-N 3.17Å; E395-I402 HydrophobicContact CB-CD1 3.88Å; E395-I402 HydrophobicContact CG-CD1 3.55Å; E395-I402 HydrophobicContact CG-CG1 4.2Å
396	I	86.3	Confident	82.7	Confident	40 Å²	40	78.9 Å²	78.9	21%	0.205	40%	0.398	C	S	.	.	H	α-helix	trans	-57.8	-42.8	179.2	-70	170.7	0	0	0	111.8	Y386 P388 K391 S392 I393 I402	Y386-I396 HydrophobicContact CD1-CG2 4.11Å; P388-I396 HydrophobicContact CB-CD1 4.32Å; K391-I396 HydrophobicContact CB-CD1 4.06Å; K391-I396 HydrophobicContact CB-CG1 3.86Å; S392-I396 PolarHBondContact O-N 3.04Å; I393-I396 PolarHBondContact O-N 3.38Å; I396-I402 HydrophobicContact CG1-CD1 4.14Å
397	M	87.3	Confident	82.9	Confident	124 Å²	124	74 Å²	74	61%	0.611	38%	0.379	S	S	*	.	H	α-helix	trans	-79.2	-37.4	-175.9	-72.1	180	67.3	0	0	113.7	I393 L394 E395	I393-M397 HydrophobicContact CG1-CG 4.44Å; I393-M397 HydrophobicContact CG1-SD 4.14Å; I393-M397 WeakPolarHBondContact O-CB 3.09Å; I393-M397 VanDerWaalsContact O-CG 3.26Å; I393-M397 WeakPolarHBondContact O-CG 3.37Å; I393-M397 PolarHBondContact O-N 3.41Å; L394-M397 PolarHBondContact O-N 3.05Å; E395-M397 VanDerWaalsContact C-N 3.31Å; E395-M397 PolarHBondContact O-N 3.49Å
398	F	87	Confident	82.9	Confident	147 Å²	147	75.5 Å²	75.5	65%	0.645	39%	0.39	S	S	*	.	H	α-helix	trans	-118.4	-5.6	-166.2	-59.6	-68.6	0	0	0	114.7	L394 E395 P400	L394-F398 HydrophobicContact CD2-CD2 4.13Å; L394-F398 HydrophobicContact CD2-CE2 3.95Å; L394-F398 WeakPolarHBondContact O-CB 3.19Å; L394-F398 WeakPolarHBondContact O-CD2 3.37Å; L394-F398 PolarHBondContact O-N 3.22Å; E395-F398 PolarHBondContact O-N 3.41Å; F398-P400 WeakPolarHBondContact O-CD 3.19Å
399	N	82	Confident	82.8	Confident	56 Å²	56	72.4 Å²	72.4	30%	0.299	37%	0.372	S	S	.	.			trans	-97.3	95.6	172.8	-172.4	1	0	0	0	110.3	E395 W401 I402	E395-N399 HydrophobicContact CG-CB 4.05Å; E395-N399 WeakPolarHBondContact O-CA 3.47Å; E395-N399 WeakPolarHBondContact O-CB 3.44Å; E395-N399 PolarHBondContact O-N 3.17Å; N399-W401 PolarHBondContact O-N 2.73Å; N399-W401 VanDerWaalsContact O-N 3.09Å; N399-W401 PolarHBondContact OD1-N 3.15Å; N399-W401 VanDerWaalsContact OD1-N 3.09Å; N399-I402 HydrophobicContact CB-CB 4.15Å; N399-I402 WeakPolarHBondContact O-CB 3.12Å; N399-I402 WeakPolarHBondContact O-CG2 3.21Å; N399-I402 PolarHBondContact O-N 2.79Å
400	P	73.6	Confident	82.7	Confident	106 Å²	106	66.4 Å²	66.4	69%	0.688	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-12.2	178.9	28.9	-35.5	0	0	0	113	F398	F398-P400 WeakPolarHBondContact O-CD 3.19Å
401	W	71.1	Confident	82.7	Confident	153 Å²	153	62.8 Å²	62.8	58%	0.58	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	12.4	-178.1	-48.4	108.3	0	0	0	112.7	Y45 N399 A403	Y45-W401 HydrophobicContact CD1-CD2 4.48Å; Y45-W401 AromaticContact CD1-CE3 3.6Å; Y45-W401 HydrophobicContact CD1-CE3 3.6Å; Y45-W401 AromaticContact CD1-CZ3 3.99Å; Y45-W401 HydrophobicContact CD1-CZ3 3.99Å; Y45-W401 HydrophobicContact CE1-CB 3.94Å; Y45-W401 AromaticContact CE1-CD2 3.93Å; Y45-W401 HydrophobicContact CE1-CD2 3.93Å; Y45-W401 AromaticContact CE1-CE3 3.45Å; Y45-W401 HydrophobicContact CE1-CE3 3.45Å; Y45-W401 VanDerWaalsContact CE1-CE3 3.45Å; Y45-W401 HydrophobicContact CE1-CG 4.15Å; Y45-W401 HydrophobicContact CE1-CZ3 4.26Å; N399-W401 PolarHBondContact O-N 2.73Å; N399-W401 VanDerWaalsContact O-N 3.09Å; N399-W401 PolarHBondContact OD1-N 3.15Å; N399-W401 VanDerWaalsContact OD1-N 3.09Å; W401-A403 PolarHBondContact O-N 3.2Å
402	I	72.8	Confident	82.3	Confident	20 Å²	20	61.8 Å²	61.8	10%	0.103	33%	0.327	C	S	.	.			trans	-66.1	-28.7	-177.9	-157.2	169.8	0	0	0	112.6	A385 Y386 K391 E395 I396 N399 K404	A385-I402 HydrophobicContact CB-CG2 4.19Å; A385-I402 WeakPolarHBondContact O-CD1 3.33Å; Y386-I402 HydrophobicContact CE1-CG2 4.39Å; K391-I402 HydrophobicContact CB-CD1 4.2Å; K391-I402 HydrophobicContact CD-CD1 4.15Å; K391-I402 HydrophobicContact CD-CG1 4.4Å; K391-I402 HydrophobicContact CG-CD1 4.13Å; E395-I402 HydrophobicContact CB-CD1 3.88Å; E395-I402 HydrophobicContact CG-CD1 3.55Å; E395-I402 HydrophobicContact CG-CG1 4.2Å; I396-I402 HydrophobicContact CG1-CD1 4.14Å; N399-I402 HydrophobicContact CB-CB 4.15Å; N399-I402 WeakPolarHBondContact O-CB 3.12Å; N399-I402 WeakPolarHBondContact O-CG2 3.21Å; N399-I402 PolarHBondContact O-N 2.79Å; I402-K404 PolarHBondContact O-N 3.17Å
403	A	76.3	Confident	81.5	Confident	44 Å²	44	64 Å²	64	36%	0.364	33%	0.329	S	S	.	.	S	Bend	trans	-79.4	116.8	173.4	0	0	0	0	0	110.1	A385 W401 S405	A385-A403 HydrophobicContact CB-CB 3.99Å; W401-A403 PolarHBondContact O-N 3.2Å; A403-S405 PolarHBondContact O-N 2.94Å
404	K	77.8	Confident	80.6	Confident	79 Å²	79	67 Å²	67	34%	0.343	33%	0.332	S	S	.	.			trans	-56.9	136.8	169	-64.7	-178.2	-175.5	175.8	0	109.4	R108 E111 I402 S408 A409	R108-K404 PolarHBondContact O-NZ 3.32Å; E111-K404 WeakPolarHBondContact OE1-CE 3.5Å; E111-K404 IonicContact OE1-NZ 2.85Å; E111-K404 PolarHBondContact OE1-NZ 2.78Å; I402-K404 PolarHBondContact O-N 3.17Å; K404-S408 WeakPolarHBondContact CD-O 3.4Å; K404-A409 HydrophobicContact CB-CB 4.22Å
405	S	81.2	Confident	79.8	Confident	45 Å²	45	61.8 Å²	61.8	32%	0.315	31%	0.305	S	S	.	.			trans	-134	169.5	179.4	83.7	0	0	0	0	111.8	S44 A403 F407 S408 A409	S44-S405 CarbonylContact O-C 3.59Å; S44-S405 VanDerWaalsContact O-C 3.25Å; S44-S405 PolarHBondContact O-OG 3.2Å; A403-S405 PolarHBondContact O-N 2.94Å; S405-F407 PolarHBondContact O-N 3.39Å; S405-S408 PolarHBondContact N-OG 3.39Å; S405-S408 WeakPolarHBondContact O-CB 3.41Å; S405-S408 PolarHBondContact O-N 3.49Å; S405-S408 PolarHBondContact O-OG 3.17Å; S405-A409 PolarHBondContact O-N 2.89Å
406	N	86.2	Confident	78.5	Confident	14 Å²	14	59.5 Å²	59.5	8%	0.075	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.1	-123.9	176.9	-161.1	37	0	0	0	113.2	Y42 F43 G46 S338 A340	Y42-N406 PolarHBondContact O-ND2 3.21Å; F43-N406 WeakPolarHBondContact O-CB 3.39Å; F43-N406 PolarHBondContact O-ND2 3.45Å; F43-N406 VanDerWaalsContact O-ND2 3.13Å; G46-N406 WeakPolarHBondContact CA-ND2 3.41Å; G46-N406 PolarHBondContact N-ND2 3Å; S338-N406 PolarHBondContact O-ND2 3.3Å; S338-N406 PolarHBondContact O-OD1 3.4Å; A340-N406 WeakPolarHBondContact CA-OD1 3.29Å; A340-N406 WeakPolarHBondContact CB-OD1 3.09Å; A340-N406 PolarHBondContact N-OD1 3.4Å
407	F	87.9	Confident	77.1	Confident	24 Å²	24	59.9 Å²	59.9	11%	0.105	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-13.6	177.8	-66.5	-72	0	0	0	114.1	F43 W160 L163 R164 C167 A340 S405 A409	F43-F407 HydrophobicContact CD1-CB 4.24Å; F43-F407 AromaticContact CD1-CD2 3.8Å; F43-F407 HydrophobicContact CD1-CD2 3.8Å; F43-F407 HydrophobicContact CD1-CE2 4.47Å; F43-F407 HydrophobicContact CD1-CG 4.23Å; F43-F407 HydrophobicContact CE1-CD2 4.49Å; F43-F407 WeakPolarHBondContact O-CB 3.29Å; F43-F407 PolarHBondContact O-N 3.43Å; W160-F407 HydrophobicContact CD2-CD1 4.48Å; W160-F407 HydrophobicContact CD2-CE1 4.35Å; W160-F407 AromaticContact CE2-CD1 3.72Å; W160-F407 AromaticContact CZ2-CD1 3.79Å; W160-F407 HydrophobicContact CZ2-CD1 3.79Å; W160-F407 HydrophobicContact CZ2-CE1 4.24Å; W160-F407 AromaticContact NE1-CD1 3.75Å; L163-F407 HydrophobicContact CB-CE1 4.26Å; L163-F407 HydrophobicContact CB-CZ 4.11Å; R164-F407 VanDerWaalsContact CA-CE1 3.5Å; R164-F407 HydrophobicContact CB-CD1 3.91Å; R164-F407 HydrophobicContact CB-CE1 3.56Å; R164-F407 HydrophobicContact CB-CZ 3.98Å; R164-F407 HydrophobicContact CG-CD1 3.94Å; R164-F407 HydrophobicContact CG-CE1 4.06Å; R164-F407 HydrophobicContact CG-CG 4.22Å; R164-F407 HydrophobicContact CG-CZ 4.44Å; C167-F407 HydrophobicContact CB-CD2 4.44Å; C167-F407 HydrophobicContact CB-CE2 3.48Å; C167-F407 VanDerWaalsContact CB-CE2 3.48Å; C167-F407 HydrophobicContact CB-CZ 3.99Å; A340-F407 HydrophobicContact CB-CD1 3.93Å; A340-F407 HydrophobicContact CB-CD2 3.94Å; A340-F407 HydrophobicContact CB-CE1 3.42Å; A340-F407 VanDerWaalsContact CB-CE1 3.42Å; A340-F407 HydrophobicContact CB-CE2 3.44Å; A340-F407 VanDerWaalsContact CB-CE2 3.44Å; A340-F407 HydrophobicContact CB-CG 4.18Å; A340-F407 HydrophobicContact CB-CZ 3.15Å; S405-F407 PolarHBondContact O-N 3.39Å; F407-A409 VanDerWaalsContact C-N 3.29Å; F407-A409 CarbonylContact C-O 3.55Å
408	S	84	Confident	75.4	Confident	38 Å²	38	57.8 Å²	57.8	27%	0.266	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-28.1	171.1	69.4	0	0	0	0	111.5	S44 K404 S405	S44-S408 PolarHBondContact O-OG 2.85Å; K404-S408 WeakPolarHBondContact CD-O 3.4Å; S405-S408 PolarHBondContact N-OG 3.39Å; S405-S408 WeakPolarHBondContact O-CB 3.41Å; S405-S408 PolarHBondContact O-N 3.49Å; S405-S408 PolarHBondContact O-OG 3.17Å
409	A	83.3	Confident	74.8	Confident	19 Å²	19	53.3 Å²	53.3	16%	0.157	26%	0.262	C	S	.	.	S	Bend	trans	-79.8	150.5	164.3	0	0	0	0	0	109.9	N109 K404 S405 F407	N109-A409 WeakPolarHBondContact OD1-CA 3.09Å; K404-A409 HydrophobicContact CB-CB 4.22Å; S405-A409 PolarHBondContact O-N 2.89Å; F407-A409 VanDerWaalsContact C-N 3.29Å; F407-A409 CarbonylContact C-O 3.55Å
410	D	82.9	Confident	74.4	Confident	13 Å²	13	53.2 Å²	53.2	7%	0.07	26%	0.261	C	S	.	.			trans	-69	177	168.9	-158.5	13.5	0	0	0	111.3	R108 N109 R157	R108-D410 HydrophobicContact CB-CB 4.48Å; N109-D410 PolarHBondContact OD1-N 3.1Å; R157-D410 IonicContact CZ-OD1 2.88Å; R157-D410 IonicContact CZ-OD2 3.28Å; R157-D410 IonicContact NH1-OD1 3.77Å; R157-D410 PolarHBondContact NH1-OD1 3.17Å; R157-D410 IonicContact NH1-OD2 2.75Å; R157-D410 IonicContact NH2-OD1 2.76Å; R157-D410 PolarHBondContact NH2-OD1 2.63Å; R157-D410 IonicContact NH2-OD2 3.73Å; R157-D410 PolarHBondContact NH2-OD2 3.45Å
411	L	82.6	Confident	74.4	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.01	24%	0.237	C	C	.	.	S	Bend	trans	-44.2	144	172.2	-85.1	177.5	0	0	0	111.3	L156 W160 F344 K413	L156-L411 HydrophobicContact CB-CD1 4.19Å; W160-L411 HydrophobicContact CB-CD2 4.05Å; W160-L411 HydrophobicContact CD2-CD2 3.59Å; W160-L411 HydrophobicContact CD2-CG 4.34Å; W160-L411 HydrophobicContact CE3-CD2 3.44Å; W160-L411 VanDerWaalsContact CE3-CD2 3.44Å; W160-L411 HydrophobicContact CG-CD2 3.88Å; W160-L411 HydrophobicContact CG-CG 4.35Å; W160-L411 HydrophobicContact CZ3-CD2 4.05Å; F344-L411 HydrophobicContact CD1-CD2 4.18Å; F344-L411 HydrophobicContact CD2-CD2 4.25Å; F344-L411 HydrophobicContact CE1-CD2 3.66Å; F344-L411 HydrophobicContact CE2-CD2 3.7Å; F344-L411 HydrophobicContact CG-CD2 4.45Å; F344-L411 HydrophobicContact CZ-CD2 3.37Å; L411-K413 PolarHBondContact O-N 2.78Å
412	P	75.1	Confident	74.6	Confident	14 Å²	14	44.2 Å²	44.2	9%	0.091	22%	0.217	C	C	.	.			trans	-53	132.4	-179.8	-18	25.9	0	0	0	110	F344 T345 R414 Y415	F344-P412 HydrophobicContact CD1-CG 4.16Å; T345-P412 HydrophobicContact CG2-CB 4.24Å; T345-P412 HydrophobicContact CG2-CG 3.8Å; P412-R414 PolarHBondContact O-N 3.23Å; P412-Y415 HydrophobicContact CB-CD2 3.79Å; P412-Y415 HydrophobicContact CB-CE2 4.06Å; P412-Y415 HydrophobicContact CG-CD2 3.95Å; P412-Y415 HydrophobicContact CG-CE2 4.11Å; P412-Y415 PolarHBondContact O-N 2.87Å
413	K	69.5	Low	74.8	Confident	112 Å²	112	45.7 Å²	45.7	49%	0.487	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-46.4	-36.9	-168.5	-71.4	-178.2	174.6	-176.5	0	113.9	Y107 L411 Y415 I416	Y107-K413 WeakPolarHBondContact OH-CE 3.45Å; L411-K413 PolarHBondContact O-N 2.78Å; K413-Y415 PolarHBondContact O-N 3Å; K413-Y415 VanDerWaalsContact O-N 3.15Å; K413-I416 PolarHBondContact O-N 2.9Å
414	R	70.9	Confident	74.7	Confident	184 Å²	184	45.8 Å²	45.8	69%	0.694	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-59	-23.5	-179.8	-66.4	-178.1	177.9	176.6	-2.3	114.4	P412 K418	P412-R414 PolarHBondContact O-N 3.23Å; R414-K418 WeakPolarHBondContact O-CB 3.4Å; R414-K418 VanDerWaalsContact O-CG 3.3Å; R414-K418 WeakPolarHBondContact O-CG 3.37Å; R414-K418 PolarHBondContact O-N 3.35Å
415	Y	71.3	Confident	74.4	Confident	3 Å²	3	43.4 Å²	43.4	1%	0.012	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-95.4	-7.1	-176.9	-61.9	-78.2	0	0	0	114.1	H153 F344 T345 F348 D349 P412 K413 W417 K418	H153-Y415 PolarHBondContact CE1-O 3.17Å; F344-Y415 HydrophobicContact CD1-CD2 4.33Å; F344-Y415 HydrophobicContact CD1-CE2 4.17Å; F344-Y415 HydrophobicContact CE1-CD1 4.3Å; F344-Y415 AromaticContact CE1-CD2 3.77Å; F344-Y415 HydrophobicContact CE1-CD2 3.77Å; F344-Y415 HydrophobicContact CE1-CE1 4.44Å; F344-Y415 AromaticContact CE1-CE2 3.94Å; F344-Y415 HydrophobicContact CE1-CE2 3.94Å; F344-Y415 AromaticContact CE1-CG 3.95Å; F344-Y415 HydrophobicContact CE1-CG 3.95Å; T345-Y415 HydrophobicContact CG2-CE2 4.29Å; F348-Y415 HydrophobicContact CB-CD1 4.29Å; F348-Y415 HydrophobicContact CB-CE1 3.41Å; F348-Y415 VanDerWaalsContact CB-CE1 3.41Å; F348-Y415 WeakPolarHBondContact CB-OH 3.42Å; F348-Y415 HydrophobicContact CG-CE1 4.45Å; F348-Y415 PolarHBondContact O-OH 3.34Å; D349-Y415 PolarHBondContact N-OH 3.06Å; D349-Y415 PolarHBondContact OD1-OH 2.91Å; P412-Y415 HydrophobicContact CB-CD2 3.79Å; P412-Y415 HydrophobicContact CB-CE2 4.06Å; P412-Y415 HydrophobicContact CG-CD2 3.95Å; P412-Y415 HydrophobicContact CG-CE2 4.11Å; P412-Y415 PolarHBondContact O-N 2.87Å; K413-Y415 PolarHBondContact O-N 3Å; K413-Y415 VanDerWaalsContact O-N 3.15Å; Y415-W417 VanDerWaalsContact C-N 3.27Å; Y415-K418 HydrophobicContact CD1-CD 4.15Å; Y415-K418 HydrophobicContact CE1-CD 4.18Å
416	I	59.3	Low	73.9	Confident	12 Å²	12	43.3 Å²	43.3	6%	0.062	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-22.7	168.4	-57.1	168	0	0	0	109.5	Y107 I116 K413	Y107-I416 HydrophobicContact CD2-CD1 4.33Å; Y107-I416 HydrophobicContact CE2-CD1 4.19Å; I116-I416 HydrophobicContact CD1-CG2 4.34Å; K413-I416 PolarHBondContact O-N 2.9Å
417	W	57.6	Low	72.9	Confident	48 Å²	48	45.8 Å²	45.8	18%	0.182	21%	0.207	C	C	.	.			trans	-127.5	18.1	-167.7	-47.6	109.1	0	0	0	115	I116 Y129 Q367 Q370 I374 Y415	I116-W417 HydrophobicContact CD1-CH2 3.98Å; I116-W417 HydrophobicContact CD1-CZ2 4.47Å; Y129-W417 HydrophobicContact CE1-CE3 4.5Å; Y129-W417 AromaticContact CE1-CH2 3.44Å; Y129-W417 HydrophobicContact CE1-CH2 3.44Å; Y129-W417 VanDerWaalsContact CE1-CH2 3.44Å; Y129-W417 AromaticContact CE1-CZ3 3.31Å; Y129-W417 HydrophobicContact CE1-CZ3 3.31Å; Y129-W417 AromaticContact CZ-CH2 3.66Å; Y129-W417 AromaticContact CZ-CZ3 3.63Å; Y129-W417 WeakPolarHBondContact OH-CH2 3.25Å; Y129-W417 WeakPolarHBondContact OH-CZ3 3.43Å; Q367-W417 PolarHBondContact NE2-O 3.35Å; Q370-W417 HydrophobicContact CB-CE3 4.29Å; Q370-W417 HydrophobicContact CB-CZ3 3.86Å; Q370-W417 HydrophobicContact CG-CZ3 4.41Å; I374-W417 HydrophobicContact CD1-CH2 2.95Å; I374-W417 HydrophobicContact CD1-CZ2 3.06Å; I374-W417 HydrophobicContact CD1-CZ3 3.78Å; I374-W417 HydrophobicContact CG1-CH2 4.28Å; Y415-W417 VanDerWaalsContact C-N 3.27Å
418	K	50.1	Low	71.5	Confident	80 Å²	80	47.7 Å²	47.7	35%	0.348	22%	0.216	S	C	.	.			trans	-90.3	0	-177.8	-110.6	-173	-177	-169.5	0	112	R414 Y415	R414-K418 WeakPolarHBondContact O-CB 3.4Å; R414-K418 VanDerWaalsContact O-CG 3.3Å; R414-K418 WeakPolarHBondContact O-CG 3.37Å; R414-K418 PolarHBondContact O-N 3.35Å; Y415-K418 HydrophobicContact CD1-CD 4.15Å; Y415-K418 HydrophobicContact CE1-CD 4.18Å

Retrieved 418 of 418 residues in 114 ms (Link to these results)

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