A0A087YIL4_POEFO Loading...

Thyroid hormone receptor alpha b

AlphaFold DB , UniProt , Accession A0A087YIL4, Species POEFO (Poecilia formosa, Amazon molly), Gene THRA, Length 421 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	33.2	Very low	28.7	Very low	245 Å²	245	167.3 Å²	167.3	100%	1.207	85%	0.847	S	S	*	*				0	112.4	0	-76	169.5	-177.9	0	0	104.6
2	E	31.4	Very low	28.9	Very low	185 Å²	185	162.6 Å²	162.6	86%	0.864	84%	0.837	S	S	*	*			cis	-135.8	124.5	33	-67.9	169.6	124.1	0	0	109.1
3	H	27.9	Very low	28.5	Very low	191 Å²	191	157.2 Å²	157.2	88%	0.884	82%	0.822	S	S	*	*				86	105.2	106.1	-83.3	-28.3	0	0	0	117.4
4	M	24.1	Very low	28.3	Very low	139 Å²	139	160.2 Å²	160.2	69%	0.685	83%	0.83	S	S	*	*			trans	-42.8	-177.7	157.1	-79.2	178	66.1	0	0	116.6	K6	M4-K6 HydrophobicContact CE-CD 3.63Å; M4-K6 HydrophobicContact CE-CG 3.88Å
5	P	39.5	Very low	28.1	Very low	110 Å²	110	154.4 Å²	154.4	71%	0.714	83%	0.825	S	S	*	*			cis	-137.8	156.8	13.7	14.7	14.5	0	0	0	118
6	K	27.5	Very low	27.9	Very low	162 Å²	162	154.7 Å²	154.7	70%	0.704	82%	0.82	S	S	*	*				58.1	107.8	97.3	-71.6	-172.1	174.1	-171.1	0	116.7	M4	M4-K6 HydrophobicContact CE-CD 3.63Å; M4-K6 HydrophobicContact CE-CG 3.88Å
7	E	28.2	Very low	28	Very low	172 Å²	172	157.4 Å²	157.4	80%	0.804	83%	0.827	S	S	*	*				77.4	126.3	87	-91	-174.5	170.4	0	0	115.3
8	Q	25.7	Very low	28	Very low	202 Å²	202	157.6 Å²	157.6	94%	0.944	82%	0.82	S	S	*	*			trans	-161.9	126.8	137.5	-110.6	170.9	16.5	0	0	112.8
9	D	25.8	Very low	27.8	Very low	161 Å²	161	158.8 Å²	158.8	86%	0.861	82%	0.821	S	S	*	*			trans	-65.7	151.8	171.4	-90.3	-46.4	0	0	0	113.8
10	S	25.1	Very low	27.7	Very low	117 Å²	117	163.1 Å²	163.1	82%	0.818	83%	0.826	S	S	*	*			trans	-170.7	114.5	133.4	56.3	0	0	0	0	111.6
11	N	27.8	Very low	27.7	Very low	156 Å²	156	163 Å²	163	83%	0.834	83%	0.827	S	S	*	*			trans	-95.4	151.2	157.6	-133.3	4.4	0	0	0	107.4
12	P	30.4	Very low	27.6	Very low	111 Å²	111	159.4 Å²	159.4	72%	0.721	81%	0.813	S	S	*	*				-153.9	160.6	90.9	38.1	-18.4	0	0	0	118
13	S	24	Very low	27.5	Very low	92 Å²	92	153.3 Å²	153.3	64%	0.643	80%	0.799	S	S	*	*			trans	70	116.8	139	68.7	0	0	0	0	123
14	E	25.4	Very low	27.5	Very low	200 Å²	200	150.3 Å²	150.3	94%	0.935	80%	0.797	S	S	*	*				68.8	124.3	127	-63.9	-175.7	163.9	0	0	120.7
15	G	25	Very low	27.7	Very low	73 Å²	73	153.3 Å²	153.3	75%	0.753	81%	0.806	S	S	*	*			trans	171.8	68	168.2	0	0	0	0	0	114.7
16	E	26.3	Very low	27.1	Very low	159 Å²	159	159.8 Å²	159.8	74%	0.743	82%	0.816	S	S	*	*			trans	42.1	114.8	148.6	-61.3	-175.2	147	0	0	120.6	K18	E16-K18 PolarHBondContact O-N 3.23Å
17	E	29.2	Very low	27.1	Very low	201 Å²	201	161.7 Å²	161.7	94%	0.939	82%	0.824	S	S	*	*			trans	-51.5	118.2	153.6	-77.2	-179.4	132	0	0	111.2
18	K	27.4	Very low	27	Very low	161 Å²	161	165.1 Å²	165.1	70%	0.7	83%	0.83	S	S	*	*			trans	-111.5	93.5	161.1	-74.2	-174.4	-177.4	172.1	0	110.7	E16 W20	E16-K18 PolarHBondContact O-N 3.23Å; K18-W20 PolarHBondContact O-N 3.3Å
19	Q	24.9	Very low	27.1	Very low	180 Å²	180	164.9 Å²	164.9	84%	0.841	83%	0.826	S	S	*	*			trans	-45.9	110.8	160.9	-162.6	166.4	44	0	0	110.8	L21	Q19-L21 PolarHBondContact O-N 3.36Å
20	W	26.1	Very low	27.1	Very low	244 Å²	244	165.2 Å²	165.2	92%	0.924	83%	0.827	S	S	*	*			trans	-79.9	111.6	169.6	-76.5	83.6	0	0	0	109.5	K18	K18-W20 PolarHBondContact O-N 3.3Å
21	L	26.4	Very low	27.3	Very low	162 Å²	162	165 Å²	165	85%	0.848	83%	0.826	S	S	*	*			trans	-55.8	136.9	175.3	-75.6	155.2	0	0	0	112	Q19 G23	Q19-L21 PolarHBondContact O-N 3.36Å; L21-G23 PolarHBondContact O-N 3.09Å; L21-G23 VanDerWaalsContact O-N 3.09Å
22	N	31.1	Very low	27.3	Very low	170 Å²	170	167 Å²	167	91%	0.909	83%	0.831	S	S	*	*			trans	-54.8	106.4	172.1	-82.2	-50.2	0	0	0	112
23	G	29.8	Very low	27.1	Very low	56 Å²	56	167.5 Å²	167.5	58%	0.577	84%	0.835	S	S	*	*			trans	-86.1	147.5	161.6	0	0	0	0	0	111.5	L21 K25	L21-G23 PolarHBondContact O-N 3.09Å; L21-G23 VanDerWaalsContact O-N 3.09Å; G23-K25 PolarHBondContact O-N 3.21Å
24	P	27.9	Very low	27.3	Very low	128 Å²	128	167.8 Å²	167.8	83%	0.831	84%	0.837	S	S	*	*			trans	-68.6	119.1	-171.8	26.3	-32.5	0	0	0	111.8	R26	P24-R26 PolarHBondContact O-N 3.01Å
25	K	27.4	Very low	27.6	Very low	203 Å²	203	164.9 Å²	164.9	88%	0.883	83%	0.832	S	S	*	*			trans	-60.3	102.1	170.4	-71.4	179.5	178.3	175	0	109.9	G23 K27	G23-K25 PolarHBondContact O-N 3.21Å; K25-K27 PolarHBondContact O-N 3.33Å; K25-K27 VanDerWaalsContact O-N 3.16Å
26	R	28.5	Very low	27.9	Very low	246 Å²	246	169.6 Å²	169.6	93%	0.928	83%	0.832	S	S	*	*			trans	-66.4	110.9	167.3	-94.2	-179.3	166.7	173.4	-3.2	109.4	P24 R28	P24-R26 PolarHBondContact O-N 3.01Å; R26-R28 PolarHBondContact O-N 3.24Å
27	K	26.8	Very low	28.2	Very low	201 Å²	201	167.6 Å²	167.6	87%	0.874	84%	0.836	S	S	*	*			trans	-52.5	116.5	170	-79.4	179.6	174.1	177.1	0	110.1	K25 K29	K25-K27 PolarHBondContact O-N 3.33Å; K25-K27 VanDerWaalsContact O-N 3.16Å; K27-K29 PolarHBondContact O-N 2.88Å
28	R	26.5	Very low	28.3	Very low	245 Å²	245	166.4 Å²	166.4	93%	0.925	83%	0.833	S	S	*	*			trans	-66	109.9	161.7	-106.8	176.5	163.4	167.8	-4.8	107.5	R26 N30	R26-R28 PolarHBondContact O-N 3.24Å; R28-N30 PolarHBondContact O-N 3.3Å
29	K	26.8	Very low	28.6	Very low	197 Å²	197	164.7 Å²	164.7	86%	0.857	84%	0.836	S	S	*	*			trans	-70.3	116.4	166.7	-83.4	-177.8	174	-179.8	0	107.9	K27 S31	K27-K29 PolarHBondContact O-N 2.88Å; K29-S31 PolarHBondContact O-N 3.35Å; K29-S31 VanDerWaalsContact O-N 3.15Å
30	N	25.3	Very low	29.2	Very low	167 Å²	167	165.4 Å²	165.4	89%	0.893	84%	0.839	S	S	*	*			trans	-62.6	106.1	164.6	-101.6	-2	0	0	0	108.2	R28	R28-N30 PolarHBondContact O-N 3.3Å
31	S	30.2	Very low	29.4	Very low	112 Å²	112	159 Å²	159	78%	0.783	83%	0.827	S	S	*	*			trans	-86.6	103.8	163	57.6	0	0	0	0	108.1	K29 C33	K29-S31 PolarHBondContact O-N 3.35Å; K29-S31 VanDerWaalsContact O-N 3.15Å; S31-C33 PolarHBondContact O-N 3.32Å
32	Q	28	Very low	29.9	Very low	200 Å²	200	159.8 Å²	159.8	94%	0.935	83%	0.831	S	S	*	*			trans	-59.9	113.8	166.3	-120.3	172.1	-4.9	0	0	108.2	S34	Q32-S34 PolarHBondContact O-N 3.32Å
33	C	27.2	Very low	29.9	Very low	121 Å²	121	158 Å²	158	82%	0.818	82%	0.82	S	S	*	*			trans	-90.9	102.1	172.3	-159.1	0	0	0	0	107.8	S31 V35	S31-C33 PolarHBondContact O-N 3.32Å; C33-V35 PolarHBondContact O-N 2.95Å
34	S	27.7	Very low	30.3	Very low	97 Å²	97	161.9 Å²	161.9	68%	0.678	83%	0.833	S	S	*	*			trans	-72	117.3	170.3	-175	0	0	0	0	108.4	Q32 K36	Q32-S34 PolarHBondContact O-N 3.32Å; S34-K36 PolarHBondContact O-N 3Å
35	V	30.6	Very low	30.8	Very low	139 Å²	139	162.8 Å²	162.8	84%	0.842	83%	0.829	S	S	*	*			trans	-78.6	103.5	174	-169.2	0	0	0	0	106.8	C33	C33-V35 PolarHBondContact O-N 2.95Å
36	K	31.1	Very low	31.9	Very low	172 Å²	172	158.7 Å²	158.7	75%	0.748	82%	0.824	S	S	*	*			trans	-108.6	121.4	162.8	-78.3	-172.3	176.1	-176.9	0	108.3	S34 M38	S34-K36 PolarHBondContact O-N 3Å; K36-M38 PolarHBondContact O-N 3.43Å
37	S	32.8	Very low	33.2	Very low	118 Å²	118	150.1 Å²	150.1	83%	0.825	81%	0.811	S	S	*	*			trans	-46.4	127.8	169.1	-176.8	0	0	0	0	110.2
38	M	32.3	Very low	34.9	Very low	176 Å²	176	149.7 Å²	149.7	87%	0.867	81%	0.806	S	S	*	*			trans	-122.8	115.4	171.9	-75.1	-167	176.8	0	0	109.3	K36	K36-M38 PolarHBondContact O-N 3.43Å
39	T	32.3	Very low	36.7	Very low	125 Å²	125	141.4 Å²	141.4	77%	0.767	78%	0.779	S	S	*	*			trans	-51.6	146.3	165.6	38.8	0	0	0	0	112.1	T41	T39-T41 PolarHBondContact O-N 3.42Å; T39-T41 VanDerWaalsContact O-N 3.16Å
40	E	38.2	Very low	38.8	Very low	195 Å²	195	132.3 Å²	132.3	91%	0.911	74%	0.74	S	S	*	*			trans	-52.1	113.7	177	-74.7	175.1	137.7	0	0	112
41	T	29.7	Very low	41.2	Very low	108 Å²	108	130.4 Å²	130.4	66%	0.663	74%	0.74	S	S	*	*			trans	-141.8	119.8	158	-49.8	0	0	0	0	106.2	T39 I43	T39-T41 PolarHBondContact O-N 3.42Å; T39-T41 VanDerWaalsContact O-N 3.16Å; T41-I43 VanDerWaalsContact C-N 3.3Å; T41-I43 PolarHBondContact O-N 2.92Å
42	L	38	Very low	43.4	Very low	179 Å²	179	132 Å²	132	94%	0.937	73%	0.729	S	S	*	*			trans	-63	90.3	176.3	-88.5	87.3	0	0	0	109.5
43	I	31.7	Very low	45.8	Very low	132 Å²	132	123.1 Å²	123.1	68%	0.677	69%	0.689	S	S	*	*			trans	-95.2	108.6	167.7	-59.7	172.9	0	0	0	106.6	T41 I45	T41-I43 VanDerWaalsContact C-N 3.3Å; T41-I43 PolarHBondContact O-N 2.92Å; I43-I45 PolarHBondContact O-N 3.25Å
44	T	36.8	Very low	48.1	Very low	139 Å²	139	124.9 Å²	124.9	85%	0.853	69%	0.685	S	S	*	*			trans	-62.1	98.6	167	7.6	0	0	0	0	108.4	P46	T44-P46 WeakPolarHBondContact O-CD 3.41Å
45	I	38.9	Very low	50.3	Low	147 Å²	147	128.7 Å²	128.7	75%	0.754	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-63.6	121.8	178.8	-56.9	173.7	0	0	0	108.4	I43 G47	I43-I45 PolarHBondContact O-N 3.25Å; I45-G47 PolarHBondContact O-N 3.27Å
46	P	51.5	Low	52.6	Low	117 Å²	117	127.1 Å²	127.1	76%	0.76	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-60.6	126.4	172.3	22.6	-29.2	0	0	0	109	T44 Y48	T44-P46 WeakPolarHBondContact O-CD 3.41Å; P46-Y48 PolarHBondContact O-N 3.5Å
47	G	55.8	Low	55.4	Low	65 Å²	65	121.6 Å²	121.6	67%	0.67	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-50.9	125.4	-172.4	0	0	0	0	0	112.1	I45 I49	I45-G47 PolarHBondContact O-N 3.27Å; G47-I49 PolarHBondContact O-N 3.37Å; G47-I49 VanDerWaalsContact O-N 3.1Å
48	Y	62.1	Low	58.3	Low	193 Å²	193	119.6 Å²	119.6	76%	0.757	64%	0.637	S	S	*	*			trans	-55.3	114.2	176.1	174.6	-100.1	0	0	0	110.2	P46 P50	P46-Y48 PolarHBondContact O-N 3.5Å; Y48-P50 HydrophobicContact CD1-CG 4.26Å; Y48-P50 HydrophobicContact CE1-CB 4.17Å; Y48-P50 HydrophobicContact CE1-CG 3.86Å
49	I	64	Low	61.4	Low	70 Å²	70	111.4 Å²	111.4	36%	0.359	60%	0.597	S	S	.	*			trans	-99.2	116.7	169.7	-60.5	176.9	0	0	0	106.5	G47 L53	G47-I49 PolarHBondContact O-N 3.37Å; G47-I49 VanDerWaalsContact O-N 3.1Å; I49-L53 HydrophobicContact CG2-CB 4.09Å; I49-L53 HydrophobicContact CG2-CD2 4.19Å
50	P	71.4	Confident	64.4	Low	6 Å²	6	108.7 Å²	108.7	4%	0.039	58%	0.58	C	S	.	*			trans	-59.6	143	177.8	-20.4	30.5	0	0	0	111.5	Y48 Y52 L53	Y48-P50 HydrophobicContact CD1-CG 4.26Å; Y48-P50 HydrophobicContact CE1-CB 4.17Å; Y48-P50 HydrophobicContact CE1-CG 3.86Å; P50-Y52 HydrophobicContact CB-CD1 3.86Å; P50-Y52 HydrophobicContact CB-CD2 3.97Å; P50-Y52 HydrophobicContact CB-CE1 3.35Å; P50-Y52 HydrophobicContact CB-CE2 3.43Å; P50-Y52 VanDerWaalsContact CB-CE2 3.43Å; P50-Y52 HydrophobicContact CB-CG 4.17Å; P50-Y52 WeakPolarHBondContact CB-OH 3.48Å; P50-Y52 HydrophobicContact CG-CE1 4.31Å; P50-Y52 HydrophobicContact CG-CE2 3.9Å; P50-Y52 WeakPolarHBondContact CG-OH 3.33Å; P50-Y52 PolarHBondContact O-N 3.02Å; P50-L53 WeakPolarHBondContact O-CB 3.27Å; P50-L53 PolarHBondContact O-N 3.48Å
51	S	74.1	Confident	67.3	Low	128 Å²	128	99.5 Å²	99.5	90%	0.895	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-12.7	-174.4	60	0	0	0	0	115.3
52	Y	77.7	Confident	70.5	Confident	144 Å²	144	94.6 Å²	94.6	57%	0.565	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-1.6	176.5	53.1	-106.8	0	0	0	113.5	P50 Y69	P50-Y52 HydrophobicContact CB-CD1 3.86Å; P50-Y52 HydrophobicContact CB-CD2 3.97Å; P50-Y52 HydrophobicContact CB-CE1 3.35Å; P50-Y52 HydrophobicContact CB-CE2 3.43Å; P50-Y52 VanDerWaalsContact CB-CE2 3.43Å; P50-Y52 HydrophobicContact CB-CG 4.17Å; P50-Y52 WeakPolarHBondContact CB-OH 3.48Å; P50-Y52 HydrophobicContact CG-CE1 4.31Å; P50-Y52 HydrophobicContact CG-CE2 3.9Å; P50-Y52 WeakPolarHBondContact CG-OH 3.33Å; P50-Y52 PolarHBondContact O-N 3.02Å; Y52-Y69 AromaticContact CD2-CD2 3.86Å; Y52-Y69 HydrophobicContact CD2-CD2 3.86Å; Y52-Y69 AromaticContact CD2-CE2 3.99Å; Y52-Y69 HydrophobicContact CD2-CE2 3.99Å; Y52-Y69 AromaticContact CE2-CD2 3.65Å; Y52-Y69 HydrophobicContact CE2-CD2 3.65Å; Y52-Y69 HydrophobicContact CE2-CE2 4.26Å
53	L	77.4	Confident	73.2	Confident	15 Å²	15	88.6 Å²	88.6	8%	0.079	49%	0.489	C	S	.	.	S	Bend	trans	-106.9	129.8	179.6	-155.7	88.6	0	0	0	108.7	I49 P50 E57 Y69 I74	I49-L53 HydrophobicContact CG2-CB 4.09Å; I49-L53 HydrophobicContact CG2-CD2 4.19Å; P50-L53 WeakPolarHBondContact O-CB 3.27Å; P50-L53 PolarHBondContact O-N 3.48Å; L53-E57 VanDerWaalsContact CD1-OE2 3.27Å; L53-E57 WeakPolarHBondContact CD1-OE2 3.45Å; L53-E57 HydrophobicContact CG-CB 4.27Å; L53-E57 WeakPolarHBondContact CG-OE2 3.47Å; L53-Y69 HydrophobicContact CD1-CD2 4.44Å; L53-Y69 HydrophobicContact CD1-CE2 4.36Å; L53-I74 HydrophobicContact CD1-CD1 4.43Å; L53-I74 HydrophobicContact CD1-CG1 4.42Å; L53-I74 HydrophobicContact CD1-CG2 3.97Å
54	E	76.4	Confident	76.3	Confident	157 Å²	157	83.5 Å²	83.5	73%	0.734	46%	0.463	S	S	*	.			trans	-70.4	151.9	173.6	-67.8	-173.2	-179.2	0	0	110.4	D56 E57	E54-D56 PolarHBondContact O-N 3.2Å; E54-E57 PolarHBondContact O-N 3.09Å
55	K	73	Confident	79	Confident	178 Å²	178	82.1 Å²	82.1	77%	0.774	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	130.4	177.4	-78.3	-176.1	179	179.2	0	109	E57	K55-E57 VanDerWaalsContact C-N 3.33Å; K55-E57 PolarHBondContact O-N 3.16Å
56	D	79.6	Confident	81.7	Confident	106 Å²	106	75.4 Å²	75.4	57%	0.567	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	24.5	177	-55	-52.4	0	0	0	115.7	E54 K65	E54-D56 PolarHBondContact O-N 3.2Å; D56-K65 VanDerWaalsContact OD1-CE 3.26Å; D56-K65 WeakPolarHBondContact OD1-CE 3.49Å; D56-K65 IonicContact OD1-NZ 3.87Å; D56-K65 PolarHBondContact OD1-NZ 3.13Å
57	E	89.3	Confident	83.6	Confident	55 Å²	55	72.3 Å²	72.3	26%	0.257	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-59.1	129	173.1	-159.6	165	-171.4	0	0	111.6	L53 E54 K55 A66 I74	L53-E57 VanDerWaalsContact CD1-OE2 3.27Å; L53-E57 WeakPolarHBondContact CD1-OE2 3.45Å; L53-E57 HydrophobicContact CG-CB 4.27Å; L53-E57 WeakPolarHBondContact CG-OE2 3.47Å; E54-E57 PolarHBondContact O-N 3.09Å; K55-E57 VanDerWaalsContact C-N 3.33Å; K55-E57 PolarHBondContact O-N 3.16Å; E57-A66 WeakPolarHBondContact O-CB 3.48Å; E57-A66 PolarHBondContact O-N 3.21Å; E57-I74 HydrophobicContact CG-CD1 4.34Å; E57-I74 HydrophobicContact CG-CG2 4.04Å; E57-I74 WeakPolarHBondContact OE1-CD1 3.36Å
58	P	94.4	Very high	85.3	Confident	77 Å²	77	69.3 Å²	69.3	50%	0.5	36%	0.36	S	S	.	.	B	Isolated β-bridge	trans	-80.1	143.7	-174.8	30.5	-34.2	0	0	0	111.9	V60	P58-V60 PolarHBondContact O-N 2.97Å
59	C	96.7	Very high	86.8	Confident	3 Å²	3	66 Å²	66	2%	0.02	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-63.1	120.2	171.6	172.8	0	0	0	0	110.2	V61 C62 G63 D64 T75 C76	C59-V61 PolarHBondContact O-N 3.48Å; C59-C62 PolarHBondContact O-N 3.48Å; C59-C62 VanDerWaalsContact SG-SG 3.68Å; C59-G63 WeakPolarHBondContact O-CA 3.38Å; C59-G63 PolarHBondContact O-N 3.39Å; C59-D64 WeakPolarHBondContact CA-O 3.26Å; C59-D64 WeakPolarHBondContact CB-O 3.33Å; C59-D64 PolarHBondContact N-O 3.36Å; C59-T75 VanDerWaalsContact SG-CA 3.59Å; C59-C76 HydrophobicContact CB-CB 3.99Å; C59-C76 PolarHBondContact SG-N 3.32Å; C59-C76 VanDerWaalsContact SG-SG 3.69Å
60	V	96.8	Very high	88.3	Confident	68 Å²	68	63.9 Å²	63.9	41%	0.412	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-13.8	-176.7	-57.9	0	0	0	0	114.2	P58 C73 I74 T75 V124	P58-V60 PolarHBondContact O-N 2.97Å; V60-C73 HydrophobicContact CG2-CB 4.08Å; V60-I74 HydrophobicContact CG1-CB 4.43Å; V60-I74 WeakPolarHBondContact CG2-O 3.33Å; V60-I74 PolarHBondContact N-O 3.43Å; V60-T75 HydrophobicContact CG2-CG2 4.35Å; V60-V124 HydrophobicContact CB-CG1 4.47Å; V60-V124 HydrophobicContact CG2-CB 3.86Å; V60-V124 HydrophobicContact CG2-CG1 4.24Å; V60-V124 HydrophobicContact CG2-CG2 3.79Å
61	V	97.9	Very high	89.5	Confident	3 Å²	3	65.5 Å²	65.5	2%	0.018	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-43.5	178.2	179.7	0	0	0	0	112.8	C59 T75 C79 I105 R117 K120 V124 M126	C59-V61 PolarHBondContact O-N 3.48Å; V61-T75 HydrophobicContact CG2-CG2 4.17Å; V61-C79 HydrophobicContact CB-CB 4.17Å; V61-C79 HydrophobicContact CG1-CB 4.33Å; V61-C79 HydrophobicContact CG2-CB 4.33Å; V61-I105 HydrophobicContact CG1-CG2 4.18Å; V61-I105 WeakPolarHBondContact O-CG2 3.24Å; V61-R117 HydrophobicContact CG1-CG 4.47Å; V61-K120 HydrophobicContact CG1-CB 4.43Å; V61-K120 HydrophobicContact CG1-CG 4.12Å; V61-V124 HydrophobicContact CG2-CG2 3.81Å; V61-M126 HydrophobicContact CG2-SD 4.16Å
62	C	97	Very high	90.4	Very high	4 Å²	4	67.9 Å²	67.9	3%	0.027	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.6	3.1	-167.3	70.2	0	0	0	0	114.9	C59 D64 C76 I105 D106 K107 R110	C59-C62 PolarHBondContact O-N 3.48Å; C59-C62 VanDerWaalsContact SG-SG 3.68Å; C62-D64 PolarHBondContact O-N 2.79Å; C62-D64 VanDerWaalsContact O-N 3.08Å; C62-C76 VanDerWaalsContact SG-SG 3.64Å; C62-I105 HydrophobicContact CB-CG2 4.04Å; C62-D106 CarbonylContact O-C 3.56Å; C62-D106 VanDerWaalsContact O-CA 3.29Å; C62-D106 WeakPolarHBondContact O-CA 3.43Å; C62-K107 PolarHBondContact O-N 3.32Å; C62-R110 HydrophobicContact CB-CB 4.15Å; C62-R110 PolarHBondContact SG-NH1 3.14Å; C62-R110 VanDerWaalsContact SG-NH1 3.36Å
63	G	95.6	Very high	91.2	Very high	53 Å²	53	61.5 Å²	61.5	55%	0.546	31%	0.307	S	S	.	.	S	Bend	trans	71.8	-4.7	179.7	0	0	0	0	0	116	C59	C59-G63 WeakPolarHBondContact O-CA 3.38Å; C59-G63 PolarHBondContact O-N 3.39Å
64	D	95.6	Very high	92.1	Very high	26 Å²	26	61.5 Å²	61.5	14%	0.139	31%	0.307	C	S	.	.	S	Bend	trans	-67.1	162.1	173.6	-163.8	14.7	0	0	0	111.8	C59 C62 A66 C76 K107 R110	C59-D64 WeakPolarHBondContact CA-O 3.26Å; C59-D64 WeakPolarHBondContact CB-O 3.33Å; C59-D64 PolarHBondContact N-O 3.36Å; C62-D64 PolarHBondContact O-N 2.79Å; C62-D64 VanDerWaalsContact O-N 3.08Å; D64-A66 PolarHBondContact O-N 3.11Å; D64-C76 HydrophobicContact CB-CB 4.23Å; D64-K107 HydrophobicContact CB-CB 4.28Å; D64-K107 HydrophobicContact CB-CD 4.33Å; D64-K107 HydrophobicContact CB-CG 4.09Å; D64-K107 WeakPolarHBondContact OD1-CD 3.36Å; D64-K107 VanDerWaalsContact OD1-CE 3.23Å; D64-K107 WeakPolarHBondContact OD1-CE 3.41Å; D64-K107 IonicContact OD1-NZ 2.75Å; D64-R110 IonicContact OD2-CZ 3.16Å; D64-R110 IonicContact OD2-NH1 3.31Å; D64-R110 PolarHBondContact OD2-NH1 3.42Å; D64-R110 IonicContact OD2-NH2 2.85Å; D64-R110 PolarHBondContact OD2-NH2 2.97Å
65	K	94.4	Very high	93	Very high	109 Å²	109	54 Å²	54	47%	0.474	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-59.4	121.6	-177.5	-175.3	166.9	178.6	154.6	0	111.6	D56 C76	D56-K65 VanDerWaalsContact OD1-CE 3.26Å; D56-K65 WeakPolarHBondContact OD1-CE 3.49Å; D56-K65 IonicContact OD1-NZ 3.87Å; D56-K65 PolarHBondContact OD1-NZ 3.13Å; K65-C76 WeakPolarHBondContact O-CB 3.44Å
66	A	94.8	Very high	94.1	Very high	7 Å²	7	45.7 Å²	45.7	6%	0.058	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-72.6	150.3	178.9	0	0	0	0	0	111.6	E57 D64 I74 T75	E57-A66 WeakPolarHBondContact O-CB 3.48Å; E57-A66 PolarHBondContact O-N 3.21Å; D64-A66 PolarHBondContact O-N 3.11Å; A66-I74 HydrophobicContact CB-CG2 3.4Å; A66-T75 WeakPolarHBondContact CA-O 3.48Å
67	T	92.6	Very high	94.9	Very high	52 Å²	52	45.2 Å²	45.2	32%	0.319	23%	0.23	S	C	.	.			trans	-112	-1.1	176.5	59.2	0	0	0	0	112.9	H70 T75 E77	T67-H70 PolarHBondContact OG1-NE2 3.49Å; T67-T75 PolarHBondContact N-O 2.96Å; T67-E77 HydrophobicContact CG2-CG 3.83Å; T67-E77 PolarHBondContact OG1-OE1 3.11Å
68	G	91.8	Very high	95.2	Very high	2 Å²	2	43.9 Å²	43.9	2%	0.021	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	146.3	-174	179.7	0	0	0	0	0	113.3	H70 I74 T75	G68-H70 PolarHBondContact O-CD2 2.87Å; G68-I74 WeakPolarHBondContact O-CA 3.21Å; G68-T75 PolarHBondContact O-N 3.36Å
69	Y	93.4	Very high	95.4	Very high	122 Å²	122	40.2 Å²	40.2	48%	0.478	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	118	168.7	-75.9	-96.4	0	0	0	110.2	Y52 L53 C73 I74	Y52-Y69 AromaticContact CD2-CD2 3.86Å; Y52-Y69 HydrophobicContact CD2-CD2 3.86Å; Y52-Y69 AromaticContact CD2-CE2 3.99Å; Y52-Y69 HydrophobicContact CD2-CE2 3.99Å; Y52-Y69 AromaticContact CE2-CD2 3.65Å; Y52-Y69 HydrophobicContact CE2-CD2 3.65Å; Y52-Y69 HydrophobicContact CE2-CE2 4.26Å; L53-Y69 HydrophobicContact CD1-CD2 4.44Å; L53-Y69 HydrophobicContact CD1-CE2 4.36Å; Y69-C73 CarbonylContact C-O 3.48Å; Y69-C73 WeakPolarHBondContact CA-O 3.48Å; Y69-I74 HydrophobicContact CD1-CG1 3.96Å; Y69-I74 HydrophobicContact CD2-CG1 4.15Å; Y69-I74 HydrophobicContact CE1-CD1 4.11Å; Y69-I74 HydrophobicContact CE1-CG1 3.57Å; Y69-I74 HydrophobicContact CE2-CD1 3.98Å; Y69-I74 HydrophobicContact CE2-CG1 3.78Å; Y69-I74 HydrophobicContact CG-CG1 4.24Å; Y69-I74 VanDerWaalsContact CZ-CG1 3.48Å; Y69-I74 WeakPolarHBondContact OH-CD1 2.96Å
70	H	94.8	Very high	95.4	Very high	27 Å²	27	42.6 Å²	42.6	13%	0.125	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	123.1	174.7	-57.1	-67.3	0	0	0	108.6	T67 G68 R72 C73 T75 E77 K80	T67-H70 PolarHBondContact OG1-NE2 3.49Å; G68-H70 PolarHBondContact O-CD2 2.87Å; H70-R72 PolarHBondContact O-N 3.03Å; H70-C73 PolarHBondContact N-O 3.49Å; H70-C73 PolarHBondContact O-N 3.42Å; H70-C73 VanDerWaalsContact O-N 3.12Å; H70-T75 WeakPolarHBondContact CB-OG1 3.26Å; H70-T75 PolarHBondContact CD2-O 3.24Å; H70-T75 PolarHBondContact CD2-OG1 3.5Å; H70-T75 VanDerWaalsContact CD2-OG1 3.27Å; H70-E77 IonicContact CE1-OE1 3.53Å; H70-E77 IonicContact NE2-OE1 3.48Å; H70-E77 PolarHBondContact NE2-OE1 3.34Å; H70-K80 HydrophobicContact CB-CB 3.94Å; H70-K80 HydrophobicContact CB-CD 4.36Å; H70-K80 HydrophobicContact CB-CG 3.8Å; H70-K80 PolarHBondContact CE1-NZ 3.45Å; H70-K80 VanDerWaalsContact ND1-CD 3.34Å; H70-K80 WeakPolarHBondContact ND1-CD 3.39Å; H70-K80 WeakPolarHBondContact ND1-CE 3.35Å
71	Y	95.8	Very high	95.4	Very high	39 Å²	39	39.9 Å²	39.9	15%	0.153	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	42.7	-178	-45.1	-74	0	0	0	112.5	C73 K80 F83 R84 M126 A127 L130 V131	Y71-C73 PolarHBondContact O-N 3.49Å; Y71-K80 HydrophobicContact CE2-CG 3.92Å; Y71-F83 AromaticContact CD2-CD1 3.69Å; Y71-F83 HydrophobicContact CD2-CD1 3.69Å; Y71-F83 HydrophobicContact CD2-CE1 4.32Å; Y71-F83 HydrophobicContact CE2-CD1 4.11Å; Y71-F83 AromaticContact CG-CD1 3.91Å; Y71-F83 HydrophobicContact CG-CD1 3.91Å; Y71-F83 HydrophobicContact CG-CE1 4.08Å; Y71-R84 HydrophobicContact CE2-CB 4.42Å; Y71-R84 VanDerWaalsContact OH-CB 3.3Å; Y71-R84 WeakPolarHBondContact OH-CB 3.43Å; Y71-R84 WeakPolarHBondContact OH-CD 3.43Å; Y71-R84 WeakPolarHBondContact OH-CG 3.49Å; Y71-M126 HydrophobicContact CD2-CE 3.56Å; Y71-M126 HydrophobicContact CE2-CE 4.47Å; Y71-M126 HydrophobicContact CG-CE 4.31Å; Y71-M126 WeakPolarHBondContact O-CA 3.14Å; Y71-A127 PolarHBondContact O-N 3.1Å; Y71-L130 HydrophobicContact CD1-CB 3.93Å; Y71-V131 HydrophobicContact CD1-CG2 3.79Å; Y71-V131 HydrophobicContact CE1-CB 4.34Å; Y71-V131 HydrophobicContact CE1-CG2 3.55Å
72	R	94.1	Very high	95.5	Very high	178 Å²	178	40.3 Å²	40.3	67%	0.672	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	76	-2	-177.4	-53	-177.4	178.8	-95.6	1.7	117.5	H70 A127 L130	H70-R72 PolarHBondContact O-N 3.03Å; R72-A127 HydrophobicContact CG-CB 4.12Å; R72-L130 HydrophobicContact CG-CD1 3.69Å
73	C	94.9	Very high	95.5	Very high	10 Å²	10	40.1 Å²	40.1	7%	0.068	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	148.9	-179	-58.4	0	0	0	0	112.5	V60 Y69 H70 Y71 T75 V124 G125 M126	V60-C73 HydrophobicContact CG2-CB 4.08Å; Y69-C73 CarbonylContact C-O 3.48Å; Y69-C73 WeakPolarHBondContact CA-O 3.48Å; H70-C73 PolarHBondContact N-O 3.49Å; H70-C73 PolarHBondContact O-N 3.42Å; H70-C73 VanDerWaalsContact O-N 3.12Å; Y71-C73 PolarHBondContact O-N 3.49Å; C73-T75 HydrophobicContact CB-CG2 3.87Å; C73-T75 PolarHBondContact O-N 3.07Å; C73-V124 PolarHBondContact SG-O 3.08Å; C73-G125 PolarHBondContact SG-O 3.36Å; C73-M126 HydrophobicContact CB-CG 3.95Å; C73-M126 PolarHBondContact SG-N 2.76Å; C73-M126 VanDerWaalsContact SG-N 3.37Å
74	I	94.8	Very high	95.5	Very high	16 Å²	16	42.6 Å²	42.6	8%	0.082	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	106.6	173.8	-58.1	178.9	0	0	0	109	L53 E57 V60 A66 G68 Y69	L53-I74 HydrophobicContact CD1-CD1 4.43Å; L53-I74 HydrophobicContact CD1-CG1 4.42Å; L53-I74 HydrophobicContact CD1-CG2 3.97Å; E57-I74 HydrophobicContact CG-CD1 4.34Å; E57-I74 HydrophobicContact CG-CG2 4.04Å; E57-I74 WeakPolarHBondContact OE1-CD1 3.36Å; V60-I74 HydrophobicContact CG1-CB 4.43Å; V60-I74 WeakPolarHBondContact CG2-O 3.33Å; V60-I74 PolarHBondContact N-O 3.43Å; A66-I74 HydrophobicContact CB-CG2 3.4Å; G68-I74 WeakPolarHBondContact O-CA 3.21Å; Y69-I74 HydrophobicContact CD1-CG1 3.96Å; Y69-I74 HydrophobicContact CD2-CG1 4.15Å; Y69-I74 HydrophobicContact CE1-CD1 4.11Å; Y69-I74 HydrophobicContact CE1-CG1 3.57Å; Y69-I74 HydrophobicContact CE2-CD1 3.98Å; Y69-I74 HydrophobicContact CE2-CG1 3.78Å; Y69-I74 HydrophobicContact CG-CG1 4.24Å; Y69-I74 VanDerWaalsContact CZ-CG1 3.48Å; Y69-I74 WeakPolarHBondContact OH-CD1 2.96Å
75	T	96.6	Very high	95.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	160.8	-173.7	65.1	0	0	0	0	112.4	C59 V60 V61 A66 T67 G68 H70 C73 M126	C59-T75 VanDerWaalsContact SG-CA 3.59Å; V60-T75 HydrophobicContact CG2-CG2 4.35Å; V61-T75 HydrophobicContact CG2-CG2 4.17Å; A66-T75 WeakPolarHBondContact CA-O 3.48Å; T67-T75 PolarHBondContact N-O 2.96Å; G68-T75 PolarHBondContact O-N 3.36Å; H70-T75 WeakPolarHBondContact CB-OG1 3.26Å; H70-T75 PolarHBondContact CD2-O 3.24Å; H70-T75 PolarHBondContact CD2-OG1 3.5Å; H70-T75 VanDerWaalsContact CD2-OG1 3.27Å; C73-T75 HydrophobicContact CB-CG2 3.87Å; C73-T75 PolarHBondContact O-N 3.07Å; T75-M126 HydrophobicContact CG2-CE 4.18Å; T75-M126 HydrophobicContact CG2-SD 4.07Å
76	C	95.8	Very high	95.6	Very high	3 Å²	3	42 Å²	42	2%	0.02	19%	0.189	C	C	.	.			trans	-80.1	161.5	169.6	68.2	0	0	0	0	111.2	C59 C62 D64 K65 G78 C79 K80 R110	C59-C76 HydrophobicContact CB-CB 3.99Å; C59-C76 PolarHBondContact SG-N 3.32Å; C59-C76 VanDerWaalsContact SG-SG 3.69Å; C62-C76 VanDerWaalsContact SG-SG 3.64Å; D64-C76 HydrophobicContact CB-CB 4.23Å; K65-C76 WeakPolarHBondContact O-CB 3.44Å; C76-G78 PolarHBondContact O-N 3.31Å; C76-G78 VanDerWaalsContact O-N 3.13Å; C76-C79 PolarHBondContact O-N 3.42Å; C76-C79 VanDerWaalsContact O-N 3.12Å; C76-C79 PolarHBondContact SG-N 3.12Å; C76-K80 PolarHBondContact O-N 2.81Å; C76-R110 PolarHBondContact SG-NH1 2.91Å; C76-R110 VanDerWaalsContact SG-NH1 3.37Å
77	E	95.6	Very high	95.6	Very high	95 Å²	95	43.4 Å²	43.4	44%	0.444	20%	0.195	S	C	.	.	H	α-helix	trans	-56.4	-30.8	175.6	-72.6	-58.9	130.2	0	0	112.9	T67 H70 K80 G81	T67-E77 HydrophobicContact CG2-CG 3.83Å; T67-E77 PolarHBondContact OG1-OE1 3.11Å; H70-E77 IonicContact CE1-OE1 3.53Å; H70-E77 IonicContact NE2-OE1 3.48Å; H70-E77 PolarHBondContact NE2-OE1 3.34Å; E77-K80 IonicContact OE1-NZ 2.79Å; E77-K80 PolarHBondContact OE1-NZ 3.27Å; E77-K80 WeakPolarHBondContact OE2-CD 3.32Å; E77-K80 IonicContact OE2-NZ 2.64Å; E77-K80 PolarHBondContact OE2-NZ 3.19Å; E77-G81 PolarHBondContact O-N 3.05Å
78	G	97	Very high	95.5	Very high	27 Å²	27	43.3 Å²	43.3	28%	0.278	19%	0.191	S	C	.	.	H	α-helix	trans	-62.7	-46.8	176.9	0	0	0	0	0	112.8	C76 F82 R117	C76-G78 PolarHBondContact O-N 3.31Å; C76-G78 VanDerWaalsContact O-N 3.13Å; G78-F82 WeakPolarHBondContact O-CB 3.39Å; G78-F82 PolarHBondContact O-N 2.95Å; G78-R117 PolarHBondContact O-NH2 3.12Å
79	C	98.1	Very high	95.5	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-77.8	-36.8	-179.6	-68.9	0	0	0	0	112.2	V61 C76 G81 F82 F83 R117	V61-C79 HydrophobicContact CB-CB 4.17Å; V61-C79 HydrophobicContact CG1-CB 4.33Å; V61-C79 HydrophobicContact CG2-CB 4.33Å; C76-C79 PolarHBondContact O-N 3.42Å; C76-C79 VanDerWaalsContact O-N 3.12Å; C76-C79 PolarHBondContact SG-N 3.12Å; C79-G81 PolarHBondContact O-N 3.04Å; C79-F82 PolarHBondContact O-N 3.25Å; C79-F83 VanDerWaalsContact O-CB 3.3Å; C79-F83 WeakPolarHBondContact O-CB 3.35Å; C79-F83 PolarHBondContact O-N 2.82Å; C79-R117 PolarHBondContact SG-NH2 3.43Å
80	K	97.3	Very high	95.5	Very high	54 Å²	54	49.4 Å²	49.4	24%	0.235	22%	0.224	C	C	.	.	H	α-helix	trans	-54.7	-51.1	167.9	173.1	-157.7	-169.3	178.3	0	112	H70 Y71 C76 E77 R84	H70-K80 HydrophobicContact CB-CB 3.94Å; H70-K80 HydrophobicContact CB-CD 4.36Å; H70-K80 HydrophobicContact CB-CG 3.8Å; H70-K80 PolarHBondContact CE1-NZ 3.45Å; H70-K80 VanDerWaalsContact ND1-CD 3.34Å; H70-K80 WeakPolarHBondContact ND1-CD 3.39Å; H70-K80 WeakPolarHBondContact ND1-CE 3.35Å; Y71-K80 HydrophobicContact CE2-CG 3.92Å; C76-K80 PolarHBondContact O-N 2.81Å; E77-K80 IonicContact OE1-NZ 2.79Å; E77-K80 PolarHBondContact OE1-NZ 3.27Å; E77-K80 WeakPolarHBondContact OE2-CD 3.32Å; E77-K80 IonicContact OE2-NZ 2.64Å; E77-K80 PolarHBondContact OE2-NZ 3.19Å; K80-R84 WeakPolarHBondContact O-CB 3.37Å; K80-R84 PolarHBondContact O-N 3.22Å
81	G	96.8	Very high	95.5	Very high	10 Å²	10	50.7 Å²	50.7	10%	0.103	23%	0.232	C	C	.	.	H	α-helix	trans	-66.9	-40.2	-178.3	0	0	0	0	0	112.7	E77 C79 R85	E77-G81 PolarHBondContact O-N 3.05Å; C79-G81 PolarHBondContact O-N 3.04Å; G81-R85 WeakPolarHBondContact O-CG 3.49Å; G81-R85 PolarHBondContact O-N 2.95Å; G81-R85 VanDerWaalsContact O-N 3.13Å; G81-R85 PolarHBondContact O-NH1 3.31Å
82	F	98.1	Very high	95.3	Very high	12 Å²	12	52 Å²	52	5%	0.053	24%	0.239	C	C	.	.	H	α-helix	trans	-59	-57.7	172.8	171.9	-101.3	0	0	0	111	G78 C79 R84 R85 T86 Y95 Q114 R117 F118	G78-F82 WeakPolarHBondContact O-CB 3.39Å; G78-F82 PolarHBondContact O-N 2.95Å; C79-F82 PolarHBondContact O-N 3.25Å; F82-R84 VanDerWaalsContact C-N 3.32Å; F82-R84 PolarHBondContact O-N 2.76Å; F82-R85 PolarHBondContact O-N 2.94Å; F82-R85 VanDerWaalsContact O-N 3.11Å; F82-T86 PolarHBondContact O-N 3.42Å; F82-T86 PolarHBondContact O-OG1 3.35Å; F82-Y95 HydrophobicContact CE2-CE2 4.1Å; F82-Y95 AromaticContact CZ-CE2 3.84Å; F82-Y95 HydrophobicContact CZ-CE2 3.84Å; F82-Q114 HydrophobicContact CE2-CB 4.26Å; F82-Q114 HydrophobicContact CE2-CG 4.29Å; F82-Q114 HydrophobicContact CZ-CB 4.39Å; F82-Q114 WeakPolarHBondContact CZ-O 3.35Å; F82-R117 HydrophobicContact CD1-CG 4.11Å; F82-R117 HydrophobicContact CE1-CB 4.07Å; F82-R117 HydrophobicContact CE1-CG 3.88Å; F82-R117 HydrophobicContact CZ-CB 4.15Å; F82-R117 HydrophobicContact CZ-CG 4.33Å; F82-F118 HydrophobicContact CE1-CB 3.88Å; F82-F118 HydrophobicContact CE1-CD2 4.38Å; F82-F118 HydrophobicContact CZ-CB 3.98Å
83	F	97.6	Very high	95.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-54.9	-46.5	-178.8	-170.6	-101.3	0	0	0	112.1	Y71 C79 R85 T86 I87 F118 C121 I122 M126 M128 V131	Y71-F83 AromaticContact CD2-CD1 3.69Å; Y71-F83 HydrophobicContact CD2-CD1 3.69Å; Y71-F83 HydrophobicContact CD2-CE1 4.32Å; Y71-F83 HydrophobicContact CE2-CD1 4.11Å; Y71-F83 AromaticContact CG-CD1 3.91Å; Y71-F83 HydrophobicContact CG-CD1 3.91Å; Y71-F83 HydrophobicContact CG-CE1 4.08Å; C79-F83 VanDerWaalsContact O-CB 3.3Å; C79-F83 WeakPolarHBondContact O-CB 3.35Å; C79-F83 PolarHBondContact O-N 2.82Å; F83-R85 PolarHBondContact O-N 2.98Å; F83-T86 PolarHBondContact O-N 3.49Å; F83-I87 HydrophobicContact CD1-CG1 4.46Å; F83-I87 HydrophobicContact CE1-CG1 4.18Å; F83-I87 HydrophobicContact CE2-CG1 4.49Å; F83-I87 HydrophobicContact CZ-CG1 4.2Å; F83-I87 WeakPolarHBondContact O-CG1 3.42Å; F83-I87 PolarHBondContact O-N 3.15Å; F83-I87 VanDerWaalsContact O-N 3.07Å; F83-F118 HydrophobicContact CD2-CD2 4.31Å; F83-F118 HydrophobicContact CD2-CE2 4.05Å; F83-F118 AromaticContact CE2-CE2 3.9Å; F83-F118 HydrophobicContact CE2-CE2 3.9Å; F83-C121 HydrophobicContact CD2-CB 3.58Å; F83-C121 HydrophobicContact CE2-CB 4Å; F83-I122 HydrophobicContact CE2-CD1 3.75Å; F83-I122 HydrophobicContact CZ-CD1 4.18Å; F83-M126 HydrophobicContact CB-CE 3.63Å; F83-M126 HydrophobicContact CB-SD 4.08Å; F83-M126 HydrophobicContact CD1-CB 4.25Å; F83-M126 HydrophobicContact CD1-CE 3.77Å; F83-M126 HydrophobicContact CD2-CB 3.94Å; F83-M126 HydrophobicContact CD2-CE 4.23Å; F83-M126 HydrophobicContact CD2-SD 3.95Å; F83-M126 HydrophobicContact CE1-CB 3.89Å; F83-M126 HydrophobicContact CE1-CE 4.48Å; F83-M126 HydrophobicContact CE2-CB 3.55Å; F83-M126 HydrophobicContact CG-CB 4.27Å; F83-M126 HydrophobicContact CG-CE 3.61Å; F83-M126 HydrophobicContact CG-SD 3.93Å; F83-M126 HydrophobicContact CZ-CB 3.52Å; F83-M126 VanDerWaalsContact CZ-O 3.27Å; F83-M126 WeakPolarHBondContact CZ-O 3.17Å; F83-M128 HydrophobicContact CE2-CG 4.43Å; F83-M128 HydrophobicContact CZ-CB 4.46Å; F83-M128 HydrophobicContact CZ-CG 3.73Å; F83-V131 HydrophobicContact CD1-CG2 4.04Å; F83-V131 HydrophobicContact CE1-CG2 3.9Å
84	R	96.1	Very high	95.4	Very high	105 Å²	105	51.8 Å²	51.8	40%	0.396	26%	0.259	S	S	.	.	H	α-helix	trans	-55.5	-50.9	175.9	-172.6	175.3	62	97.9	-11.8	112.6	Y71 K80 F82 T86 Q88 V131	Y71-R84 HydrophobicContact CE2-CB 4.42Å; Y71-R84 VanDerWaalsContact OH-CB 3.3Å; Y71-R84 WeakPolarHBondContact OH-CB 3.43Å; Y71-R84 WeakPolarHBondContact OH-CD 3.43Å; Y71-R84 WeakPolarHBondContact OH-CG 3.49Å; K80-R84 WeakPolarHBondContact O-CB 3.37Å; K80-R84 PolarHBondContact O-N 3.22Å; F82-R84 VanDerWaalsContact C-N 3.32Å; F82-R84 PolarHBondContact O-N 2.76Å; R84-T86 VanDerWaalsContact C-N 3.35Å; R84-Q88 HydrophobicContact CG-CG 4.28Å; R84-Q88 VanDerWaalsContact O-CB 3.28Å; R84-Q88 WeakPolarHBondContact O-CB 3.4Å; R84-Q88 VanDerWaalsContact O-CG 3.23Å; R84-Q88 WeakPolarHBondContact O-CG 3.27Å; R84-Q88 PolarHBondContact O-N 3.25Å; R84-V131 HydrophobicContact CG-CG1 4.27Å
85	R	95.6	Very high	95.5	Very high	123 Å²	123	52.2 Å²	52.2	46%	0.464	26%	0.26	S	S	.	.	H	α-helix	trans	-66.6	-39.2	-178	-73.3	-173.5	-60.6	-92.5	0.3	111.5	G81 F82 F83 K89	G81-R85 WeakPolarHBondContact O-CG 3.49Å; G81-R85 PolarHBondContact O-N 2.95Å; G81-R85 VanDerWaalsContact O-N 3.13Å; G81-R85 PolarHBondContact O-NH1 3.31Å; F82-R85 PolarHBondContact O-N 2.94Å; F82-R85 VanDerWaalsContact O-N 3.11Å; F83-R85 PolarHBondContact O-N 2.98Å; R85-K89 WeakPolarHBondContact O-CB 3.13Å; R85-K89 PolarHBondContact O-N 3.27Å
86	T	95.8	Very high	95.4	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-46.5	179	-58.1	0	0	0	0	111.5	F82 F83 R84 N90 L91 H92 Y95 F118	F82-T86 PolarHBondContact O-N 3.42Å; F82-T86 PolarHBondContact O-OG1 3.35Å; F83-T86 PolarHBondContact O-N 3.49Å; R84-T86 VanDerWaalsContact C-N 3.35Å; T86-N90 WeakPolarHBondContact O-CA 3.45Å; T86-N90 PolarHBondContact O-N 3.48Å; T86-L91 HydrophobicContact CG2-CB 4.46Å; T86-L91 PolarHBondContact O-N 3.01Å; T86-H92 HydrophobicContact CG2-CB 3.68Å; T86-Y95 HydrophobicContact CG2-CD2 4.38Å; T86-Y95 HydrophobicContact CG2-CE2 3.5Å; T86-Y95 VanDerWaalsContact CG2-CE2 3.5Å; T86-Y95 PolarHBondContact OG1-OH 3.22Å; T86-F118 HydrophobicContact CG2-CD2 3.53Å; T86-F118 HydrophobicContact CG2-CE2 3.66Å; T86-F118 HydrophobicContact CG2-CG 4.07Å; T86-F118 HydrophobicContact CG2-CZ 4.32Å
87	I	94.8	Very high	95.4	Very high	36 Å²	36	58 Å²	58	19%	0.185	30%	0.3	C	S	.	.	H	α-helix	trans	-73.6	-46.7	178.7	-58.8	-55.9	0	0	0	111.4	F83 K89 N90 F118 M128 V131	F83-I87 HydrophobicContact CD1-CG1 4.46Å; F83-I87 HydrophobicContact CE1-CG1 4.18Å; F83-I87 HydrophobicContact CE2-CG1 4.49Å; F83-I87 HydrophobicContact CZ-CG1 4.2Å; F83-I87 WeakPolarHBondContact O-CG1 3.42Å; F83-I87 PolarHBondContact O-N 3.15Å; F83-I87 VanDerWaalsContact O-N 3.07Å; I87-K89 VanDerWaalsContact C-N 3.31Å; I87-K89 PolarHBondContact O-N 2.87Å; I87-N90 PolarHBondContact O-N 2.8Å; I87-N90 VanDerWaalsContact O-N 3.15Å; I87-F118 HydrophobicContact CD1-CE2 3.73Å; I87-F118 HydrophobicContact CD1-CZ 3.77Å; I87-F118 HydrophobicContact CG1-CE2 4.47Å; I87-M128 HydrophobicContact CD1-CB 4.13Å; I87-M128 HydrophobicContact CD1-CG 3.64Å; I87-M128 HydrophobicContact CD1-SD 3.71Å; I87-M128 HydrophobicContact CG1-CB 4.39Å; I87-M128 HydrophobicContact CG1-CG 4.21Å; I87-V131 HydrophobicContact CB-CB 4.16Å; I87-V131 HydrophobicContact CB-CG1 4.07Å; I87-V131 HydrophobicContact CB-CG2 4.04Å; I87-V131 HydrophobicContact CG1-CG2 4.2Å; I87-V131 HydrophobicContact CG2-CB 3.81Å; I87-V131 HydrophobicContact CG2-CG1 3.99Å; I87-V131 HydrophobicContact CG2-CG2 4.11Å
88	Q	91.7	Very high	95.3	Very high	51 Å²	51	62.8 Å²	62.8	24%	0.238	32%	0.319	C	S	.	.	H	α-helix	trans	-61.7	-36	-177.1	-75.5	-177.9	-26.3	0	0	113.8	R84 V131 L132	R84-Q88 HydrophobicContact CG-CG 4.28Å; R84-Q88 VanDerWaalsContact O-CB 3.28Å; R84-Q88 WeakPolarHBondContact O-CB 3.4Å; R84-Q88 VanDerWaalsContact O-CG 3.23Å; R84-Q88 WeakPolarHBondContact O-CG 3.27Å; R84-Q88 PolarHBondContact O-N 3.25Å; Q88-V131 HydrophobicContact CG-CG1 3.49Å; Q88-V131 VanDerWaalsContact CG-CG1 3.49Å; Q88-L132 PolarHBondContact NE2-O 2.64Å
89	K	92.1	Very high	95.1	Very high	152 Å²	152	69.6 Å²	69.6	66%	0.661	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	7.7	-179.8	-66.9	-174.1	176.2	-166.2	0	112.9	R85 I87 L91	R85-K89 WeakPolarHBondContact O-CB 3.13Å; R85-K89 PolarHBondContact O-N 3.27Å; I87-K89 VanDerWaalsContact C-N 3.31Å; I87-K89 PolarHBondContact O-N 2.87Å; K89-L91 VanDerWaalsContact C-N 3.29Å; K89-L91 HydrophobicContact CB-CD1 3.98Å; K89-L91 HydrophobicContact CB-CD2 4Å; K89-L91 HydrophobicContact CB-CG 3.65Å; K89-L91 HydrophobicContact CD-CD1 4.29Å; K89-L91 PolarHBondContact O-N 2.92Å
90	N	92.6	Very high	94.9	Very high	100 Å²	100	77.1 Å²	77.1	54%	0.535	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	46.9	-176.1	-164.4	29	0	0	0	113.4	T86 I87 H92 P93	T86-N90 WeakPolarHBondContact O-CA 3.45Å; T86-N90 PolarHBondContact O-N 3.48Å; I87-N90 PolarHBondContact O-N 2.8Å; I87-N90 VanDerWaalsContact O-N 3.15Å; N90-H92 PolarHBondContact OD1-NE2 3.32Å; N90-P93 VanDerWaalsContact O-CD 3.26Å; N90-P93 WeakPolarHBondContact O-CD 3.41Å
91	L	94.5	Very high	94.6	Very high	54 Å²	54	75.4 Å²	75.4	28%	0.283	38%	0.376	S	S	.	.			trans	-88.6	-16.7	-174.2	-59.6	174.8	0	0	0	113.6	T86 K89 P93 T94 Y95	T86-L91 HydrophobicContact CG2-CB 4.46Å; T86-L91 PolarHBondContact O-N 3.01Å; K89-L91 VanDerWaalsContact C-N 3.29Å; K89-L91 HydrophobicContact CB-CD1 3.98Å; K89-L91 HydrophobicContact CB-CD2 4Å; K89-L91 HydrophobicContact CB-CG 3.65Å; K89-L91 HydrophobicContact CD-CD1 4.29Å; K89-L91 PolarHBondContact O-N 2.92Å; L91-P93 VanDerWaalsContact C-N 3.3Å; L91-T94 PolarHBondContact O-N 3.06Å; L91-T94 PolarHBondContact O-OG1 3.48Å; L91-Y95 HydrophobicContact CB-CE1 3.85Å; L91-Y95 HydrophobicContact CB-CE2 4.42Å; L91-Y95 WeakPolarHBondContact CB-OH 3.33Å; L91-Y95 WeakPolarHBondContact O-CD1 3.46Å; L91-Y95 PolarHBondContact O-N 3Å
92	H	92.1	Very high	94.5	Very high	66 Å²	66	80.3 Å²	80.3	31%	0.306	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-59.2	-32.6	-177.4	67.2	85.5	0	0	0	114.6	T86 N90 T94 Y95 F118	T86-H92 HydrophobicContact CG2-CB 3.68Å; N90-H92 PolarHBondContact OD1-NE2 3.32Å; H92-T94 PolarHBondContact O-N 3.25Å; H92-Y95 PolarHBondContact O-N 3.32Å; H92-F118 HydrophobicContact CB-CD1 3.55Å; H92-F118 HydrophobicContact CB-CD2 4.49Å; H92-F118 HydrophobicContact CB-CE1 3.25Å; H92-F118 HydrophobicContact CB-CE2 4.24Å; H92-F118 HydrophobicContact CB-CG 4.16Å; H92-F118 HydrophobicContact CB-CZ 3.62Å; H92-F118 AromaticContact CG-CE1 3.73Å; H92-F118 AromaticContact CG-CZ 3.92Å
93	P	94.7	Very high	94.4	Very high	85 Å²	85	81.4 Å²	81.4	55%	0.552	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-69.7	-22.2	175.7	-16.6	32.9	0	0	0	112.8	N90 L91	N90-P93 VanDerWaalsContact O-CD 3.26Å; N90-P93 WeakPolarHBondContact O-CD 3.41Å; L91-P93 VanDerWaalsContact C-N 3.3Å
94	T	95.4	Very high	94.3	Very high	99 Å²	99	88 Å²	88	61%	0.607	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-87.5	-9.7	-177.5	71	0	0	0	0	112.8	L91 H92	L91-T94 PolarHBondContact O-N 3.06Å; L91-T94 PolarHBondContact O-OG1 3.48Å; H92-T94 PolarHBondContact O-N 3.25Å
95	Y	96.7	Very high	94.4	Very high	25 Å²	25	84.1 Å²	84.1	10%	0.098	44%	0.436	C	S	.	.			trans	-78.9	126.6	-179.1	-63.4	-24	0	0	0	111.3	F82 T86 L91 H92 Q114 F118	F82-Y95 HydrophobicContact CE2-CE2 4.1Å; F82-Y95 AromaticContact CZ-CE2 3.84Å; F82-Y95 HydrophobicContact CZ-CE2 3.84Å; T86-Y95 HydrophobicContact CG2-CD2 4.38Å; T86-Y95 HydrophobicContact CG2-CE2 3.5Å; T86-Y95 VanDerWaalsContact CG2-CE2 3.5Å; T86-Y95 PolarHBondContact OG1-OH 3.22Å; L91-Y95 HydrophobicContact CB-CE1 3.85Å; L91-Y95 HydrophobicContact CB-CE2 4.42Å; L91-Y95 WeakPolarHBondContact CB-OH 3.33Å; L91-Y95 WeakPolarHBondContact O-CD1 3.46Å; L91-Y95 PolarHBondContact O-N 3Å; H92-Y95 PolarHBondContact O-N 3.32Å; Y95-Q114 HydrophobicContact CD1-CB 3.78Å; Y95-Q114 HydrophobicContact CD2-CB 3.89Å; Y95-Q114 HydrophobicContact CE1-CB 3.93Å; Y95-Q114 HydrophobicContact CE1-CG 4.38Å; Y95-Q114 HydrophobicContact CE2-CB 4.01Å; Y95-Q114 HydrophobicContact CG-CB 3.79Å; Y95-F118 HydrophobicContact CD2-CB 4.24Å; Y95-F118 HydrophobicContact CE2-CB 4.4Å
96	S	95.3	Very high	94.4	Very high	96 Å²	96	80.7 Å²	80.7	67%	0.671	43%	0.427	S	S	*	.			trans	-117.9	144.3	171.7	58.8	0	0	0	0	110.6
97	C	96.5	Very high	94.4	Very high	27 Å²	27	86.9 Å²	86.9	18%	0.182	45%	0.454	C	S	.	.			trans	-90.7	140.2	169.3	-170.5	0	0	0	0	108.8	Y99 L115	C97-Y99 VanDerWaalsContact C-N 3.28Å; C97-Y99 PolarHBondContact SG-N 3.04Å; C97-Y99 PolarHBondContact SG-O 2.87Å; C97-L115 HydrophobicContact CB-CB 4.42Å; C97-L115 HydrophobicContact CB-CD2 3.88Å
98	K	93.7	Very high	94.5	Very high	197 Å²	197	92.2 Å²	92.2	86%	0.857	48%	0.481	S	S	*	.	S	Bend	trans	-85.4	-3.7	174.1	-60.2	-177.2	-179.6	-178.7	0	113.3
99	Y	92.8	Very high	94.6	Very high	170 Å²	170	91.9 Å²	91.9	67%	0.667	48%	0.483	S	S	*	.	S	Bend	trans	-128.3	-159.5	-178.5	-49.6	-81.6	0	0	0	108.7	C97 G101	C97-Y99 VanDerWaalsContact C-N 3.28Å; C97-Y99 PolarHBondContact SG-N 3.04Å; C97-Y99 PolarHBondContact SG-O 2.87Å; Y99-G101 PolarHBondContact O-N 3.15Å
100	D	92.4	Very high	94.8	Very high	158 Å²	158	86.5 Å²	86.5	85%	0.845	46%	0.459	S	S	*	.	S	Bend	trans	-77.8	17.7	-174.1	-50.2	-51.8	0	0	0	115.3	C102	D100-C102 PolarHBondContact O-N 3.22Å
101	G	91.6	Very high	95	Very high	18 Å²	18	87.2 Å²	87.2	19%	0.186	46%	0.462	C	S	.	.	S	Bend	trans	70.2	13.1	-179	0	0	0	0	0	115.4	Y99 C116	Y99-G101 PolarHBondContact O-N 3.15Å; G101-C116 PolarHBondContact O-SG 3.29Å; G101-C116 VanDerWaalsContact O-SG 3.33Å
102	C	94.2	Very high	95.1	Very high	113 Å²	113	92.2 Å²	92.2	76%	0.764	48%	0.484	S	S	*	.			trans	-117	27.3	-176.8	-64.4	0	0	0	0	113.5	D100 I104	D100-C102 PolarHBondContact O-N 3.22Å; C102-I104 PolarHBondContact O-N 3.05Å
103	C	96.3	Very high	95.3	Very high	35 Å²	35	89.4 Å²	89.4	24%	0.236	47%	0.472	C	S	.	.			trans	-60.3	134.9	-179.3	-53.3	0	0	0	0	111.6	C113 C116	C103-C113 HydrophobicContact CB-CB 4.06Å; C103-C116 HydrophobicContact CB-CB 3.79Å; C103-C116 PolarHBondContact N-SG 2.87Å
104	I	95.4	Very high	95.5	Very high	138 Å²	138	90.4 Å²	90.4	71%	0.708	47%	0.469	S	S	*	.			trans	-64.9	135.7	171.8	-60.8	173.4	0	0	0	108.9	C102 T109	C102-I104 PolarHBondContact O-N 3.05Å; I104-T109 PolarHBondContact O-OG1 3.47Å; I104-T109 VanDerWaalsContact O-OG1 3.1Å
105	I	97.7	Very high	95.6	Very high	23 Å²	23	87.2 Å²	87.2	12%	0.118	45%	0.448	C	S	.	.			trans	-116.1	103.1	179.2	-56	-60.3	0	0	0	108.3	V61 C62 R110 C116 R117 K120	V61-I105 HydrophobicContact CG1-CG2 4.18Å; V61-I105 WeakPolarHBondContact O-CG2 3.24Å; C62-I105 HydrophobicContact CB-CG2 4.04Å; I105-R110 HydrophobicContact CG2-CB 3.86Å; I105-C116 HydrophobicContact CD1-CB 4.03Å; I105-C116 HydrophobicContact CG1-CB 4.5Å; I105-R117 HydrophobicContact CD1-CB 3.97Å; I105-R117 HydrophobicContact CG2-CG 4.12Å; I105-K120 HydrophobicContact CG1-CB 4.38Å
106	D	96.9	Very high	95.6	Very high	52 Å²	52	86.3 Å²	86.3	28%	0.278	45%	0.446	S	S	.	.			trans	-126.7	-178	173.9	64.4	58.3	0	0	0	111	C62 I108 T109 R110	C62-D106 CarbonylContact O-C 3.56Å; C62-D106 VanDerWaalsContact O-CA 3.29Å; C62-D106 WeakPolarHBondContact O-CA 3.43Å; D106-I108 PolarHBondContact O-N 2.94Å; D106-I108 VanDerWaalsContact O-N 3.16Å; D106-I108 WeakPolarHBondContact OD1-CA 3.49Å; D106-I108 WeakPolarHBondContact OD1-CB 3.48Å; D106-I108 PolarHBondContact OD1-N 3.16Å; D106-T109 PolarHBondContact N-OG1 2.91Å; D106-T109 VanDerWaalsContact N-OG1 3.08Å; D106-T109 PolarHBondContact O-N 3.07Å; D106-T109 PolarHBondContact OD1-N 2.94Å; D106-T109 PolarHBondContact OD1-OG1 2.93Å; D106-T109 VanDerWaalsContact OD1-OG1 3.09Å; D106-T109 WeakPolarHBondContact OD2-CG2 3.23Å; D106-T109 PolarHBondContact OD2-OG1 3.44Å; D106-R110 WeakPolarHBondContact O-CB 3.28Å; D106-R110 WeakPolarHBondContact O-CG 3.49Å; D106-R110 PolarHBondContact O-N 2.95Å
107	K	95.4	Very high	95.8	Very high	129 Å²	129	82.2 Å²	82.2	56%	0.561	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-34.7	-178	-178	176.7	179.9	174.5	0	113	C62 D64	C62-K107 PolarHBondContact O-N 3.32Å; D64-K107 HydrophobicContact CB-CB 4.28Å; D64-K107 HydrophobicContact CB-CD 4.33Å; D64-K107 HydrophobicContact CB-CG 4.09Å; D64-K107 WeakPolarHBondContact OD1-CD 3.36Å; D64-K107 VanDerWaalsContact OD1-CE 3.23Å; D64-K107 WeakPolarHBondContact OD1-CE 3.41Å; D64-K107 IonicContact OD1-NZ 2.75Å
108	I	95.9	Very high	95.8	Very high	148 Å²	148	81.8 Å²	81.8	76%	0.759	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-46.1	-175.3	-54.4	172.3	0	0	0	109.9	D106	D106-I108 PolarHBondContact O-N 2.94Å; D106-I108 VanDerWaalsContact O-N 3.16Å; D106-I108 WeakPolarHBondContact OD1-CA 3.49Å; D106-I108 WeakPolarHBondContact OD1-CB 3.48Å; D106-I108 PolarHBondContact OD1-N 3.16Å
109	T	95.6	Very high	96	Very high	44 Å²	44	77.7 Å²	77.7	27%	0.27	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-11.3	-169.8	61.1	0	0	0	0	114.4	I104 D106 N111 Q112	I104-T109 PolarHBondContact O-OG1 3.47Å; I104-T109 VanDerWaalsContact O-OG1 3.1Å; D106-T109 PolarHBondContact N-OG1 2.91Å; D106-T109 VanDerWaalsContact N-OG1 3.08Å; D106-T109 PolarHBondContact O-N 3.07Å; D106-T109 PolarHBondContact OD1-N 2.94Å; D106-T109 PolarHBondContact OD1-OG1 2.93Å; D106-T109 VanDerWaalsContact OD1-OG1 3.09Å; D106-T109 WeakPolarHBondContact OD2-CG2 3.23Å; D106-T109 PolarHBondContact OD2-OG1 3.44Å; T109-N111 PolarHBondContact O-N 3.43Å; T109-Q112 WeakPolarHBondContact O-CB 3.5Å; T109-Q112 WeakPolarHBondContact O-CG 3.48Å; T109-Q112 PolarHBondContact O-N 3.11Å
110	R	95.9	Very high	96.2	Very high	40 Å²	40	73.8 Å²	73.8	15%	0.151	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-15.6	-176.5	63.2	-173.1	-170.9	-169.5	-4.5	116.3	C62 D64 C76 I105 D106 R117	C62-R110 HydrophobicContact CB-CB 4.15Å; C62-R110 PolarHBondContact SG-NH1 3.14Å; C62-R110 VanDerWaalsContact SG-NH1 3.36Å; D64-R110 IonicContact OD2-CZ 3.16Å; D64-R110 IonicContact OD2-NH1 3.31Å; D64-R110 PolarHBondContact OD2-NH1 3.42Å; D64-R110 IonicContact OD2-NH2 2.85Å; D64-R110 PolarHBondContact OD2-NH2 2.97Å; C76-R110 PolarHBondContact SG-NH1 2.91Å; C76-R110 VanDerWaalsContact SG-NH1 3.37Å; I105-R110 HydrophobicContact CG2-CB 3.86Å; D106-R110 WeakPolarHBondContact O-CB 3.28Å; D106-R110 WeakPolarHBondContact O-CG 3.49Å; D106-R110 PolarHBondContact O-N 2.95Å; R110-R117 WeakPolarHBondContact O-CD 3.3Å; R110-R117 PolarHBondContact O-NH1 3.31Å
111	N	95.8	Very high	96.5	Very high	115 Å²	115	66.3 Å²	66.3	62%	0.615	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-8.7	178.1	-63.4	-30.8	0	0	0	113.3	T109 R117	T109-N111 PolarHBondContact O-N 3.43Å; N111-R117 PolarHBondContact OD1-NH1 3.46Å
112	Q	96.1	Very high	96.8	Very high	159 Å²	159	68.6 Å²	68.6	74%	0.743	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-29.7	-175.6	-59.4	-61.4	0.8	0	0	113.4	T109	T109-Q112 WeakPolarHBondContact O-CB 3.5Å; T109-Q112 WeakPolarHBondContact O-CG 3.48Å; T109-Q112 PolarHBondContact O-N 3.11Å
113	C	97.4	Very high	96.9	Very high	7 Å²	7	67.4 Å²	67.4	5%	0.047	34%	0.339	C	S	.	.			trans	-140.6	108.8	177.1	-174.9	0	0	0	0	111.8	C103 C116 R117	C103-C113 HydrophobicContact CB-CB 4.06Å; C113-C116 HydrophobicContact CB-CB 4.15Å; C113-C116 PolarHBondContact SG-N 3.5Å; C113-C116 PolarHBondContact SG-SG 3.02Å; C113-R117 WeakPolarHBondContact O-CB 3.36Å; C113-R117 PolarHBondContact O-N 3.49Å; C113-R117 VanDerWaalsContact O-N 3.11Å
114	Q	97.4	Very high	96.9	Very high	105 Å²	105	67.7 Å²	67.7	49%	0.491	34%	0.34	S	S	.	.	H	α-helix	trans	-67.8	-36.4	179.4	-65.2	173.9	-33.4	0	0	112.1	F82 Y95 R117 F118	F82-Q114 HydrophobicContact CE2-CB 4.26Å; F82-Q114 HydrophobicContact CE2-CG 4.29Å; F82-Q114 HydrophobicContact CZ-CB 4.39Å; F82-Q114 WeakPolarHBondContact CZ-O 3.35Å; Y95-Q114 HydrophobicContact CD1-CB 3.78Å; Y95-Q114 HydrophobicContact CD2-CB 3.89Å; Y95-Q114 HydrophobicContact CE1-CB 3.93Å; Y95-Q114 HydrophobicContact CE1-CG 4.38Å; Y95-Q114 HydrophobicContact CE2-CB 4.01Å; Y95-Q114 HydrophobicContact CG-CB 3.79Å; Q114-R117 PolarHBondContact O-N 3.13Å; Q114-F118 WeakPolarHBondContact O-CB 3.34Å; Q114-F118 PolarHBondContact O-N 3.29Å
115	L	97.9	Very high	96.9	Very high	32 Å²	32	63.1 Å²	63.1	17%	0.168	33%	0.327	C	S	.	.	H	α-helix	trans	-62.5	-53.4	178.5	-178.5	60.1	0	0	0	111.2	C97 R117 F118 K119	C97-L115 HydrophobicContact CB-CB 4.42Å; C97-L115 HydrophobicContact CB-CD2 3.88Å; L115-R117 VanDerWaalsContact C-N 3.31Å; L115-R117 PolarHBondContact O-N 3.01Å; L115-F118 PolarHBondContact O-N 2.91Å; L115-K119 HydrophobicContact CD1-CG 4.39Å; L115-K119 HydrophobicContact CG-CD 4.38Å; L115-K119 WeakPolarHBondContact O-CB 3.3Å; L115-K119 WeakPolarHBondContact O-CG 3.2Å; L115-K119 PolarHBondContact O-N 3.02Å
116	C	97.8	Very high	96.9	Very high	6 Å²	6	62.3 Å²	62.3	4%	0.041	32%	0.323	C	S	.	.	H	α-helix	trans	-63.9	-37.5	180	-62.8	0	0	0	0	111.7	G101 C103 I105 C113 K119 K120	G101-C116 PolarHBondContact O-SG 3.29Å; G101-C116 VanDerWaalsContact O-SG 3.33Å; C103-C116 HydrophobicContact CB-CB 3.79Å; C103-C116 PolarHBondContact N-SG 2.87Å; I105-C116 HydrophobicContact CD1-CB 4.03Å; I105-C116 HydrophobicContact CG1-CB 4.5Å; C113-C116 HydrophobicContact CB-CB 4.15Å; C113-C116 PolarHBondContact SG-N 3.5Å; C113-C116 PolarHBondContact SG-SG 3.02Å; C116-K119 PolarHBondContact O-N 2.95Å; C116-K120 WeakPolarHBondContact O-CB 3.37Å; C116-K120 PolarHBondContact O-N 3.1Å
117	R	98.2	Very high	96.8	Very high	11 Å²	11	60.5 Å²	60.5	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-62.7	-45.6	174.4	-166	-165.5	-168.3	153.3	-6.6	112.1	V61 G78 C79 F82 I105 R110 N111 C113 Q114 L115 K120 C121	V61-R117 HydrophobicContact CG1-CG 4.47Å; G78-R117 PolarHBondContact O-NH2 3.12Å; C79-R117 PolarHBondContact SG-NH2 3.43Å; F82-R117 HydrophobicContact CD1-CG 4.11Å; F82-R117 HydrophobicContact CE1-CB 4.07Å; F82-R117 HydrophobicContact CE1-CG 3.88Å; F82-R117 HydrophobicContact CZ-CB 4.15Å; F82-R117 HydrophobicContact CZ-CG 4.33Å; I105-R117 HydrophobicContact CD1-CB 3.97Å; I105-R117 HydrophobicContact CG2-CG 4.12Å; R110-R117 WeakPolarHBondContact O-CD 3.3Å; R110-R117 PolarHBondContact O-NH1 3.31Å; N111-R117 PolarHBondContact OD1-NH1 3.46Å; C113-R117 WeakPolarHBondContact O-CB 3.36Å; C113-R117 PolarHBondContact O-N 3.49Å; C113-R117 VanDerWaalsContact O-N 3.11Å; Q114-R117 PolarHBondContact O-N 3.13Å; L115-R117 VanDerWaalsContact C-N 3.31Å; L115-R117 PolarHBondContact O-N 3.01Å; R117-K120 PolarHBondContact O-N 3.44Å; R117-C121 PolarHBondContact O-N 3.09Å; R117-C121 PolarHBondContact O-SG 2.97Å; R117-C121 VanDerWaalsContact O-SG 3.36Å
118	F	98.1	Very high	96.6	Very high	17 Å²	17	58.7 Å²	58.7	8%	0.075	31%	0.31	C	S	.	.	H	α-helix	trans	-67.1	-43.7	178.2	-178.4	-107.9	0	0	0	112	F82 F83 T86 I87 H92 Y95 Q114 L115 K120 C121 I122 M128	F82-F118 HydrophobicContact CE1-CB 3.88Å; F82-F118 HydrophobicContact CE1-CD2 4.38Å; F82-F118 HydrophobicContact CZ-CB 3.98Å; F83-F118 HydrophobicContact CD2-CD2 4.31Å; F83-F118 HydrophobicContact CD2-CE2 4.05Å; F83-F118 AromaticContact CE2-CE2 3.9Å; F83-F118 HydrophobicContact CE2-CE2 3.9Å; T86-F118 HydrophobicContact CG2-CD2 3.53Å; T86-F118 HydrophobicContact CG2-CE2 3.66Å; T86-F118 HydrophobicContact CG2-CG 4.07Å; T86-F118 HydrophobicContact CG2-CZ 4.32Å; I87-F118 HydrophobicContact CD1-CE2 3.73Å; I87-F118 HydrophobicContact CD1-CZ 3.77Å; I87-F118 HydrophobicContact CG1-CE2 4.47Å; H92-F118 HydrophobicContact CB-CD1 3.55Å; H92-F118 HydrophobicContact CB-CD2 4.49Å; H92-F118 HydrophobicContact CB-CE1 3.25Å; H92-F118 HydrophobicContact CB-CE2 4.24Å; H92-F118 HydrophobicContact CB-CG 4.16Å; H92-F118 HydrophobicContact CB-CZ 3.62Å; H92-F118 AromaticContact CG-CE1 3.73Å; H92-F118 AromaticContact CG-CZ 3.92Å; Y95-F118 HydrophobicContact CD2-CB 4.24Å; Y95-F118 HydrophobicContact CE2-CB 4.4Å; Q114-F118 WeakPolarHBondContact O-CB 3.34Å; Q114-F118 PolarHBondContact O-N 3.29Å; L115-F118 PolarHBondContact O-N 2.91Å; F118-K120 PolarHBondContact O-N 3.16Å; F118-C121 WeakPolarHBondContact O-CB 3.36Å; F118-C121 PolarHBondContact O-N 3.48Å; F118-I122 HydrophobicContact CD1-CG1 4.35Å; F118-I122 HydrophobicContact CE1-CD1 4.36Å; F118-I122 HydrophobicContact CE1-CG1 3.85Å; F118-I122 HydrophobicContact CE2-CD1 4.14Å; F118-I122 HydrophobicContact CE2-CG1 4.15Å; F118-I122 HydrophobicContact CZ-CD1 3.8Å; F118-I122 HydrophobicContact CZ-CG1 3.76Å; F118-I122 PolarHBondContact O-N 3.43Å; F118-M128 HydrophobicContact CZ-SD 4.39Å
119	K	97.3	Very high	96.3	Very high	112 Å²	112	57.2 Å²	57.2	49%	0.487	30%	0.303	S	S	.	.	H	α-helix	trans	-54.6	-42.8	171.9	-76.3	-175.8	175.2	-174.4	0	111.3	L115 C116 I122 S123	L115-K119 HydrophobicContact CD1-CG 4.39Å; L115-K119 HydrophobicContact CG-CD 4.38Å; L115-K119 WeakPolarHBondContact O-CB 3.3Å; L115-K119 WeakPolarHBondContact O-CG 3.2Å; L115-K119 PolarHBondContact O-N 3.02Å; C116-K119 PolarHBondContact O-N 2.95Å; K119-I122 PolarHBondContact O-N 3.33Å; K119-S123 WeakPolarHBondContact O-CB 3.22Å; K119-S123 PolarHBondContact O-N 2.95Å; K119-S123 PolarHBondContact O-OG 3.08Å
120	K	97.8	Very high	96.1	Very high	88 Å²	88	58.8 Å²	58.8	38%	0.383	31%	0.31	S	S	.	.	H	α-helix	trans	-64.4	-41.3	175.2	-172.1	63.3	173.9	-179.4	0	112.4	V61 I105 C116 R117 F118 I122 S123 V124	V61-K120 HydrophobicContact CG1-CB 4.43Å; V61-K120 HydrophobicContact CG1-CG 4.12Å; I105-K120 HydrophobicContact CG1-CB 4.38Å; C116-K120 WeakPolarHBondContact O-CB 3.37Å; C116-K120 PolarHBondContact O-N 3.1Å; R117-K120 PolarHBondContact O-N 3.44Å; F118-K120 PolarHBondContact O-N 3.16Å; K120-I122 VanDerWaalsContact C-N 3.31Å; K120-I122 PolarHBondContact O-N 3.42Å; K120-S123 WeakPolarHBondContact CA-OG 3.32Å; K120-S123 PolarHBondContact O-N 3.37Å; K120-S123 PolarHBondContact O-OG 2.7Å; K120-S123 VanDerWaalsContact O-OG 3.13Å; K120-V124 HydrophobicContact CD-CG1 4.2Å; K120-V124 WeakPolarHBondContact O-CG1 3.34Å; K120-V124 WeakPolarHBondContact O-CG2 3.17Å; K120-V124 PolarHBondContact O-N 2.9Å; K120-V124 VanDerWaalsContact O-N 3.09Å
121	C	97.9	Very high	95.8	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-57.9	-42.9	173.6	-70.3	0	0	0	0	112.4	F83 R117 F118 V124 M126	F83-C121 HydrophobicContact CD2-CB 3.58Å; F83-C121 HydrophobicContact CE2-CB 4Å; R117-C121 PolarHBondContact O-N 3.09Å; R117-C121 PolarHBondContact O-SG 2.97Å; R117-C121 VanDerWaalsContact O-SG 3.36Å; F118-C121 WeakPolarHBondContact O-CB 3.36Å; F118-C121 PolarHBondContact O-N 3.48Å; C121-V124 VanDerWaalsContact O-CG2 3.26Å; C121-V124 WeakPolarHBondContact O-CG2 3.47Å; C121-M126 HydrophobicContact CB-CB 4.45Å; C121-M126 HydrophobicContact CB-CG 4.3Å; C121-M126 HydrophobicContact CB-SD 3.67Å; C121-M126 VanDerWaalsContact O-CB 3.24Å; C121-M126 WeakPolarHBondContact O-CB 3.1Å; C121-M126 WeakPolarHBondContact O-CG 3.38Å; C121-M126 PolarHBondContact O-N 3.2Å
122	I	97.7	Very high	95.4	Very high	66 Å²	66	55.3 Å²	55.3	34%	0.338	29%	0.294	S	S	.	.	H	α-helix	trans	-70.6	-42.8	178.1	-62.4	-63.7	0	0	0	111	F83 F118 K119 K120 V124 G125 M128	F83-I122 HydrophobicContact CE2-CD1 3.75Å; F83-I122 HydrophobicContact CZ-CD1 4.18Å; F118-I122 HydrophobicContact CD1-CG1 4.35Å; F118-I122 HydrophobicContact CE1-CD1 4.36Å; F118-I122 HydrophobicContact CE1-CG1 3.85Å; F118-I122 HydrophobicContact CE2-CD1 4.14Å; F118-I122 HydrophobicContact CE2-CG1 4.15Å; F118-I122 HydrophobicContact CZ-CD1 3.8Å; F118-I122 HydrophobicContact CZ-CG1 3.76Å; F118-I122 PolarHBondContact O-N 3.43Å; K119-I122 PolarHBondContact O-N 3.33Å; K120-I122 VanDerWaalsContact C-N 3.31Å; K120-I122 PolarHBondContact O-N 3.42Å; I122-V124 VanDerWaalsContact C-N 3.28Å; I122-V124 PolarHBondContact O-N 3.13Å; I122-G125 WeakPolarHBondContact O-CA 3.34Å; I122-G125 PolarHBondContact O-N 3.32Å; I122-M128 HydrophobicContact CD1-CE 4.37Å; I122-M128 HydrophobicContact CD1-CG 3.8Å; I122-M128 HydrophobicContact CD1-SD 3.74Å
123	S	96.8	Very high	94.9	Very high	88 Å²	88	50.7 Å²	50.7	62%	0.615	27%	0.274	S	S	*	.	H	α-helix	trans	-66.9	-27.6	-177.6	71.8	0	0	0	0	113.8	K119 K120 G125	K119-S123 WeakPolarHBondContact O-CB 3.22Å; K119-S123 PolarHBondContact O-N 2.95Å; K119-S123 PolarHBondContact O-OG 3.08Å; K120-S123 WeakPolarHBondContact CA-OG 3.32Å; K120-S123 PolarHBondContact O-N 3.37Å; K120-S123 PolarHBondContact O-OG 2.7Å; K120-S123 VanDerWaalsContact O-OG 3.13Å; S123-G125 VanDerWaalsContact C-N 3.27Å
124	V	96.3	Very high	94.3	Very high	41 Å²	41	55.1 Å²	55.1	25%	0.248	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-1.3	172.1	-56.7	0	0	0	0	113.5	V60 V61 C73 K120 C121 I122 M126	V60-V124 HydrophobicContact CB-CG1 4.47Å; V60-V124 HydrophobicContact CG2-CB 3.86Å; V60-V124 HydrophobicContact CG2-CG1 4.24Å; V60-V124 HydrophobicContact CG2-CG2 3.79Å; V61-V124 HydrophobicContact CG2-CG2 3.81Å; C73-V124 PolarHBondContact SG-O 3.08Å; K120-V124 HydrophobicContact CD-CG1 4.2Å; K120-V124 WeakPolarHBondContact O-CG1 3.34Å; K120-V124 WeakPolarHBondContact O-CG2 3.17Å; K120-V124 PolarHBondContact O-N 2.9Å; K120-V124 VanDerWaalsContact O-N 3.09Å; C121-V124 VanDerWaalsContact O-CG2 3.26Å; C121-V124 WeakPolarHBondContact O-CG2 3.47Å; I122-V124 VanDerWaalsContact C-N 3.28Å; I122-V124 PolarHBondContact O-N 3.13Å; V124-M126 HydrophobicContact CG2-CG 4.15Å
125	G	95.6	Very high	93.8	Very high	42 Å²	42	54.6 Å²	54.6	43%	0.433	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.2	20.8	172.9	0	0	0	0	0	116.3	C73 I122 S123 A127	C73-G125 PolarHBondContact SG-O 3.36Å; I122-G125 WeakPolarHBondContact O-CA 3.34Å; I122-G125 PolarHBondContact O-N 3.32Å; S123-G125 VanDerWaalsContact C-N 3.27Å; G125-A127 PolarHBondContact O-N 2.69Å
126	M	97.1	Very high	93.3	Very high	6 Å²	6	58.2 Å²	58.2	3%	0.03	32%	0.32	C	S	.	.			trans	-64.5	124.3	176.2	-66.5	-171	76.9	0	0	110.6	V61 Y71 C73 T75 F83 C121 V124	V61-M126 HydrophobicContact CG2-SD 4.16Å; Y71-M126 HydrophobicContact CD2-CE 3.56Å; Y71-M126 HydrophobicContact CE2-CE 4.47Å; Y71-M126 HydrophobicContact CG-CE 4.31Å; Y71-M126 WeakPolarHBondContact O-CA 3.14Å; C73-M126 HydrophobicContact CB-CG 3.95Å; C73-M126 PolarHBondContact SG-N 2.76Å; C73-M126 VanDerWaalsContact SG-N 3.37Å; T75-M126 HydrophobicContact CG2-CE 4.18Å; T75-M126 HydrophobicContact CG2-SD 4.07Å; F83-M126 HydrophobicContact CB-CE 3.63Å; F83-M126 HydrophobicContact CB-SD 4.08Å; F83-M126 HydrophobicContact CD1-CB 4.25Å; F83-M126 HydrophobicContact CD1-CE 3.77Å; F83-M126 HydrophobicContact CD2-CB 3.94Å; F83-M126 HydrophobicContact CD2-CE 4.23Å; F83-M126 HydrophobicContact CD2-SD 3.95Å; F83-M126 HydrophobicContact CE1-CB 3.89Å; F83-M126 HydrophobicContact CE1-CE 4.48Å; F83-M126 HydrophobicContact CE2-CB 3.55Å; F83-M126 HydrophobicContact CG-CB 4.27Å; F83-M126 HydrophobicContact CG-CE 3.61Å; F83-M126 HydrophobicContact CG-SD 3.93Å; F83-M126 HydrophobicContact CZ-CB 3.52Å; F83-M126 VanDerWaalsContact CZ-O 3.27Å; F83-M126 WeakPolarHBondContact CZ-O 3.17Å; C121-M126 HydrophobicContact CB-CB 4.45Å; C121-M126 HydrophobicContact CB-CG 4.3Å; C121-M126 HydrophobicContact CB-SD 3.67Å; C121-M126 VanDerWaalsContact O-CB 3.24Å; C121-M126 WeakPolarHBondContact O-CB 3.1Å; C121-M126 WeakPolarHBondContact O-CG 3.38Å; C121-M126 PolarHBondContact O-N 3.2Å; V124-M126 HydrophobicContact CG2-CG 4.15Å
127	A	94.3	Very high	92.7	Very high	14 Å²	14	61.1 Å²	61.1	12%	0.116	33%	0.33	C	S	.	.			trans	-87	115.8	-170.8	0	0	0	0	0	112.2	Y71 R72 G125 D129 L130	Y71-A127 PolarHBondContact O-N 3.1Å; R72-A127 HydrophobicContact CG-CB 4.12Å; G125-A127 PolarHBondContact O-N 2.69Å; A127-D129 WeakPolarHBondContact CB-OD1 2.99Å; A127-L130 HydrophobicContact CB-CD1 4.02Å; A127-L130 HydrophobicContact CB-CG 4.07Å
128	M	92.1	Very high	92.3	Very high	92 Å²	92	64 Å²	64	45%	0.453	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-70.1	-34.8	-176	-60.8	-177.4	-74.1	0	0	112.9	F83 I87 F118 I122 L130 V131	F83-M128 HydrophobicContact CE2-CG 4.43Å; F83-M128 HydrophobicContact CZ-CB 4.46Å; F83-M128 HydrophobicContact CZ-CG 3.73Å; I87-M128 HydrophobicContact CD1-CB 4.13Å; I87-M128 HydrophobicContact CD1-CG 3.64Å; I87-M128 HydrophobicContact CD1-SD 3.71Å; I87-M128 HydrophobicContact CG1-CB 4.39Å; I87-M128 HydrophobicContact CG1-CG 4.21Å; F118-M128 HydrophobicContact CZ-SD 4.39Å; I122-M128 HydrophobicContact CD1-CE 4.37Å; I122-M128 HydrophobicContact CD1-CG 3.8Å; I122-M128 HydrophobicContact CD1-SD 3.74Å; M128-L130 PolarHBondContact O-N 3.15Å; M128-V131 VanDerWaalsContact O-CB 3.32Å; M128-V131 WeakPolarHBondContact O-CB 3.29Å; M128-V131 PolarHBondContact O-N 3.16Å
129	D	89.8	Confident	91.9	Very high	116 Å²	116	65.9 Å²	65.9	62%	0.62	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-64.4	-24	-179.6	65	-34.3	0	0	0	113.7	A127 V131	A127-D129 WeakPolarHBondContact CB-OD1 2.99Å; D129-V131 VanDerWaalsContact C-N 3.26Å; D129-V131 PolarHBondContact O-N 3.43Å
130	L	90.7	Very high	91.5	Very high	78 Å²	78	66.2 Å²	66.2	41%	0.408	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-78	-9.3	174	-64.3	-174	0	0	0	113.3	Y71 R72 A127 M128 L132	Y71-L130 HydrophobicContact CD1-CB 3.93Å; R72-L130 HydrophobicContact CG-CD1 3.69Å; A127-L130 HydrophobicContact CB-CD1 4.02Å; A127-L130 HydrophobicContact CB-CG 4.07Å; M128-L130 PolarHBondContact O-N 3.15Å; L130-L132 PolarHBondContact O-N 2.93Å
131	V	90.1	Very high	91.1	Very high	11 Å²	11	70.5 Å²	70.5	7%	0.067	38%	0.383	C	S	.	.	S	Bend	trans	-80	115.1	172.1	-176.5	0	0	0	0	108.9	Y71 F83 R84 I87 Q88 M128 D129 D133	Y71-V131 HydrophobicContact CD1-CG2 3.79Å; Y71-V131 HydrophobicContact CE1-CB 4.34Å; Y71-V131 HydrophobicContact CE1-CG2 3.55Å; F83-V131 HydrophobicContact CD1-CG2 4.04Å; F83-V131 HydrophobicContact CE1-CG2 3.9Å; R84-V131 HydrophobicContact CG-CG1 4.27Å; I87-V131 HydrophobicContact CB-CB 4.16Å; I87-V131 HydrophobicContact CB-CG1 4.07Å; I87-V131 HydrophobicContact CB-CG2 4.04Å; I87-V131 HydrophobicContact CG1-CG2 4.2Å; I87-V131 HydrophobicContact CG2-CB 3.81Å; I87-V131 HydrophobicContact CG2-CG1 3.99Å; I87-V131 HydrophobicContact CG2-CG2 4.11Å; Q88-V131 HydrophobicContact CG-CG1 3.49Å; Q88-V131 VanDerWaalsContact CG-CG1 3.49Å; M128-V131 VanDerWaalsContact O-CB 3.32Å; M128-V131 WeakPolarHBondContact O-CB 3.29Å; M128-V131 PolarHBondContact O-N 3.16Å; D129-V131 VanDerWaalsContact C-N 3.26Å; D129-V131 PolarHBondContact O-N 3.43Å; V131-D133 PolarHBondContact O-N 2.89Å; V131-D133 VanDerWaalsContact O-N 3.15Å
132	L	87.1	Confident	90.8	Very high	70 Å²	70	78.5 Å²	78.5	37%	0.366	41%	0.413	S	S	.	.			trans	-60.9	118	179.1	-68.2	165.2	0	0	0	111.5	Q88 L130 K136 R137 K140	Q88-L132 PolarHBondContact NE2-O 2.64Å; L130-L132 PolarHBondContact O-N 2.93Å; L132-K136 HydrophobicContact CD2-CB 3.7Å; L132-K136 HydrophobicContact CD2-CD 4.07Å; L132-K136 HydrophobicContact CD2-CG 4.5Å; L132-R137 PolarHBondContact O-NH2 2.89Å; L132-K140 HydrophobicContact CD1-CD 4.41Å
133	D	86.2	Confident	90.6	Very high	63 Å²	63	80.1 Å²	80.1	34%	0.337	42%	0.421	S	S	.	.			trans	-63.1	171.2	167.1	62.2	57.3	0	0	0	112	V131 S135 K136 R137	V131-D133 PolarHBondContact O-N 2.89Å; V131-D133 VanDerWaalsContact O-N 3.15Å; D133-S135 VanDerWaalsContact C-N 3.34Å; D133-S135 PolarHBondContact O-N 3.26Å; D133-S135 WeakPolarHBondContact OD1-CB 3.4Å; D133-S135 PolarHBondContact OD1-N 3.11Å; D133-S135 VanDerWaalsContact OD1-N 3.11Å; D133-K136 WeakPolarHBondContact OD1-CB 3.34Å; D133-K136 WeakPolarHBondContact OD1-CG 3.5Å; D133-K136 PolarHBondContact OD1-N 3.33Å; D133-K136 WeakPolarHBondContact OD2-CD 3.47Å; D133-K136 WeakPolarHBondContact OD2-CE 3.4Å; D133-K136 IonicContact OD2-NZ 3.14Å; D133-K136 PolarHBondContact OD2-NZ 3.42Å; D133-K136 VanDerWaalsContact OD2-NZ 3.14Å; D133-R137 WeakPolarHBondContact O-CB 3.34Å; D133-R137 PolarHBondContact O-N 3.44Å
134	D	84.5	Confident	90.3	Very high	99 Å²	99	79.6 Å²	79.6	53%	0.529	41%	0.411	S	S	.	.	H	α-helix	trans	-64.2	-38.8	-176.1	-76.9	0.7	0	0	0	112.3	R137 V138	D134-R137 PolarHBondContact O-N 3.02Å; D134-R137 IonicContact OD1-CZ 2.69Å; D134-R137 IonicContact OD1-NH1 3.18Å; D134-R137 PolarHBondContact OD1-NH1 2.86Å; D134-R137 IonicContact OD1-NH2 2.87Å; D134-R137 PolarHBondContact OD1-NH2 3.31Å; D134-V138 WeakPolarHBondContact O-CG2 3.26Å; D134-V138 PolarHBondContact O-N 3.08Å
135	S	86.9	Confident	90.1	Very high	95 Å²	95	81.9 Å²	81.9	66%	0.664	42%	0.419	S	S	*	.	H	α-helix	trans	-61.7	-51.3	177.9	-179	0	0	0	0	111.5	D133 R137 V138 A139	D133-S135 VanDerWaalsContact C-N 3.34Å; D133-S135 PolarHBondContact O-N 3.26Å; D133-S135 WeakPolarHBondContact OD1-CB 3.4Å; D133-S135 PolarHBondContact OD1-N 3.11Å; D133-S135 VanDerWaalsContact OD1-N 3.11Å; S135-R137 VanDerWaalsContact C-N 3.28Å; S135-R137 PolarHBondContact O-N 3Å; S135-V138 PolarHBondContact O-N 3.06Å; S135-A139 WeakPolarHBondContact O-CB 3.44Å; S135-A139 PolarHBondContact O-N 3.45Å
136	K	87.1	Confident	90	Very high	107 Å²	107	85.7 Å²	85.7	47%	0.465	43%	0.426	S	S	.	.	H	α-helix	trans	-64.9	-30.8	178.6	-66.8	174.5	-171.6	154.7	0	112.4	L132 D133 K140	L132-K136 HydrophobicContact CD2-CB 3.7Å; L132-K136 HydrophobicContact CD2-CD 4.07Å; L132-K136 HydrophobicContact CD2-CG 4.5Å; D133-K136 WeakPolarHBondContact OD1-CB 3.34Å; D133-K136 WeakPolarHBondContact OD1-CG 3.5Å; D133-K136 PolarHBondContact OD1-N 3.33Å; D133-K136 WeakPolarHBondContact OD2-CD 3.47Å; D133-K136 WeakPolarHBondContact OD2-CE 3.4Å; D133-K136 IonicContact OD2-NZ 3.14Å; D133-K136 PolarHBondContact OD2-NZ 3.42Å; D133-K136 VanDerWaalsContact OD2-NZ 3.14Å; K136-K140 WeakPolarHBondContact O-CB 3.23Å; K136-K140 PolarHBondContact O-N 2.79Å
137	R	86.4	Confident	89.8	Confident	67 Å²	67	89 Å²	89	25%	0.253	44%	0.444	S	S	.	.	H	α-helix	trans	-70.3	-43.3	176	-164.9	-176.6	-47.3	117.3	16.7	111.8	L132 D133 D134 S135 K140 R141	L132-R137 PolarHBondContact O-NH2 2.89Å; D133-R137 WeakPolarHBondContact O-CB 3.34Å; D133-R137 PolarHBondContact O-N 3.44Å; D134-R137 PolarHBondContact O-N 3.02Å; D134-R137 IonicContact OD1-CZ 2.69Å; D134-R137 IonicContact OD1-NH1 3.18Å; D134-R137 PolarHBondContact OD1-NH1 2.86Å; D134-R137 IonicContact OD1-NH2 2.87Å; D134-R137 PolarHBondContact OD1-NH2 3.31Å; S135-R137 VanDerWaalsContact C-N 3.28Å; S135-R137 PolarHBondContact O-N 3Å; R137-K140 PolarHBondContact O-N 2.85Å; R137-R141 WeakPolarHBondContact O-CG 3.38Å; R137-R141 PolarHBondContact O-N 3.31Å
138	V	87.8	Confident	89.7	Confident	73 Å²	73	95.5 Å²	95.5	44%	0.442	47%	0.465	S	S	.	.	H	α-helix	trans	-63.4	-45.3	174.5	172.9	0	0	0	0	110	D134 S135 K140 R141 R142	D134-V138 WeakPolarHBondContact O-CG2 3.26Å; D134-V138 PolarHBondContact O-N 3.08Å; S135-V138 PolarHBondContact O-N 3.06Å; V138-K140 PolarHBondContact O-N 3.44Å; V138-R141 PolarHBondContact O-N 3.06Å; V138-R141 VanDerWaalsContact O-N 3.16Å; V138-R142 WeakPolarHBondContact O-CG 3.16Å; V138-R142 PolarHBondContact O-N 2.86Å
139	A	89.6	Confident	89.6	Confident	55 Å²	55	94.7 Å²	94.7	46%	0.455	46%	0.46	S	S	.	.	H	α-helix	trans	-58.3	-45.9	175.9	0	0	0	0	0	112.2	S135 R141 R142 L143	S135-A139 WeakPolarHBondContact O-CB 3.44Å; S135-A139 PolarHBondContact O-N 3.45Å; A139-R141 VanDerWaalsContact C-N 3.34Å; A139-R141 PolarHBondContact O-N 2.84Å; A139-R142 PolarHBondContact O-N 2.75Å; A139-L143 WeakPolarHBondContact O-CB 3.32Å; A139-L143 PolarHBondContact O-N 2.82Å
140	K	89.9	Confident	89.6	Confident	120 Å²	120	94.9 Å²	94.9	52%	0.522	46%	0.455	S	S	.	.	H	α-helix	trans	-60.8	-40.7	175.4	-177.2	175.5	179.4	176	0	112.2	L132 K136 R137 V138 I144	L132-K140 HydrophobicContact CD1-CD 4.41Å; K136-K140 WeakPolarHBondContact O-CB 3.23Å; K136-K140 PolarHBondContact O-N 2.79Å; R137-K140 PolarHBondContact O-N 2.85Å; V138-K140 PolarHBondContact O-N 3.44Å; K140-I144 HydrophobicContact CG-CD1 4.03Å; K140-I144 WeakPolarHBondContact O-CD1 3.41Å; K140-I144 VanDerWaalsContact O-CG1 3.23Å; K140-I144 WeakPolarHBondContact O-CG1 3.4Å; K140-I144 PolarHBondContact O-N 2.8Å
141	R	90	Very high	89.4	Confident	178 Å²	178	99.8 Å²	99.8	67%	0.672	47%	0.468	S	S	*	.	H	α-helix	trans	-64.6	-44.9	176.9	-75.5	-179.7	-178.6	-165.3	0.4	111.7	R137 V138 A139 I144 E145	R137-R141 WeakPolarHBondContact O-CG 3.38Å; R137-R141 PolarHBondContact O-N 3.31Å; V138-R141 PolarHBondContact O-N 3.06Å; V138-R141 VanDerWaalsContact O-N 3.16Å; A139-R141 VanDerWaalsContact C-N 3.34Å; A139-R141 PolarHBondContact O-N 2.84Å; R141-I144 PolarHBondContact O-N 2.75Å; R141-E145 PolarHBondContact O-N 3.24Å; R141-E145 VanDerWaalsContact O-N 3.08Å
142	R	91.6	Very high	89.2	Confident	168 Å²	168	105 Å²	105	63%	0.634	49%	0.49	S	S	*	.	H	α-helix	trans	-58.5	-48	175.7	-72.4	-178.9	-179	-179.2	-0.1	111.6	V138 A139 I144 E145 E146	V138-R142 WeakPolarHBondContact O-CG 3.16Å; V138-R142 PolarHBondContact O-N 2.86Å; A139-R142 PolarHBondContact O-N 2.75Å; R142-I144 VanDerWaalsContact C-N 3.3Å; R142-I144 PolarHBondContact O-N 3.24Å; R142-E145 PolarHBondContact O-N 3.01Å; R142-E145 VanDerWaalsContact O-N 3.11Å; R142-E146 WeakPolarHBondContact O-CG 3.34Å; R142-E146 PolarHBondContact O-N 3.4Å
143	L	92.8	Very high	88.8	Confident	99 Å²	99	108.1 Å²	108.1	52%	0.518	50%	0.501	S	S	.	.	H	α-helix	trans	-61.1	-37	178	-174.9	68.1	0	0	0	112.9	A139 N147	A139-L143 WeakPolarHBondContact O-CB 3.32Å; A139-L143 PolarHBondContact O-N 2.82Å; L143-N147 WeakPolarHBondContact O-CB 3.34Å; L143-N147 VanDerWaalsContact O-CG 3.31Å; L143-N147 PolarHBondContact O-N 2.96Å; L143-N147 PolarHBondContact O-ND2 3.01Å
144	I	91.3	Very high	88.5	Confident	77 Å²	77	110.2 Å²	110.2	40%	0.395	51%	0.508	S	S	.	.	H	α-helix	trans	-65.3	-43.2	175.8	-71	164.3	0	0	0	110.4	K140 R141 R142 N147 R148	K140-I144 HydrophobicContact CG-CD1 4.03Å; K140-I144 WeakPolarHBondContact O-CD1 3.41Å; K140-I144 VanDerWaalsContact O-CG1 3.23Å; K140-I144 WeakPolarHBondContact O-CG1 3.4Å; K140-I144 PolarHBondContact O-N 2.8Å; R141-I144 PolarHBondContact O-N 2.75Å; R142-I144 VanDerWaalsContact C-N 3.3Å; R142-I144 PolarHBondContact O-N 3.24Å; I144-N147 PolarHBondContact O-N 3.24Å; I144-R148 WeakPolarHBondContact O-CG 3.48Å; I144-R148 PolarHBondContact O-N 2.87Å
145	E	91.9	Very high	88.1	Confident	89 Å²	89	112 Å²	112	42%	0.416	51%	0.514	S	S	.	.	H	α-helix	trans	-67.6	-46	-179.8	-162	57.1	-143.8	0	0	111.6	R141 R142 N147 R148 E149	R141-E145 PolarHBondContact O-N 3.24Å; R141-E145 VanDerWaalsContact O-N 3.08Å; R142-E145 PolarHBondContact O-N 3.01Å; R142-E145 VanDerWaalsContact O-N 3.11Å; E145-N147 VanDerWaalsContact C-N 3.29Å; E145-N147 PolarHBondContact O-N 3.03Å; E145-R148 WeakPolarHBondContact O-CB 3.4Å; E145-R148 PolarHBondContact O-N 3.44Å; E145-R148 VanDerWaalsContact O-N 3.07Å; E145-E149 PolarHBondContact O-N 3.45Å
146	E	93.6	Very high	87.3	Confident	123 Å²	123	113.3 Å²	113.3	58%	0.575	51%	0.511	S	S	*	.	H	α-helix	trans	-57.3	-41.5	174.4	-74.8	170.4	-168.5	0	0	112.2	R142 E149 K150	R142-E146 WeakPolarHBondContact O-CG 3.34Å; R142-E146 PolarHBondContact O-N 3.4Å; E146-E149 PolarHBondContact O-N 3.48Å; E146-K150 WeakPolarHBondContact O-CB 3.32Å; E146-K150 PolarHBondContact O-N 2.91Å
147	N	92.4	Very high	86.4	Confident	76 Å²	76	111.6 Å²	111.6	41%	0.406	51%	0.509	S	S	.	.	H	α-helix	trans	-68.9	-33.6	176.6	-79.7	-49.9	0	0	0	113	L143 I144 E145 R151	L143-N147 WeakPolarHBondContact O-CB 3.34Å; L143-N147 VanDerWaalsContact O-CG 3.31Å; L143-N147 PolarHBondContact O-N 2.96Å; L143-N147 PolarHBondContact O-ND2 3.01Å; I144-N147 PolarHBondContact O-N 3.24Å; E145-N147 VanDerWaalsContact C-N 3.29Å; E145-N147 PolarHBondContact O-N 3.03Å; N147-R151 VanDerWaalsContact O-CG 3.32Å; N147-R151 WeakPolarHBondContact O-CG 3.23Å; N147-R151 PolarHBondContact O-N 3.07Å
148	R	92.6	Very high	85.5	Confident	150 Å²	150	115.5 Å²	115.5	57%	0.566	53%	0.528	S	S	*	.	H	α-helix	trans	-66.5	-46.6	173.7	-79.6	176.6	172	-174.7	-5.1	110.8	I144 E145 K150 R151 K152	I144-R148 WeakPolarHBondContact O-CG 3.48Å; I144-R148 PolarHBondContact O-N 2.87Å; E145-R148 WeakPolarHBondContact O-CB 3.4Å; E145-R148 PolarHBondContact O-N 3.44Å; E145-R148 VanDerWaalsContact O-N 3.07Å; R148-K150 VanDerWaalsContact C-N 3.33Å; R148-K150 PolarHBondContact O-N 3.27Å; R148-R151 PolarHBondContact O-N 3.3Å; R148-K152 WeakPolarHBondContact O-CG 3.39Å; R148-K152 PolarHBondContact O-N 2.9Å
149	E	90	Very high	84.2	Confident	74 Å²	74	116.9 Å²	116.9	35%	0.346	54%	0.536	S	S	.	.	H	α-helix	trans	-62.7	-40.6	177	-73.1	-59.7	118.9	0	0	111.7	E145 E146 K152 K153	E145-E149 PolarHBondContact O-N 3.45Å; E146-E149 PolarHBondContact O-N 3.48Å; E149-K152 PolarHBondContact O-N 3Å; E149-K152 IonicContact OE1-NZ 3.45Å; E149-K152 PolarHBondContact OE1-NZ 3.06Å; E149-K153 WeakPolarHBondContact O-CG 3.43Å; E149-K153 PolarHBondContact O-N 3.45Å
150	K	89.3	Confident	82.9	Confident	121 Å²	121	120 Å²	120	53%	0.526	55%	0.545	S	S	.	.	H	α-helix	trans	-60.3	-46.3	173.4	-169.1	-179.3	-177.3	-170.8	0	111.9	E146 R148 K153 E154	E146-K150 WeakPolarHBondContact O-CB 3.32Å; E146-K150 PolarHBondContact O-N 2.91Å; R148-K150 VanDerWaalsContact C-N 3.33Å; R148-K150 PolarHBondContact O-N 3.27Å; K150-K153 PolarHBondContact O-N 3.17Å; K150-E154 WeakPolarHBondContact CE-OE1 3.44Å; K150-E154 IonicContact NZ-OE1 3.96Å; K150-E154 WeakPolarHBondContact O-CG 3.26Å; K150-E154 PolarHBondContact O-N 3.49Å
151	R	86.3	Confident	81.6	Confident	180 Å²	180	121 Å²	121	68%	0.679	55%	0.552	S	S	*	*	H	α-helix	trans	-62.1	-43.4	177.4	-76.4	177.3	-175	-168.9	1.3	112.5	N147 R148 K153 E154 E155	N147-R151 VanDerWaalsContact O-CG 3.32Å; N147-R151 WeakPolarHBondContact O-CG 3.23Å; N147-R151 PolarHBondContact O-N 3.07Å; R148-R151 PolarHBondContact O-N 3.3Å; R151-K153 VanDerWaalsContact C-N 3.33Å; R151-K153 PolarHBondContact O-N 2.96Å; R151-E154 PolarHBondContact O-N 3.42Å; R151-E155 VanDerWaalsContact O-CB 3.31Å; R151-E155 WeakPolarHBondContact O-CB 3.44Å; R151-E155 PolarHBondContact O-N 2.81Å
152	K	85	Confident	80.7	Confident	121 Å²	121	117.6 Å²	117.6	53%	0.526	55%	0.551	S	S	.	*	H	α-helix	trans	-59.4	-44.1	175.2	-73.3	178.3	-172.7	165.3	0	111.6	R148 E149 E155 M156	R148-K152 WeakPolarHBondContact O-CG 3.39Å; R148-K152 PolarHBondContact O-N 2.9Å; E149-K152 PolarHBondContact O-N 3Å; E149-K152 IonicContact OE1-NZ 3.45Å; E149-K152 PolarHBondContact OE1-NZ 3.06Å; K152-E155 PolarHBondContact O-N 3.1Å; K152-M156 WeakPolarHBondContact O-CB 3.31Å; K152-M156 PolarHBondContact O-N 3.49Å
153	K	80.3	Confident	80	Confident	136 Å²	136	114.1 Å²	114.1	59%	0.591	54%	0.537	S	S	*	.	H	α-helix	trans	-63.1	-45.2	176.3	-72.8	178.5	-179.4	-177.4	0	111.9	E149 K150 R151 M156 V157	E149-K153 WeakPolarHBondContact O-CG 3.43Å; E149-K153 PolarHBondContact O-N 3.45Å; K150-K153 PolarHBondContact O-N 3.17Å; R151-K153 VanDerWaalsContact C-N 3.33Å; R151-K153 PolarHBondContact O-N 2.96Å; K153-M156 PolarHBondContact O-N 2.91Å; K153-V157 VanDerWaalsContact O-CG2 3.26Å; K153-V157 WeakPolarHBondContact O-CG2 3.34Å; K153-V157 PolarHBondContact O-N 3.26Å
154	E	79.8	Confident	79.8	Confident	106 Å²	106	112.5 Å²	112.5	50%	0.495	53%	0.533	S	S	.	.	H	α-helix	trans	-62.1	-41.4	177.2	-73.9	171.9	176.4	0	0	112.1	K150 R151 V157 K158	K150-E154 WeakPolarHBondContact CE-OE1 3.44Å; K150-E154 IonicContact NZ-OE1 3.96Å; K150-E154 WeakPolarHBondContact O-CG 3.26Å; K150-E154 PolarHBondContact O-N 3.49Å; R151-E154 PolarHBondContact O-N 3.42Å; E154-V157 PolarHBondContact O-N 3.44Å; E154-K158 WeakPolarHBondContact O-CB 3.5Å; E154-K158 PolarHBondContact O-N 2.94Å
155	E	74.8	Confident	79.8	Confident	137 Å²	137	114.7 Å²	114.7	64%	0.64	54%	0.542	S	S	*	.	H	α-helix	trans	-68.6	-42.2	178.5	-165.4	164	-149.4	0	0	111.8	R151 K152 V157 K158 T159	R151-E155 VanDerWaalsContact O-CB 3.31Å; R151-E155 WeakPolarHBondContact O-CB 3.44Å; R151-E155 PolarHBondContact O-N 2.81Å; K152-E155 PolarHBondContact O-N 3.1Å; E155-V157 VanDerWaalsContact C-N 3.34Å; E155-V157 PolarHBondContact O-N 3.26Å; E155-K158 WeakPolarHBondContact O-CB 3.4Å; E155-K158 PolarHBondContact O-N 2.9Å; E155-T159 PolarHBondContact O-N 2.97Å; E155-T159 PolarHBondContact O-OG1 2.89Å; E155-T159 VanDerWaalsContact O-OG1 3.11Å
156	M	71.3	Confident	80	Confident	123 Å²	123	111 Å²	111	61%	0.606	53%	0.525	S	S	*	.	H	α-helix	trans	-60.2	-42.5	173.4	-169.9	178.5	81.3	0	0	112	K152 K153 K158 L160	K152-M156 WeakPolarHBondContact O-CB 3.31Å; K152-M156 PolarHBondContact O-N 3.49Å; K153-M156 PolarHBondContact O-N 2.91Å; M156-K158 VanDerWaalsContact C-N 3.34Å; M156-L160 WeakPolarHBondContact O-CD1 3.49Å; M156-L160 WeakPolarHBondContact O-CG 3.43Å; M156-L160 PolarHBondContact O-N 3.45Å
157	V	68.7	Low	80.1	Confident	70 Å²	70	109 Å²	109	42%	0.424	52%	0.521	S	S	.	.	H	α-helix	trans	-65.4	-38.3	175.4	170.2	0	0	0	0	111.3	K153 E154 E155 L160 Q161	K153-V157 VanDerWaalsContact O-CG2 3.26Å; K153-V157 WeakPolarHBondContact O-CG2 3.34Å; K153-V157 PolarHBondContact O-N 3.26Å; E154-V157 PolarHBondContact O-N 3.44Å; E155-V157 VanDerWaalsContact C-N 3.34Å; E155-V157 PolarHBondContact O-N 3.26Å; V157-L160 PolarHBondContact O-N 3.41Å; V157-Q161 WeakPolarHBondContact O-CG 3.37Å; V157-Q161 PolarHBondContact O-N 3.17Å
158	K	66.8	Low	80.3	Confident	150 Å²	150	110.9 Å²	110.9	65%	0.652	54%	0.536	S	S	*	.	H	α-helix	trans	-66.9	-40.9	179.8	-165.1	179.8	-178.7	-173.1	0	112.3	E154 E155 M156 L160 Q161 T162	E154-K158 WeakPolarHBondContact O-CB 3.5Å; E154-K158 PolarHBondContact O-N 2.94Å; E155-K158 WeakPolarHBondContact O-CB 3.4Å; E155-K158 PolarHBondContact O-N 2.9Å; M156-K158 VanDerWaalsContact C-N 3.34Å; K158-L160 VanDerWaalsContact C-N 3.29Å; K158-L160 PolarHBondContact O-N 3.08Å; K158-Q161 PolarHBondContact O-N 3.44Å; K158-Q161 VanDerWaalsContact O-N 3.08Å; K158-T162 PolarHBondContact O-N 3.13Å
159	T	61.4	Low	80.5	Confident	101 Å²	101	107.2 Å²	107.2	62%	0.62	54%	0.537	S	S	*	.	H	α-helix	trans	-63.4	-35.4	174.9	-53.3	0	0	0	0	111.9	E155 Q161 T162	E155-T159 PolarHBondContact O-N 2.97Å; E155-T159 PolarHBondContact O-OG1 2.89Å; E155-T159 VanDerWaalsContact O-OG1 3.11Å; T159-Q161 VanDerWaalsContact C-N 3.27Å; T159-Q161 PolarHBondContact O-N 3.31Å; T159-T162 PolarHBondContact O-OG1 3.37Å; T159-T162 VanDerWaalsContact O-OG1 3.05Å
160	L	60.5	Low	80.8	Confident	122 Å²	122	105 Å²	105	64%	0.639	53%	0.527	S	S	*	.	H	α-helix	trans	-72.3	-15.5	174	-70.3	165.2	0	0	0	113.9	M156 V157 K158	M156-L160 WeakPolarHBondContact O-CD1 3.49Å; M156-L160 WeakPolarHBondContact O-CG 3.43Å; M156-L160 PolarHBondContact O-N 3.45Å; V157-L160 PolarHBondContact O-N 3.41Å; K158-L160 VanDerWaalsContact C-N 3.29Å; K158-L160 PolarHBondContact O-N 3.08Å
161	Q	64.2	Low	81.3	Confident	141 Å²	141	103.7 Å²	103.7	66%	0.659	52%	0.519	S	S	*	.	H	α-helix	trans	-93.6	-22.1	-178.8	-78.8	176.1	-10.8	0	0	113.7	V157 K158 T159 R163	V157-Q161 WeakPolarHBondContact O-CG 3.37Å; V157-Q161 PolarHBondContact O-N 3.17Å; K158-Q161 PolarHBondContact O-N 3.44Å; K158-Q161 VanDerWaalsContact O-N 3.08Å; T159-Q161 VanDerWaalsContact C-N 3.27Å; T159-Q161 PolarHBondContact O-N 3.31Å; Q161-R163 VanDerWaalsContact C-N 3.25Å; Q161-R163 PolarHBondContact O-N 3.05Å
162	T	69.4	Low	81.8	Confident	106 Å²	106	99 Å²	99	65%	0.65	51%	0.507	S	S	*	.			trans	-72.1	87.7	165.8	29.7	0	0	0	0	108.8	K158 T159 P164	K158-T162 PolarHBondContact O-N 3.13Å; T159-T162 PolarHBondContact O-OG1 3.37Å; T159-T162 VanDerWaalsContact O-OG1 3.05Å; T162-P164 WeakPolarHBondContact O-CD 3.16Å
163	R	78.6	Confident	82.4	Confident	94 Å²	94	94.2 Å²	94.2	36%	0.355	49%	0.487	S	S	.	.			trans	-93.7	100.1	172.1	-70.2	-170.3	-174.1	-172.5	13.1	108.1	Q161 E165 N365 H369	Q161-R163 VanDerWaalsContact C-N 3.25Å; Q161-R163 PolarHBondContact O-N 3.05Å; R163-E165 PolarHBondContact O-N 3.01Å; R163-N365 HydrophobicContact CB-CB 3.9Å; R163-N365 WeakPolarHBondContact CD-OD1 3.35Å; R163-H369 PolarHBondContact NH1-O 3.22Å
164	P	87.1	Confident	83.2	Confident	65 Å²	65	87.9 Å²	87.9	42%	0.422	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-58.3	136.6	177.2	20.3	-30	0	0	0	110.7	T162 H362 N365	T162-P164 WeakPolarHBondContact O-CD 3.16Å; P164-H362 WeakPolarHBondContact CB-NE2 3.23Å; P164-H362 VanDerWaalsContact CG-CD2 3.43Å; P164-H362 WeakPolarHBondContact CG-CD2 3.39Å; P164-H362 WeakPolarHBondContact CG-NE2 3.48Å; P164-H362 WeakPolarHBondContact O-CA 3.5Å; P164-N365 VanDerWaalsContact O-CB 3.29Å; P164-N365 WeakPolarHBondContact O-CB 3.39Å; P164-N365 PolarHBondContact O-ND2 3.5Å
165	E	91.4	Very high	84.1	Confident	124 Å²	124	89.8 Å²	89.8	58%	0.579	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-93.8	162	171.6	-67.6	-175.8	-174.6	0	0	110	R163 T167 Y366	R163-E165 PolarHBondContact O-N 3.01Å; E165-T167 PolarHBondContact O-N 3.33Å; E165-Y366 HydrophobicContact CG-CD2 4.48Å
166	P	96.4	Very high	85.1	Confident	12 Å²	12	86.8 Å²	86.8	8%	0.078	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-65.8	133.2	-175.4	-15.9	28.3	0	0	0	111.3	E170 W171 I174 H362	P166-E170 WeakPolarHBondContact CA-OE2 3.4Å; P166-E170 HydrophobicContact CB-CB 4.05Å; P166-W171 HydrophobicContact CB-CD2 4.19Å; P166-W171 HydrophobicContact CB-CG 4.22Å; P166-W171 HydrophobicContact CB-CZ2 4.34Å; P166-W171 HydrophobicContact CG-CZ2 3.87Å; P166-W171 PolarHBondContact O-NE1 3.27Å; P166-I174 HydrophobicContact CB-CD1 3.95Å; P166-I174 HydrophobicContact CG-CD1 4.11Å; P166-H362 HydrophobicContact CB-CB 4.19Å; P166-H362 WeakPolarHBondContact CD-O 3.45Å; P166-H362 HydrophobicContact CG-CB 3.89Å
167	T	96.6	Very high	86.4	Confident	79 Å²	79	80.9 Å²	80.9	49%	0.485	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-67.6	167	169.1	63.5	0	0	0	0	110.9	E165 A169 E170 W171	E165-T167 PolarHBondContact O-N 3.33Å; T167-A169 VanDerWaalsContact C-N 3.31Å; T167-A169 PolarHBondContact O-N 3.35Å; T167-E170 WeakPolarHBondContact CB-OE2 3.45Å; T167-E170 WeakPolarHBondContact CG2-OE2 3.47Å; T167-E170 PolarHBondContact N-OE2 3.11Å; T167-E170 PolarHBondContact O-N 3.26Å; T167-E170 VanDerWaalsContact OG1-CG 3.28Å; T167-E170 WeakPolarHBondContact OG1-CG 3.33Å; T167-E170 PolarHBondContact OG1-N 2.76Å; T167-E170 PolarHBondContact OG1-OE2 2.91Å; T167-W171 VanDerWaalsContact O-CD1 3.28Å; T167-W171 PolarHBondContact O-N 3.45Å
168	V	96.6	Very high	87.8	Confident	117 Å²	117	78.1 Å²	78.1	71%	0.709	40%	0.404	S	S	*	.	H	α-helix	trans	-57.9	-43.6	178.8	179.7	0	0	0	0	111.7	E170 W171 D172	V168-E170 VanDerWaalsContact C-N 3.35Å; V168-E170 PolarHBondContact O-N 3.43Å; V168-W171 WeakPolarHBondContact O-CB 3.27Å; V168-W171 PolarHBondContact O-N 2.92Å; V168-D172 PolarHBondContact O-N 3.44Å; V168-D172 VanDerWaalsContact O-N 3.11Å
169	A	96.1	Very high	89.2	Confident	73 Å²	73	74.7 Å²	74.7	60%	0.603	39%	0.391	S	S	*	.	H	α-helix	trans	-65.1	-38.4	178	0	0	0	0	0	112.3	T167 D172 L173	T167-A169 VanDerWaalsContact C-N 3.31Å; T167-A169 PolarHBondContact O-N 3.35Å; A169-D172 PolarHBondContact O-N 3.05Å; A169-L173 PolarHBondContact O-N 3.3Å; A169-L173 VanDerWaalsContact O-N 3.08Å
170	E	97.3	Very high	90.9	Very high	26 Å²	26	70 Å²	70	12%	0.121	36%	0.363	C	S	.	.	H	α-helix	trans	-66.7	-38.4	174.5	-71	167.7	139.4	0	0	111.4	P166 T167 V168 D172 L173 I174 A359 H362	P166-E170 WeakPolarHBondContact CA-OE2 3.4Å; P166-E170 HydrophobicContact CB-CB 4.05Å; T167-E170 WeakPolarHBondContact CB-OE2 3.45Å; T167-E170 WeakPolarHBondContact CG2-OE2 3.47Å; T167-E170 PolarHBondContact N-OE2 3.11Å; T167-E170 PolarHBondContact O-N 3.26Å; T167-E170 VanDerWaalsContact OG1-CG 3.28Å; T167-E170 WeakPolarHBondContact OG1-CG 3.33Å; T167-E170 PolarHBondContact OG1-N 2.76Å; T167-E170 PolarHBondContact OG1-OE2 2.91Å; V168-E170 VanDerWaalsContact C-N 3.35Å; V168-E170 PolarHBondContact O-N 3.43Å; E170-D172 VanDerWaalsContact C-N 3.32Å; E170-D172 PolarHBondContact O-N 2.94Å; E170-L173 PolarHBondContact O-N 3.49Å; E170-I174 HydrophobicContact CB-CD1 4.46Å; E170-I174 VanDerWaalsContact O-CB 3.29Å; E170-I174 WeakPolarHBondContact O-CB 3.46Å; E170-I174 WeakPolarHBondContact O-CD1 3.5Å; E170-I174 WeakPolarHBondContact O-CG1 3.33Å; E170-I174 PolarHBondContact O-N 3.3Å; E170-A359 HydrophobicContact CB-CB 4.15Å; E170-A359 HydrophobicContact CG-CB 4.1Å; E170-H362 VanDerWaalsContact CD-ND1 3.28Å; E170-H362 IonicContact OE1-CE1 3.75Å; E170-H362 PolarHBondContact OE1-CE1 3.29Å; E170-H362 VanDerWaalsContact OE1-CE1 3.3Å; E170-H362 IonicContact OE1-CG 3.08Å; E170-H362 IonicContact OE1-ND1 2.77Å; E170-H362 PolarHBondContact OE1-ND1 3Å; E170-H362 IonicContact OE2-CE1 3.12Å; E170-H362 IonicContact OE2-ND1 2.86Å; E170-H362 PolarHBondContact OE2-ND1 3.28Å
171	W	98	Very high	92.6	Very high	95 Å²	95	64.2 Å²	64.2	36%	0.36	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-40.7	174.2	-85.4	116.1	0	0	0	112.8	P166 T167 V168 I174 R175 Y363 Y366	P166-W171 HydrophobicContact CB-CD2 4.19Å; P166-W171 HydrophobicContact CB-CG 4.22Å; P166-W171 HydrophobicContact CB-CZ2 4.34Å; P166-W171 HydrophobicContact CG-CZ2 3.87Å; P166-W171 PolarHBondContact O-NE1 3.27Å; T167-W171 VanDerWaalsContact O-CD1 3.28Å; T167-W171 PolarHBondContact O-N 3.45Å; V168-W171 WeakPolarHBondContact O-CB 3.27Å; V168-W171 PolarHBondContact O-N 2.92Å; W171-I174 HydrophobicContact CE3-CD1 4.41Å; W171-I174 HydrophobicContact CE3-CG2 4.35Å; W171-I174 HydrophobicContact CZ3-CG2 4.38Å; W171-I174 PolarHBondContact O-N 2.95Å; W171-R175 WeakPolarHBondContact O-CB 3.24Å; W171-R175 PolarHBondContact O-N 2.91Å; W171-Y363 AromaticContact CH2-CD2 3.65Å; W171-Y363 HydrophobicContact CH2-CD2 3.65Å; W171-Y363 AromaticContact CH2-CE2 3.53Å; W171-Y363 HydrophobicContact CH2-CE2 3.53Å; W171-Y363 AromaticContact CZ3-CD2 3.75Å; W171-Y363 HydrophobicContact CZ3-CD2 3.75Å; W171-Y363 AromaticContact CZ3-CE2 3.55Å; W171-Y363 HydrophobicContact CZ3-CE2 3.55Å; W171-Y366 AromaticContact CH2-CD1 3.94Å; W171-Y366 HydrophobicContact CH2-CD1 3.94Å; W171-Y366 AromaticContact CH2-CE1 3.95Å; W171-Y366 HydrophobicContact CH2-CE1 3.95Å; W171-Y366 AromaticContact CZ2-CD1 3.98Å; W171-Y366 HydrophobicContact CZ2-CD1 3.98Å; W171-Y366 HydrophobicContact CZ2-CE1 4.08Å; W171-Y366 HydrophobicContact CZ2-CG 4.26Å
172	D	97.3	Very high	94	Very high	80 Å²	80	64 Å²	64	43%	0.428	33%	0.325	S	S	.	.	H	α-helix	trans	-64.2	-44.4	175.1	-78	-39.9	0	0	0	111.8	V168 A169 E170 R175 L176	V168-D172 PolarHBondContact O-N 3.44Å; V168-D172 VanDerWaalsContact O-N 3.11Å; A169-D172 PolarHBondContact O-N 3.05Å; E170-D172 VanDerWaalsContact C-N 3.32Å; E170-D172 PolarHBondContact O-N 2.94Å; D172-R175 PolarHBondContact O-N 2.61Å; D172-R175 IonicContact OD1-NH2 4Å; D172-L176 WeakPolarHBondContact O-CG 3.39Å; D172-L176 PolarHBondContact O-N 3.35Å
173	L	97.1	Very high	95.2	Very high	21 Å²	21	64.8 Å²	64.8	11%	0.11	32%	0.321	C	S	.	.	H	α-helix	trans	-60.6	-49.3	174.7	-177.8	63.1	0	0	0	111.6	A169 E170 R175 L176 V177 P245 M246 T355 Y356 A359	A169-L173 PolarHBondContact O-N 3.3Å; A169-L173 VanDerWaalsContact O-N 3.08Å; E170-L173 PolarHBondContact O-N 3.49Å; L173-R175 VanDerWaalsContact C-N 3.26Å; L173-R175 PolarHBondContact O-N 2.76Å; L173-L176 PolarHBondContact O-N 2.8Å; L173-L176 VanDerWaalsContact O-N 3.14Å; L173-V177 HydrophobicContact CD1-CG2 4.24Å; L173-V177 HydrophobicContact CG-CG2 4.37Å; L173-V177 VanDerWaalsContact O-CG2 3.25Å; L173-V177 WeakPolarHBondContact O-CG2 3.43Å; L173-V177 PolarHBondContact O-N 3.01Å; L173-P245 HydrophobicContact CD1-CG 3.71Å; L173-M246 HydrophobicContact CD1-CE 4.32Å; L173-M246 HydrophobicContact CD2-CE 4.24Å; L173-T355 HydrophobicContact CD2-CG2 3.76Å; L173-Y356 HydrophobicContact CD1-CD1 4.48Å; L173-Y356 HydrophobicContact CD1-CE1 3.71Å; L173-Y356 HydrophobicContact CD2-CD1 3.96Å; L173-Y356 HydrophobicContact CD2-CE1 4Å; L173-Y356 HydrophobicContact CG-CD1 4.28Å; L173-Y356 HydrophobicContact CG-CE1 3.98Å; L173-A359 HydrophobicContact CD2-CB 4.42Å
174	I	98.3	Very high	96	Very high	3 Å²	3	60.5 Å²	60.5	2%	0.015	31%	0.306	C	S	.	.	H	α-helix	trans	-55.8	-43.9	178.2	-73.1	163.7	0	0	0	110.3	P166 E170 W171 T178 T325 L329 A359 Y363	P166-I174 HydrophobicContact CB-CD1 3.95Å; P166-I174 HydrophobicContact CG-CD1 4.11Å; E170-I174 HydrophobicContact CB-CD1 4.46Å; E170-I174 VanDerWaalsContact O-CB 3.29Å; E170-I174 WeakPolarHBondContact O-CB 3.46Å; E170-I174 WeakPolarHBondContact O-CD1 3.5Å; E170-I174 WeakPolarHBondContact O-CG1 3.33Å; E170-I174 PolarHBondContact O-N 3.3Å; W171-I174 HydrophobicContact CE3-CD1 4.41Å; W171-I174 HydrophobicContact CE3-CG2 4.35Å; W171-I174 HydrophobicContact CZ3-CG2 4.38Å; W171-I174 PolarHBondContact O-N 2.95Å; I174-T178 VanDerWaalsContact O-CB 3.29Å; I174-T178 WeakPolarHBondContact O-CB 3.41Å; I174-T178 PolarHBondContact O-N 3.38Å; I174-T178 PolarHBondContact O-OG1 3.17Å; I174-T325 HydrophobicContact CG2-CG2 3.38Å; I174-L329 HydrophobicContact CG1-CD1 4.17Å; I174-L329 HydrophobicContact CG1-CD2 4.3Å; I174-A359 HydrophobicContact CD1-CB 4.3Å; I174-A359 HydrophobicContact CG1-CB 4.12Å; I174-Y363 HydrophobicContact CD1-CD2 4.13Å; I174-Y363 HydrophobicContact CD1-CG 4.46Å; I174-Y363 HydrophobicContact CG2-CD2 4.21Å; I174-Y363 HydrophobicContact CG2-CE2 4.4Å
175	R	98	Very high	96	Very high	146 Å²	146	58.4 Å²	58.4	55%	0.551	29%	0.291	S	S	*	.	H	α-helix	trans	-62.5	-46.5	177.5	-176.1	-179.7	62.7	80.1	1.9	111.6	W171 D172 L173 T178 E179	W171-R175 WeakPolarHBondContact O-CB 3.24Å; W171-R175 PolarHBondContact O-N 2.91Å; D172-R175 PolarHBondContact O-N 2.61Å; D172-R175 IonicContact OD1-NH2 4Å; L173-R175 VanDerWaalsContact C-N 3.26Å; L173-R175 PolarHBondContact O-N 2.76Å; R175-T178 PolarHBondContact O-N 3.1Å; R175-E179 WeakPolarHBondContact O-CB 3.5Å; R175-E179 PolarHBondContact O-N 2.91Å
176	L	96.9	Very high	95.3	Very high	74 Å²	74	53.1 Å²	53.1	39%	0.387	27%	0.268	S	S	.	.	H	α-helix	trans	-60.7	-47	178.5	-70.9	169.8	0	0	0	111.8	D172 L173 E179 A180 P245	D172-L176 WeakPolarHBondContact O-CG 3.39Å; D172-L176 PolarHBondContact O-N 3.35Å; L173-L176 PolarHBondContact O-N 2.8Å; L173-L176 VanDerWaalsContact O-N 3.14Å; L176-E179 PolarHBondContact O-N 3.3Å; L176-A180 WeakPolarHBondContact O-CB 3.44Å; L176-A180 PolarHBondContact O-N 3.23Å; L176-P245 HydrophobicContact CD1-CG 4.44Å
177	V	97.6	Very high	94	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.8	-42.5	179.6	179.9	0	0	0	0	111	L173 E179 A180 H181 F240 L244 A328 L329 A332 Y356	L173-V177 HydrophobicContact CD1-CG2 4.24Å; L173-V177 HydrophobicContact CG-CG2 4.37Å; L173-V177 VanDerWaalsContact O-CG2 3.25Å; L173-V177 WeakPolarHBondContact O-CG2 3.43Å; L173-V177 PolarHBondContact O-N 3.01Å; V177-E179 VanDerWaalsContact C-N 3.33Å; V177-E179 PolarHBondContact O-N 3.39Å; V177-A180 WeakPolarHBondContact O-CB 3.43Å; V177-A180 PolarHBondContact O-N 2.96Å; V177-H181 PolarHBondContact O-N 3.12Å; V177-F240 HydrophobicContact CG1-CE2 4.49Å; V177-F240 HydrophobicContact CG1-CZ 4.29Å; V177-L244 HydrophobicContact CB-CD2 4.28Å; V177-L244 HydrophobicContact CG1-CD2 4.17Å; V177-L244 HydrophobicContact CG2-CD2 4.01Å; V177-A328 HydrophobicContact CG1-CB 3.81Å; V177-A328 WeakPolarHBondContact CG1-O 3.26Å; V177-L329 HydrophobicContact CB-CD2 4.47Å; V177-L329 HydrophobicContact CG1-CD2 4.29Å; V177-A332 HydrophobicContact CG1-CB 4.04Å; V177-Y356 HydrophobicContact CG2-CD1 4.07Å; V177-Y356 HydrophobicContact CG2-CE1 3.42Å; V177-Y356 VanDerWaalsContact CG2-CE1 3.42Å
178	T	97.8	Very high	92.8	Very high	11 Å²	11	53.5 Å²	53.5	7%	0.067	27%	0.273	C	S	.	.	H	α-helix	trans	-61	-43.8	176.5	-57.6	0	0	0	0	111.1	I174 R175 H181 R182 D324 T325	I174-T178 VanDerWaalsContact O-CB 3.29Å; I174-T178 WeakPolarHBondContact O-CB 3.41Å; I174-T178 PolarHBondContact O-N 3.38Å; I174-T178 PolarHBondContact O-OG1 3.17Å; R175-T178 PolarHBondContact O-N 3.1Å; T178-H181 WeakPolarHBondContact O-CB 3.23Å; T178-H181 PolarHBondContact O-N 2.77Å; T178-R182 WeakPolarHBondContact O-CG 3.4Å; T178-R182 PolarHBondContact O-N 2.82Å; T178-D324 HydrophobicContact CG2-CB 4.35Å; T178-T325 VanDerWaalsContact CG2-OG1 3.31Å; T178-T325 WeakPolarHBondContact CG2-OG1 3.39Å; T178-T325 WeakPolarHBondContact OG1-CB 3.39Å; T178-T325 WeakPolarHBondContact OG1-CG2 3.08Å; T178-T325 PolarHBondContact OG1-OG1 3.06Å
179	E	96.8	Very high	91.4	Very high	79 Å²	79	52.7 Å²	52.7	37%	0.369	28%	0.279	S	S	.	.	H	α-helix	trans	-68.7	-38.7	179.8	-167.9	58.1	-156.3	0	0	112.2	R175 L176 V177 H181 R182 H183	R175-E179 WeakPolarHBondContact O-CB 3.5Å; R175-E179 PolarHBondContact O-N 2.91Å; L176-E179 PolarHBondContact O-N 3.3Å; V177-E179 VanDerWaalsContact C-N 3.33Å; V177-E179 PolarHBondContact O-N 3.39Å; E179-H181 VanDerWaalsContact C-N 3.3Å; E179-H181 PolarHBondContact O-N 2.86Å; E179-R182 PolarHBondContact O-N 2.92Å; E179-H183 WeakPolarHBondContact O-CB 3.46Å; E179-H183 PolarHBondContact O-N 3.28Å; E179-H183 PolarHBondContact O-ND1 3.49Å; E179-H183 IonicContact OE1-CD2 3.3Å; E179-H183 IonicContact OE1-CE1 2.82Å; E179-H183 PolarHBondContact OE1-CE1 3.08Å; E179-H183 IonicContact OE1-ND1 2.86Å; E179-H183 PolarHBondContact OE1-ND1 2.82Å; E179-H183 IonicContact OE1-NE2 3.92Å; E179-H183 PolarHBondContact OE1-NE2 3.01Å; E179-H183 VanDerWaalsContact OE1-NE2 3.16Å
180	A	97.1	Very high	90.3	Very high	3 Å²	3	54.9 Å²	54.9	3%	0.025	28%	0.276	C	S	.	.	H	α-helix	trans	-58	-44.3	171.5	0	0	0	0	0	111.3	L176 V177 T184 F240 K243 L244	L176-A180 WeakPolarHBondContact O-CB 3.44Å; L176-A180 PolarHBondContact O-N 3.23Å; V177-A180 WeakPolarHBondContact O-CB 3.43Å; V177-A180 PolarHBondContact O-N 2.96Å; A180-T184 WeakPolarHBondContact O-CB 3.27Å; A180-T184 WeakPolarHBondContact O-CG2 3.36Å; A180-T184 PolarHBondContact O-N 2.94Å; A180-T184 PolarHBondContact O-OG1 3.37Å; A180-F240 HydrophobicContact CB-CD2 3.89Å; A180-F240 HydrophobicContact CB-CE2 3.98Å; A180-K243 HydrophobicContact CB-CB 3.53Å; A180-K243 HydrophobicContact CB-CD 4.23Å; A180-L244 HydrophobicContact CB-CD2 3.94Å
181	H	96.3	Very high	89.4	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-49.3	176	172.9	53.1	0	0	0	111.6	V177 T178 E179 H183 T184 N185 F240 D324 A328 Q331	V177-H181 PolarHBondContact O-N 3.12Å; T178-H181 WeakPolarHBondContact O-CB 3.23Å; T178-H181 PolarHBondContact O-N 2.77Å; E179-H181 VanDerWaalsContact C-N 3.3Å; E179-H181 PolarHBondContact O-N 2.86Å; H181-H183 PolarHBondContact O-N 3.19Å; H181-T184 CarbonylContact O-C 3.57Å; H181-T184 PolarHBondContact O-N 2.85Å; H181-T184 VanDerWaalsContact O-N 3.07Å; H181-T184 PolarHBondContact O-OG1 2.9Å; H181-N185 PolarHBondContact NE2-ND2 3.24Å; H181-N185 VanDerWaalsContact O-CB 3.26Å; H181-N185 WeakPolarHBondContact O-CB 3.29Å; H181-N185 PolarHBondContact O-N 3.45Å; H181-F240 HydrophobicContact CB-CD2 4.3Å; H181-F240 HydrophobicContact CB-CE2 3.95Å; H181-D324 PolarHBondContact CD2-O 3.13Å; H181-A328 HydrophobicContact CB-CB 3.42Å; H181-A328 VanDerWaalsContact CB-CB 3.42Å; H181-Q331 PolarHBondContact CE1-NE2 3.25Å; H181-Q331 PolarHBondContact ND1-NE2 3.41Å
182	R	94.5	Very high	88.5	Confident	137 Å²	137	55 Å²	55	52%	0.517	28%	0.278	S	S	.	.	H	α-helix	trans	-59.9	-43.1	-178.2	-75.2	177.8	168.7	-177.8	1.2	113	T178 E179 T184 D324	T178-R182 WeakPolarHBondContact O-CG 3.4Å; T178-R182 PolarHBondContact O-N 2.82Å; E179-R182 PolarHBondContact O-N 2.92Å; R182-T184 PolarHBondContact O-N 3.33Å; R182-D324 IonicContact CZ-OD2 3.39Å; R182-D324 IonicContact NE-OD2 2.77Å; R182-D324 PolarHBondContact NE-OD2 2.87Å; R182-D324 IonicContact NH2-OD2 2.87Å; R182-D324 PolarHBondContact NH2-OD2 3.36Å; R182-D324 VanDerWaalsContact NH2-OD2 3.08Å
183	H	94.1	Very high	87.6	Confident	121 Å²	121	58.5 Å²	58.5	56%	0.56	29%	0.292	S	S	*	.	H	α-helix	trans	-65.5	-22.8	177.1	-77.3	138.3	0	0	0	114.2	E179 H181	E179-H183 WeakPolarHBondContact O-CB 3.46Å; E179-H183 PolarHBondContact O-N 3.28Å; E179-H183 PolarHBondContact O-ND1 3.49Å; E179-H183 IonicContact OE1-CD2 3.3Å; E179-H183 IonicContact OE1-CE1 2.82Å; E179-H183 PolarHBondContact OE1-CE1 3.08Å; E179-H183 IonicContact OE1-ND1 2.86Å; E179-H183 PolarHBondContact OE1-ND1 2.82Å; E179-H183 IonicContact OE1-NE2 3.92Å; E179-H183 PolarHBondContact OE1-NE2 3.01Å; E179-H183 VanDerWaalsContact OE1-NE2 3.16Å; H181-H183 PolarHBondContact O-N 3.19Å
184	T	94.6	Very high	86.8	Confident	5 Å²	5	61.3 Å²	61.3	3%	0.031	31%	0.307	C	S	.	.	H	α-helix	trans	-113.6	-1.9	-174.2	61.9	0	0	0	0	112.9	A180 H181 R182 R236 D239 F240 K243 R273	A180-T184 WeakPolarHBondContact O-CB 3.27Å; A180-T184 WeakPolarHBondContact O-CG2 3.36Å; A180-T184 PolarHBondContact O-N 2.94Å; A180-T184 PolarHBondContact O-OG1 3.37Å; H181-T184 CarbonylContact O-C 3.57Å; H181-T184 PolarHBondContact O-N 2.85Å; H181-T184 VanDerWaalsContact O-N 3.07Å; H181-T184 PolarHBondContact O-OG1 2.9Å; R182-T184 PolarHBondContact O-N 3.33Å; T184-R236 WeakPolarHBondContact CB-O 3.33Å; T184-R236 WeakPolarHBondContact O-CB 3.49Å; T184-R236 VanDerWaalsContact O-CD 3.26Å; T184-R236 WeakPolarHBondContact O-CD 3.37Å; T184-R236 WeakPolarHBondContact O-CG 3.4Å; T184-D239 HydrophobicContact CG2-CB 3.83Å; T184-F240 HydrophobicContact CG2-CB 4.26Å; T184-K243 HydrophobicContact CG2-CD 4.24Å; T184-R273 PolarHBondContact O-NH1 3.27Å; T184-R273 PolarHBondContact OG1-NH2 3.17Å; T184-R273 VanDerWaalsContact OG1-NH2 3.16Å
185	N	87.5	Confident	86.1	Confident	20 Å²	20	63.1 Å²	63.1	11%	0.107	31%	0.314	C	S	.	.	S	Bend	trans	-84.9	131.4	176.5	-165.9	17.4	0	0	0	110	H181 Q187	H181-N185 PolarHBondContact NE2-ND2 3.24Å; H181-N185 VanDerWaalsContact O-CB 3.26Å; H181-N185 WeakPolarHBondContact O-CB 3.29Å; H181-N185 PolarHBondContact O-N 3.45Å; N185-Q187 PolarHBondContact O-N 3.28Å
186	A	76.4	Confident	85.6	Confident	13 Å²	13	64 Å²	64	11%	0.107	32%	0.322	C	S	.	.	S	Bend	trans	-72.2	124.2	-179.4	0	0	0	0	0	110.9	G188 S288	A186-G188 PolarHBondContact O-N 2.75Å; A186-S288 VanDerWaalsContact CB-O 3.27Å; A186-S288 WeakPolarHBondContact CB-O 3.28Å
187	Q	69.6	Low	85.1	Confident	65 Å²	65	65.1 Å²	65.1	30%	0.304	32%	0.323	S	S	.	.	S	Bend	trans	62.3	7.4	170.5	-55.4	-170.2	-5.7	0	0	117.2	N185 Q190 N194 G289	N185-Q187 PolarHBondContact O-N 3.28Å; Q187-Q190 PolarHBondContact O-N 2.9Å; Q187-N194 VanDerWaalsContact OE1-CB 3.22Å; Q187-G289 PolarHBondContact OE1-O 3.38Å
188	G	71.4	Confident	84.5	Confident	34 Å²	34	66.4 Å²	66.4	35%	0.351	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	49.8	-142.5	173.3	0	0	0	0	0	113.6	A186 Q190 W191	A186-G188 PolarHBondContact O-N 2.75Å; G188-Q190 PolarHBondContact O-N 3.49Å; G188-W191 VanDerWaalsContact O-CD1 3.31Å
189	A	66.1	Low	83.2	Confident	101 Å²	101	72.7 Å²	72.7	84%	0.835	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-68.6	-11.5	-179.2	0	0	0	0	0	114.9
190	Q	74.4	Confident	81.2	Confident	118 Å²	118	75.1 Å²	75.1	55%	0.551	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-91.5	2.4	-174.5	-69	-178.1	-16.9	0	0	114	Q187 G188 K192 Q193 N194	Q187-Q190 PolarHBondContact O-N 2.9Å; G188-Q190 PolarHBondContact O-N 3.49Å; Q190-K192 PolarHBondContact O-N 2.96Å; Q190-Q193 PolarHBondContact O-N 2.95Å; Q190-N194 PolarHBondContact O-N 3.18Å
191	W	77.9	Confident	78.8	Confident	25 Å²	25	79.3 Å²	79.3	10%	0.095	40%	0.399	C	S	.	.	H	α-helix	trans	-52.6	-32.7	-178	69.8	-94.1	0	0	0	113.8	G188 Q193 N194 R195 R277 D279 T286	G188-W191 VanDerWaalsContact O-CD1 3.31Å; W191-Q193 VanDerWaalsContact C-N 3.27Å; W191-Q193 PolarHBondContact O-N 3.24Å; W191-N194 PolarHBondContact O-N 2.9Å; W191-R195 WeakPolarHBondContact O-CB 3.19Å; W191-R195 PolarHBondContact O-N 3.4Å; W191-R277 HydrophobicContact CD2-CB 4.02Å; W191-R277 HydrophobicContact CD2-CG 3.96Å; W191-R277 HydrophobicContact CE3-CB 4.22Å; W191-R277 HydrophobicContact CG-CG 4.05Å; W191-R277 HydrophobicContact CH2-CB 4.17Å; W191-R277 WeakPolarHBondContact CH2-O 3.46Å; W191-R277 HydrophobicContact CZ2-CB 4Å; W191-R277 HydrophobicContact CZ2-CG 4.33Å; W191-R277 HydrophobicContact CZ3-CB 4.31Å; W191-R277 WeakPolarHBondContact CZ3-O 3.49Å; W191-D279 HydrophobicContact CH2-CB 4.02Å; W191-D279 HydrophobicContact CZ3-CB 4.49Å; W191-T286 HydrophobicContact CE3-CG2 4.14Å; W191-T286 WeakPolarHBondContact CZ3-OG1 3.42Å
192	K	78.4	Confident	76.2	Confident	100 Å²	100	86.7 Å²	86.7	44%	0.435	43%	0.433	S	S	.	.	H	α-helix	trans	-63.3	-31.9	179.1	-72.5	-161.7	179.6	-155.7	0	113.2	Q190 D279	Q190-K192 PolarHBondContact O-N 2.96Å; K192-D279 IonicContact NZ-OD1 3.08Å; K192-D279 PolarHBondContact NZ-OD1 2.98Å
193	Q	78.6	Confident	73.6	Confident	152 Å²	152	90.1 Å²	90.1	71%	0.71	45%	0.452	S	S	*	.	H	α-helix	trans	-86.9	-26.8	-175.4	-67.4	162.4	-11.7	0	0	112.1	Q190 W191	Q190-Q193 PolarHBondContact O-N 2.95Å; W191-Q193 VanDerWaalsContact C-N 3.27Å; W191-Q193 PolarHBondContact O-N 3.24Å
194	N	79.9	Confident	71.1	Confident	80 Å²	80	91.1 Å²	91.1	43%	0.428	46%	0.46	S	S	.	.	H	α-helix	trans	-102.5	-5.2	-172.7	-65.3	-25.8	0	0	0	113.8	Q187 Q190 W191	Q187-N194 VanDerWaalsContact OE1-CB 3.22Å; Q190-N194 PolarHBondContact O-N 3.18Å; W191-N194 PolarHBondContact O-N 2.9Å
195	R	84.4	Confident	68.8	Low	41 Å²	41	93.6 Å²	93.6	16%	0.155	49%	0.486	C	S	.	.			trans	-71.4	139.6	-180	72.6	-172.4	-178.1	168.1	-7	112.2	W191 D279 S282 T284 T286 E290 A292	W191-R195 WeakPolarHBondContact O-CB 3.19Å; W191-R195 PolarHBondContact O-N 3.4Å; R195-D279 IonicContact CZ-OD2 2.79Å; R195-D279 VanDerWaalsContact NH1-CB 3.33Å; R195-D279 IonicContact NH1-OD2 2.62Å; R195-D279 PolarHBondContact NH1-OD2 3.27Å; R195-D279 IonicContact NH2-OD2 3.51Å; R195-D279 PolarHBondContact NH2-OD2 3.44Å; R195-S282 PolarHBondContact NH1-OG 3.2Å; R195-S282 PolarHBondContact NH2-OG 3.39Å; R195-T284 PolarHBondContact NH1-OG1 3.31Å; R195-T286 HydrophobicContact CB-CG2 3.83Å; R195-T286 WeakPolarHBondContact CD-OG1 3.24Å; R195-E290 CarbonylContact C-O 3.34Å; R195-E290 WeakPolarHBondContact CA-O 3.46Å; R195-A292 HydrophobicContact CB-CB 4.22Å; R195-A292 HydrophobicContact CG-CB 4.09Å
196	K	87.3	Confident	66.3	Low	166 Å²	166	102.3 Å²	102.3	72%	0.722	53%	0.526	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.7	133.7	170.8	-61.2	177.2	-175.2	174.2	0	108.4	L198 E290 I291 A292	K196-L198 PolarHBondContact O-N 2.78Å; K196-E290 PolarHBondContact N-O 2.87Å; K196-I291 CarbonylContact O-C 3.2Å; K196-I291 WeakPolarHBondContact O-CA 3.43Å; K196-A292 PolarHBondContact O-N 2.84Å
197	F	85.9	Confident	64.3	Low	96 Å²	96	106.5 Å²	106.5	42%	0.421	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.9	132	174.2	-71.4	-93.4	0	0	0	109.4	M199 T284 A292	F197-M199 HydrophobicContact CB-CE 4.05Å; F197-M199 WeakPolarHBondContact O-CE 3.32Å; F197-M199 PolarHBondContact O-N 2.73Å; F197-M199 VanDerWaalsContact O-N 3.08Å; F197-T284 HydrophobicContact CD1-CG2 4.36Å; F197-T284 HydrophobicContact CE1-CG2 3.87Å; F197-A292 HydrophobicContact CD1-CB 3.91Å; F197-A292 HydrophobicContact CE1-CB 4.11Å; F197-A292 HydrophobicContact CG-CB 4.22Å
198	L	84.6	Confident	62.9	Low	27 Å²	27	109.6 Å²	109.6	14%	0.141	58%	0.58	C	S	.	*			trans	-60.5	115.9	169.2	-172.5	71.4	0	0	0	107.4	K196 A222 E225 F226 I291 A292 V293 Q297	K196-L198 PolarHBondContact O-N 2.78Å; L198-A222 HydrophobicContact CD2-CB 4.42Å; L198-E225 HydrophobicContact CD1-CB 4.02Å; L198-E225 HydrophobicContact CD1-CG 4.09Å; L198-F226 HydrophobicContact CD2-CE1 3.8Å; L198-F226 HydrophobicContact CD2-CZ 3.82Å; L198-I291 HydrophobicContact CB-CG2 3.92Å; L198-I291 HydrophobicContact CD1-CG2 4.18Å; L198-A292 PolarHBondContact N-O 2.72Å; L198-V293 HydrophobicContact CB-CG1 4.18Å; L198-V293 HydrophobicContact CD2-CG1 4.26Å; L198-Q297 HydrophobicContact CD2-CB 4.26Å; L198-Q297 PolarHBondContact O-NE2 2.94Å
199	M	70.2	Confident	61.2	Low	144 Å²	144	114.3 Å²	114.3	71%	0.709	60%	0.602	S	S	*	*			trans	-65.1	139.6	179.8	-67.7	-71.7	97.1	0	0	109.3	F197	F197-M199 HydrophobicContact CB-CE 4.05Å; F197-M199 WeakPolarHBondContact O-CE 3.32Å; F197-M199 PolarHBondContact O-N 2.73Å; F197-M199 VanDerWaalsContact O-N 3.08Å
200	Q	55.7	Low	59.7	Low	130 Å²	130	113.1 Å²	113.1	61%	0.607	59%	0.592	S	S	*	*			trans	-85.2	142.8	160.7	-68	179.6	8.8	0	0	106.6	E202	Q200-E202 PolarHBondContact O-N 3.22Å
201	P	46.8	Very low	58	Low	91 Å²	91	113.7 Å²	113.7	59%	0.591	61%	0.607	S	S	*	*			trans	-56.3	114.6	163.7	5.6	-4	0	0	0	107.3	K203	P201-K203 PolarHBondContact O-N 3.31Å
202	E	40.7	Very low	55.9	Low	154 Å²	154	118.7 Å²	118.7	72%	0.72	64%	0.64	S	S	*	*			trans	-55.2	117.3	172.1	-67.7	164	164.6	0	0	106.5	Q200 I204	Q200-E202 PolarHBondContact O-N 3.22Å; E202-I204 HydrophobicContact CB-CD1 4.29Å; E202-I204 HydrophobicContact CB-CG1 3.86Å; E202-I204 PolarHBondContact O-N 2.89Å
203	K	41.8	Very low	54.1	Low	209 Å²	209	119.9 Å²	119.9	91%	0.909	66%	0.661	S	S	*	*			trans	-67.3	75.9	167.4	-73.3	-172.9	178.1	-177.9	0	108	P201 G205	P201-K203 PolarHBondContact O-N 3.31Å; K203-G205 VanDerWaalsContact C-N 3.33Å; K203-G205 PolarHBondContact O-N 3.07Å
204	I	40.9	Very low	52.4	Low	143 Å²	143	116.9 Å²	116.9	73%	0.733	65%	0.65	S	S	*	*			trans	-72	94.9	170.7	-62.5	175.4	0	0	0	106.4	E202	E202-I204 HydrophobicContact CB-CD1 4.29Å; E202-I204 HydrophobicContact CB-CG1 3.86Å; E202-I204 PolarHBondContact O-N 2.89Å
205	G	47	Very low	51.1	Low	56 Å²	56	116.5 Å²	116.5	58%	0.577	67%	0.665	S	S	*	*	S	Bend	trans	65.8	94.3	158.1	0	0	0	0	0	117.4	K203	K203-G205 VanDerWaalsContact C-N 3.33Å; K203-G205 PolarHBondContact O-N 3.07Å
206	Q	34.7	Very low	49.8	Very low	203 Å²	203	121 Å²	121	95%	0.949	69%	0.692	S	S	*	*			trans	-169.1	149	136.8	-104.5	156.9	62.9	0	0	112.6
207	S	33.6	Very low	49.4	Very low	102 Å²	102	120.2 Å²	120.2	71%	0.713	69%	0.688	S	S	*	*			trans	-41.3	165	-174	-121.8	0	0	0	0	117.9	V209	S207-V209 PolarHBondContact O-N 3.18Å
208	P	40.5	Very low	49.5	Very low	129 Å²	129	116.5 Å²	116.5	84%	0.838	67%	0.673	S	S	*	*			trans	-74	90.3	-175.8	31.6	-29	0	0	0	110.2
209	V	36	Very low	49.8	Very low	133 Å²	133	118.5 Å²	118.5	81%	0.806	69%	0.685	S	S	*	*			trans	-87.6	125.9	160	-174.2	0	0	0	0	106.8	S207	S207-V209 PolarHBondContact O-N 3.18Å
210	A	35.2	Very low	50.8	Low	76 Å²	76	115.4 Å²	115.4	63%	0.628	67%	0.67	S	S	*	*			trans	-44.9	146.2	-177.7	0	0	0	0	0	112.7	T212	A210-T212 PolarHBondContact O-N 3.39Å
211	P	37.6	Very low	52.4	Low	131 Å²	131	115.2 Å²	115.2	85%	0.851	67%	0.669	S	S	*	*			trans	-65	105.6	174.9	27.5	-30.5	0	0	0	108.1	S213	P211-S213 PolarHBondContact O-N 2.8Å; P211-S213 VanDerWaalsContact O-N 3.13Å
212	T	34.6	Very low	54.5	Low	130 Å²	130	111.2 Å²	111.2	80%	0.798	64%	0.644	S	S	*	*			trans	-65.4	113.8	164.7	48.1	0	0	0	0	107.2	A210 D214	A210-T212 PolarHBondContact O-N 3.39Å; T212-D214 VanDerWaalsContact C-N 3.29Å; T212-D214 PolarHBondContact O-N 3.22Å
213	S	39.9	Very low	56.9	Low	125 Å²	125	104.3 Å²	104.3	87%	0.874	61%	0.612	S	S	*	*	S	Bend	trans	-55	80.4	171.1	157.8	0	0	0	0	111.8	P211	P211-S213 PolarHBondContact O-N 2.8Å; P211-S213 VanDerWaalsContact O-N 3.13Å
214	D	44	Very low	59.2	Low	89 Å²	89	96.1 Å²	96.1	48%	0.476	58%	0.58	S	S	.	*			trans	-139.1	64.2	163.4	-151.5	11.5	0	0	0	108.1	T212 D216 K217	T212-D214 VanDerWaalsContact C-N 3.29Å; T212-D214 PolarHBondContact O-N 3.22Å; D214-D216 PolarHBondContact O-N 2.92Å; D214-K217 WeakPolarHBondContact OD2-CD 3.37Å; D214-K217 VanDerWaalsContact OD2-CE 3.22Å; D214-K217 WeakPolarHBondContact OD2-CE 3.37Å; D214-K217 IonicContact OD2-NZ 3.26Å; D214-K217 PolarHBondContact OD2-NZ 3.29Å
215	G	51.2	Low	61.6	Low	72 Å²	72	92.4 Å²	92.4	74%	0.742	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	9.1	-175.6	0	0	0	0	0	115
216	D	58.3	Low	63.8	Low	136 Å²	136	90.6 Å²	90.6	73%	0.727	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	-0.8	-173.4	-77	-25.6	0	0	0	113.8	D214	D214-D216 PolarHBondContact O-N 2.92Å
217	K	79.3	Confident	66.4	Low	148 Å²	148	81.8 Å²	81.8	64%	0.643	50%	0.496	S	S	*	.	S	Bend	trans	-87.3	135.8	178	-78.5	-178	177.2	146.3	0	112.6	D214	D214-K217 WeakPolarHBondContact OD2-CD 3.37Å; D214-K217 VanDerWaalsContact OD2-CE 3.22Å; D214-K217 WeakPolarHBondContact OD2-CE 3.37Å; D214-K217 IonicContact OD2-NZ 3.26Å; D214-K217 PolarHBondContact OD2-NZ 3.29Å
218	V	87.3	Confident	69.1	Low	18 Å²	18	82.7 Å²	82.7	11%	0.109	49%	0.488	C	S	.	.			trans	-67.5	131.4	176.1	179	0	0	0	0	110.6	L220 F223 N300 R395 E402 C403	V218-L220 PolarHBondContact O-N 3.5Å; V218-L220 VanDerWaalsContact O-N 3.17Å; V218-F223 HydrophobicContact CG1-CB 3.86Å; V218-F223 HydrophobicContact CG1-CD2 4.3Å; V218-F223 HydrophobicContact CG1-CG 4.2Å; V218-N300 CarbonylContact C-O 3.58Å; V218-N300 WeakPolarHBondContact CA-O 3.38Å; V218-N300 WeakPolarHBondContact CG1-O 3.26Å; V218-R395 VanDerWaalsContact CG2-NH2 3.31Å; V218-E402 HydrophobicContact CG2-CB 3.99Å; V218-E402 WeakPolarHBondContact CG2-OE2 3.44Å; V218-C403 VanDerWaalsContact CG1-SG 3.6Å
219	D	91.6	Very high	71.5	Confident	70 Å²	70	77.6 Å²	77.6	37%	0.374	45%	0.453	S	S	.	.			trans	-70.7	103.8	166.6	-178.4	-14.8	0	0	0	109	E221 A222 F223 N300	D219-E221 VanDerWaalsContact C-N 3.28Å; D219-E221 PolarHBondContact O-N 3.3Å; D219-E221 PolarHBondContact OD1-N 3.39Å; D219-A222 HydrophobicContact CB-CB 4.01Å; D219-A222 PolarHBondContact O-N 3.45Å; D219-A222 PolarHBondContact OD1-N 2.89Å; D219-F223 VanDerWaalsContact O-CB 3.31Å; D219-F223 WeakPolarHBondContact O-CB 3.49Å; D219-F223 PolarHBondContact O-N 3.44Å; D219-N300 HydrophobicContact CB-CB 4.3Å; D219-N300 PolarHBondContact N-O 3.23Å
220	L	90.1	Very high	74.2	Confident	78 Å²	78	72.9 Å²	72.9	41%	0.408	42%	0.423	S	S	.	.	H	α-helix	trans	-66.4	-27.4	-175.6	-63.9	179.2	0	0	0	113.2	V218 S224 C403 L407	V218-L220 PolarHBondContact O-N 3.5Å; V218-L220 VanDerWaalsContact O-N 3.17Å; L220-S224 WeakPolarHBondContact O-CB 3.42Å; L220-S224 PolarHBondContact O-N 3.11Å; L220-C403 HydrophobicContact CD2-CB 4.45Å; L220-L407 HydrophobicContact CD2-CD1 4.31Å
221	E	89.5	Confident	77	Confident	126 Å²	126	71.5 Å²	71.5	59%	0.589	41%	0.407	S	S	*	.	H	α-helix	trans	-72.8	-48.9	177.2	-173.9	175.7	-173.7	0	0	109.8	D219 F223 S224 E225	D219-E221 VanDerWaalsContact C-N 3.28Å; D219-E221 PolarHBondContact O-N 3.3Å; D219-E221 PolarHBondContact OD1-N 3.39Å; E221-F223 VanDerWaalsContact C-N 3.32Å; E221-F223 PolarHBondContact O-N 2.98Å; E221-S224 WeakPolarHBondContact O-CB 3.25Å; E221-S224 PolarHBondContact O-N 3.17Å; E221-E225 PolarHBondContact O-N 3.19Å; E221-E225 VanDerWaalsContact O-N 3.07Å
222	A	90.1	Very high	79.7	Confident	7 Å²	7	68.2 Å²	68.2	6%	0.058	39%	0.386	C	S	.	.	H	α-helix	trans	-60.2	-42.6	174	0	0	0	0	0	111.8	L198 D219 S224 E225 F226	L198-A222 HydrophobicContact CD2-CB 4.42Å; D219-A222 HydrophobicContact CB-CB 4.01Å; D219-A222 PolarHBondContact O-N 3.45Å; D219-A222 PolarHBondContact OD1-N 2.89Å; A222-S224 VanDerWaalsContact C-N 3.35Å; A222-S224 PolarHBondContact O-N 3.33Å; A222-E225 PolarHBondContact O-N 3.22Å; A222-F226 HydrophobicContact CB-CE2 4.44Å; A222-F226 WeakPolarHBondContact O-CD2 3.24Å; A222-F226 VanDerWaalsContact O-CG 3.28Å; A222-F226 WeakPolarHBondContact O-CG 3.43Å; A222-F226 PolarHBondContact O-N 3.02Å
223	F	92.3	Very high	82.5	Confident	10 Å²	10	62.6 Å²	62.6	4%	0.044	35%	0.352	C	S	.	.	H	α-helix	trans	-59.8	-43.7	175.6	-176	-106.2	0	0	0	111.6	V218 D219 E221 E225 F226 T227 G301 M399 C403 L407 F408	V218-F223 HydrophobicContact CG1-CB 3.86Å; V218-F223 HydrophobicContact CG1-CD2 4.3Å; V218-F223 HydrophobicContact CG1-CG 4.2Å; D219-F223 VanDerWaalsContact O-CB 3.31Å; D219-F223 WeakPolarHBondContact O-CB 3.49Å; D219-F223 PolarHBondContact O-N 3.44Å; E221-F223 VanDerWaalsContact C-N 3.32Å; E221-F223 PolarHBondContact O-N 2.98Å; F223-E225 PolarHBondContact O-N 3.04Å; F223-F226 PolarHBondContact O-N 3.25Å; F223-T227 HydrophobicContact CD1-CG2 4.04Å; F223-T227 HydrophobicContact CE1-CG2 3.73Å; F223-T227 HydrophobicContact CE2-CG2 4.26Å; F223-T227 HydrophobicContact CG-CG2 4.43Å; F223-T227 HydrophobicContact CZ-CG2 3.84Å; F223-T227 VanDerWaalsContact O-CG2 3.24Å; F223-T227 WeakPolarHBondContact O-CG2 3.34Å; F223-T227 PolarHBondContact O-N 3.22Å; F223-G301 WeakPolarHBondContact CD2-O 3.5Å; F223-M399 HydrophobicContact CE2-SD 4.15Å; F223-C403 HydrophobicContact CD1-CB 4.21Å; F223-C403 HydrophobicContact CE1-CB 3.8Å; F223-C403 HydrophobicContact CZ-CB 4.16Å; F223-L407 HydrophobicContact CD1-CB 4Å; F223-L407 HydrophobicContact CD1-CD1 3.88Å; F223-L407 HydrophobicContact CE1-CB 3.69Å; F223-L407 HydrophobicContact CE1-CD1 4.32Å; F223-F408 HydrophobicContact CE1-CE1 4.48Å; F223-F408 HydrophobicContact CE1-CE2 4.33Å; F223-F408 HydrophobicContact CE1-CZ 4.28Å; F223-F408 HydrophobicContact CE2-CE1 4.43Å; F223-F408 HydrophobicContact CZ-CD1 4.02Å; F223-F408 AromaticContact CZ-CE1 3.61Å; F223-F408 HydrophobicContact CZ-CE1 3.61Å; F223-F408 HydrophobicContact CZ-CE2 4.19Å; F223-F408 HydrophobicContact CZ-CG 4.48Å; F223-F408 AromaticContact CZ-CZ 3.71Å; F223-F408 HydrophobicContact CZ-CZ 3.71Å
224	S	90.6	Very high	85.2	Confident	36 Å²	36	56.7 Å²	56.7	25%	0.252	31%	0.311	S	S	.	.	H	α-helix	trans	-62.4	-38	176.7	-174.1	0	0	0	0	113	L220 E221 A222 T227 K228	L220-S224 WeakPolarHBondContact O-CB 3.42Å; L220-S224 PolarHBondContact O-N 3.11Å; E221-S224 WeakPolarHBondContact O-CB 3.25Å; E221-S224 PolarHBondContact O-N 3.17Å; A222-S224 VanDerWaalsContact C-N 3.35Å; A222-S224 PolarHBondContact O-N 3.33Å; S224-T227 PolarHBondContact O-OG1 3.04Å; S224-K228 WeakPolarHBondContact O-CG 3.46Å; S224-K228 PolarHBondContact O-N 3.22Å
225	E	90.8	Very high	87.7	Confident	65 Å²	65	55.1 Å²	55.1	30%	0.304	31%	0.305	S	S	.	.	H	α-helix	trans	-68	-36.8	174	-68.9	-54.5	142	0	0	112.3	L198 E221 A222 F223 K228	L198-E225 HydrophobicContact CD1-CB 4.02Å; L198-E225 HydrophobicContact CD1-CG 4.09Å; E221-E225 PolarHBondContact O-N 3.19Å; E221-E225 VanDerWaalsContact O-N 3.07Å; A222-E225 PolarHBondContact O-N 3.22Å; F223-E225 PolarHBondContact O-N 3.04Å; E225-K228 VanDerWaalsContact CD-NZ 3.26Å; E225-K228 PolarHBondContact O-N 3.45Å; E225-K228 IonicContact OE1-NZ 3.58Å; E225-K228 PolarHBondContact OE1-NZ 3.19Å; E225-K228 IonicContact OE2-NZ 3.14Å; E225-K228 PolarHBondContact OE2-NZ 3.24Å
226	F	92	Very high	89.9	Confident	18 Å²	18	53.8 Å²	53.8	8%	0.079	28%	0.277	C	S	.	.	H	α-helix	trans	-70	-36.3	177.1	-62	-23	0	0	0	113	L198 A222 F223 K228 I229 I230 L287 V293 L298 G301	L198-F226 HydrophobicContact CD2-CE1 3.8Å; L198-F226 HydrophobicContact CD2-CZ 3.82Å; A222-F226 HydrophobicContact CB-CE2 4.44Å; A222-F226 WeakPolarHBondContact O-CD2 3.24Å; A222-F226 VanDerWaalsContact O-CG 3.28Å; A222-F226 WeakPolarHBondContact O-CG 3.43Å; A222-F226 PolarHBondContact O-N 3.02Å; F223-F226 PolarHBondContact O-N 3.25Å; F226-K228 VanDerWaalsContact C-N 3.25Å; F226-K228 PolarHBondContact O-N 2.82Å; F226-I229 WeakPolarHBondContact O-CG1 3.49Å; F226-I229 PolarHBondContact O-N 2.91Å; F226-I229 VanDerWaalsContact O-N 3.17Å; F226-I230 PolarHBondContact O-N 2.9Å; F226-L287 HydrophobicContact CD1-CD1 3.99Å; F226-L287 HydrophobicContact CE1-CD1 3.93Å; F226-V293 HydrophobicContact CE1-CG1 3.65Å; F226-V293 HydrophobicContact CZ-CG1 3.89Å; F226-L298 HydrophobicContact CD2-CD1 4.42Å; F226-L298 HydrophobicContact CE2-CD1 3.96Å; F226-L298 HydrophobicContact CZ-CD1 4.21Å; F226-G301 WeakPolarHBondContact CD2-O 3.25Å
227	T	90.1	Very high	91.7	Very high	18 Å²	18	47.3 Å²	47.3	11%	0.11	24%	0.243	C	C	.	.	H	α-helix	trans	-65.9	-29.1	178.1	61.1	0	0	0	0	112.1	F223 S224 I229 I230 L407 P409	F223-T227 HydrophobicContact CD1-CG2 4.04Å; F223-T227 HydrophobicContact CE1-CG2 3.73Å; F223-T227 HydrophobicContact CE2-CG2 4.26Å; F223-T227 HydrophobicContact CG-CG2 4.43Å; F223-T227 HydrophobicContact CZ-CG2 3.84Å; F223-T227 VanDerWaalsContact O-CG2 3.24Å; F223-T227 WeakPolarHBondContact O-CG2 3.34Å; F223-T227 PolarHBondContact O-N 3.22Å; S224-T227 PolarHBondContact O-OG1 3.04Å; T227-I229 VanDerWaalsContact C-N 3.27Å; T227-I229 PolarHBondContact O-N 3.24Å; T227-I230 WeakPolarHBondContact O-CG2 3.43Å; T227-I230 PolarHBondContact O-N 3.16Å; T227-L407 WeakPolarHBondContact CB-O 3.4Å; T227-L407 WeakPolarHBondContact CG2-O 3.34Å; T227-L407 PolarHBondContact OG1-O 3.39Å; T227-P409 WeakPolarHBondContact O-CG 3.07Å
228	K	90.4	Very high	92.5	Very high	122 Å²	122	41.9 Å²	41.9	53%	0.53	22%	0.222	S	C	.	.	H	α-helix	trans	-62.5	-32.2	174.2	-67.5	169.7	-165.5	174.7	0	113.3	S224 E225 F226	S224-K228 WeakPolarHBondContact O-CG 3.46Å; S224-K228 PolarHBondContact O-N 3.22Å; E225-K228 VanDerWaalsContact CD-NZ 3.26Å; E225-K228 PolarHBondContact O-N 3.45Å; E225-K228 IonicContact OE1-NZ 3.58Å; E225-K228 PolarHBondContact OE1-NZ 3.19Å; E225-K228 IonicContact OE2-NZ 3.14Å; E225-K228 PolarHBondContact OE2-NZ 3.24Å; F226-K228 VanDerWaalsContact C-N 3.25Å; F226-K228 PolarHBondContact O-N 2.82Å
229	I	91.3	Very high	93	Very high	21 Å²	21	44.1 Å²	44.1	11%	0.108	23%	0.233	C	C	.	.	H	α-helix	trans	-98.8	-8	-175.6	63.2	160.4	0	0	0	114.1	F226 T227 A233 L287 S288 I291	F226-I229 WeakPolarHBondContact O-CG1 3.49Å; F226-I229 PolarHBondContact O-N 2.91Å; F226-I229 VanDerWaalsContact O-N 3.17Å; T227-I229 VanDerWaalsContact C-N 3.27Å; T227-I229 PolarHBondContact O-N 3.24Å; I229-A233 WeakPolarHBondContact O-CB 3.47Å; I229-A233 PolarHBondContact O-N 3.3Å; I229-L287 HydrophobicContact CD1-CB 3.39Å; I229-L287 HydrophobicContact CD1-CD1 4.08Å; I229-L287 HydrophobicContact CD1-CG 4.41Å; I229-S288 PolarHBondContact O-OG 3.03Å; I229-I291 HydrophobicContact CD1-CD1 4.12Å; I229-I291 HydrophobicContact CG2-CD1 3.71Å; I229-I291 HydrophobicContact CG2-CG1 4.46Å
230	I	92.5	Very high	93.3	Very high	35 Å²	35	40.8 Å²	40.8	18%	0.179	22%	0.215	C	C	.	.	H	α-helix	trans	-76.4	-42.9	-173.9	-153.5	155.5	0	0	0	112.4	F226 T227 A233 I234 P409 F412	F226-I230 PolarHBondContact O-N 2.9Å; T227-I230 WeakPolarHBondContact O-CG2 3.43Å; T227-I230 PolarHBondContact O-N 3.16Å; I230-A233 WeakPolarHBondContact O-CA 3.36Å; I230-A233 WeakPolarHBondContact O-CB 3.45Å; I230-A233 PolarHBondContact O-N 2.86Å; I230-I234 HydrophobicContact CG1-CD1 4.39Å; I230-I234 WeakPolarHBondContact O-CG1 3.18Å; I230-I234 PolarHBondContact O-N 2.85Å; I230-P409 HydrophobicContact CG2-CB 4.41Å; I230-P409 HydrophobicContact CG2-CG 3.73Å; I230-F412 HydrophobicContact CD1-CD2 3.26Å; I230-F412 HydrophobicContact CD1-CE2 3.23Å; I230-F412 HydrophobicContact CD1-CG 4.24Å; I230-F412 HydrophobicContact CD1-CZ 4.17Å; I230-F412 HydrophobicContact CG1-CD2 3.79Å; I230-F412 HydrophobicContact CG1-CE2 4.21Å; I230-F412 HydrophobicContact CG2-CB 4.17Å; I230-F412 HydrophobicContact CG2-CD2 4.26Å; I230-F412 HydrophobicContact CG2-CG 4.42Å
231	T	93.6	Very high	93.6	Very high	46 Å²	46	37 Å²	37	28%	0.282	20%	0.196	S	C	.	.	H	α-helix	trans	-59.7	-49.9	178.1	-61.4	0	0	0	0	111.2	A233 I234 T235 P409 L411	T231-A233 PolarHBondContact O-N 3.3Å; T231-I234 PolarHBondContact O-N 2.82Å; T231-T235 PolarHBondContact O-N 3.21Å; T231-T235 PolarHBondContact O-OG1 3.4Å; T231-P409 VanDerWaalsContact OG1-CB 3.25Å; T231-P409 WeakPolarHBondContact OG1-CB 3.49Å; T231-L411 HydrophobicContact CG2-CB 4.32Å; T231-L411 HydrophobicContact CG2-CD2 3.92Å
232	P	93.7	Very high	93.8	Very high	63 Å²	63	36.8 Å²	36.8	41%	0.409	19%	0.193	S	C	.	.	H	α-helix	trans	-59.6	-30.1	172.9	-24.1	33.7	0	0	0	114	R236	P232-R236 WeakPolarHBondContact O-CB 3.19Å; P232-R236 VanDerWaalsContact O-CG 3.31Å; P232-R236 WeakPolarHBondContact O-CG 3.46Å; P232-R236 PolarHBondContact O-N 2.69Å; P232-R236 PolarHBondContact O-NE 2.93Å
233	A	94.5	Very high	94	Very high	12 Å²	12	41.6 Å²	41.6	10%	0.099	21%	0.212	C	C	.	.	H	α-helix	trans	-70.5	-46.5	176.7	0	0	0	0	0	111.6	I229 I230 T231 R236 V237 M270	I229-A233 WeakPolarHBondContact O-CB 3.47Å; I229-A233 PolarHBondContact O-N 3.3Å; I230-A233 WeakPolarHBondContact O-CA 3.36Å; I230-A233 WeakPolarHBondContact O-CB 3.45Å; I230-A233 PolarHBondContact O-N 2.86Å; T231-A233 PolarHBondContact O-N 3.3Å; A233-R236 PolarHBondContact O-N 3.49Å; A233-V237 PolarHBondContact O-N 3.32Å; A233-M270 HydrophobicContact CB-CG 4.36Å; A233-M270 HydrophobicContact CB-SD 3.68Å
234	I	96.4	Very high	94.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.6	-49.1	175.7	-65.2	170.2	0	0	0	110.2	I230 T231 R236 V237 V238 M270 L411 F412 V415 F416	I230-I234 HydrophobicContact CG1-CD1 4.39Å; I230-I234 WeakPolarHBondContact O-CG1 3.18Å; I230-I234 PolarHBondContact O-N 2.85Å; T231-I234 PolarHBondContact O-N 2.82Å; I234-R236 VanDerWaalsContact C-N 3.26Å; I234-R236 PolarHBondContact O-N 3.05Å; I234-V237 WeakPolarHBondContact O-CA 3.42Å; I234-V237 WeakPolarHBondContact O-CB 3.4Å; I234-V237 PolarHBondContact O-N 3.35Å; I234-V238 HydrophobicContact CG2-CG2 4.47Å; I234-V238 PolarHBondContact O-N 3.49Å; I234-M270 HydrophobicContact CG1-CE 4.28Å; I234-M270 HydrophobicContact CG1-SD 4.06Å; I234-L411 HydrophobicContact CB-CD2 4.04Å; I234-L411 HydrophobicContact CB-CG 4.49Å; I234-L411 HydrophobicContact CD1-CG 4.41Å; I234-L411 HydrophobicContact CG2-CD1 4.47Å; I234-L411 HydrophobicContact CG2-CD2 3.71Å; I234-L411 HydrophobicContact CG2-CG 3.92Å; I234-F412 HydrophobicContact CD1-CB 4.21Å; I234-F412 HydrophobicContact CD1-CD2 4.21Å; I234-V415 HydrophobicContact CG2-CG2 3.92Å; I234-F416 HydrophobicContact CD1-CE2 4.13Å
235	T	96.6	Very high	94	Very high	57 Å²	57	40.5 Å²	40.5	35%	0.35	21%	0.205	S	C	.	.	H	α-helix	trans	-56.3	-42.4	178.5	-55.5	0	0	0	0	111.3	T231 V237 V238 D239	T231-T235 PolarHBondContact O-N 3.21Å; T231-T235 PolarHBondContact O-OG1 3.4Å; T235-V237 VanDerWaalsContact C-N 3.25Å; T235-V237 PolarHBondContact O-N 2.92Å; T235-V238 PolarHBondContact O-N 3.47Å; T235-V238 VanDerWaalsContact O-N 3.15Å; T235-D239 WeakPolarHBondContact O-CB 3.43Å; T235-D239 VanDerWaalsContact O-CG 3.25Å; T235-D239 PolarHBondContact O-N 2.9Å
236	R	96.3	Very high	93.9	Very high	43 Å²	43	38.7 Å²	38.7	16%	0.162	20%	0.197	C	C	.	.	H	α-helix	trans	-66.2	-22.1	175.6	-78	-179.8	-70	125.9	-8.9	114.2	T184 P232 A233 I234 F240 R273 S288	T184-R236 WeakPolarHBondContact CB-O 3.33Å; T184-R236 WeakPolarHBondContact O-CB 3.49Å; T184-R236 VanDerWaalsContact O-CD 3.26Å; T184-R236 WeakPolarHBondContact O-CD 3.37Å; T184-R236 WeakPolarHBondContact O-CG 3.4Å; P232-R236 WeakPolarHBondContact O-CB 3.19Å; P232-R236 VanDerWaalsContact O-CG 3.31Å; P232-R236 WeakPolarHBondContact O-CG 3.46Å; P232-R236 PolarHBondContact O-N 2.69Å; P232-R236 PolarHBondContact O-NE 2.93Å; A233-R236 PolarHBondContact O-N 3.49Å; I234-R236 VanDerWaalsContact C-N 3.26Å; I234-R236 PolarHBondContact O-N 3.05Å; R236-F240 WeakPolarHBondContact O-CB 3.47Å; R236-F240 PolarHBondContact O-N 3.25Å; R236-R273 PolarHBondContact O-NH1 2.96Å; R236-R273 VanDerWaalsContact O-NH1 3.13Å; R236-S288 VanDerWaalsContact NH2-CB 3.32Å; R236-S288 PolarHBondContact NH2-OG 3.08Å
237	V	97.3	Very high	93.7	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-77	-44.1	170.5	177.5	0	0	0	0	110.3	A233 I234 T235 D239 F240 A241 I269 M270	A233-V237 PolarHBondContact O-N 3.32Å; I234-V237 WeakPolarHBondContact O-CA 3.42Å; I234-V237 WeakPolarHBondContact O-CB 3.4Å; I234-V237 PolarHBondContact O-N 3.35Å; T235-V237 VanDerWaalsContact C-N 3.25Å; T235-V237 PolarHBondContact O-N 2.92Å; V237-D239 PolarHBondContact O-N 2.79Å; V237-F240 WeakPolarHBondContact O-CB 3.07Å; V237-F240 PolarHBondContact O-N 3.42Å; V237-A241 PolarHBondContact O-N 3.48Å; V237-I269 HydrophobicContact CB-CG2 4.47Å; V237-I269 HydrophobicContact CG1-CB 4.22Å; V237-I269 HydrophobicContact CG1-CD1 3.94Å; V237-I269 HydrophobicContact CG1-CG2 4.1Å; V237-I269 HydrophobicContact CG2-CB 4.23Å; V237-I269 HydrophobicContact CG2-CG2 3.66Å; V237-M270 HydrophobicContact CG2-CG 3.98Å
238	V	96.8	Very high	93.2	Very high	34 Å²	34	39.1 Å²	39.1	21%	0.206	20%	0.203	C	C	.	.	H	α-helix	trans	-60.7	-45.8	175.9	177.5	0	0	0	0	110.9	I234 T235 F240 A241 K242 L262	I234-V238 HydrophobicContact CG2-CG2 4.47Å; I234-V238 PolarHBondContact O-N 3.49Å; T235-V238 PolarHBondContact O-N 3.47Å; T235-V238 VanDerWaalsContact O-N 3.15Å; V238-F240 VanDerWaalsContact C-N 3.27Å; V238-F240 PolarHBondContact O-N 2.87Å; V238-A241 PolarHBondContact O-N 3.36Å; V238-K242 HydrophobicContact CG1-CD 4.11Å; V238-K242 HydrophobicContact CG1-CG 4.47Å; V238-K242 WeakPolarHBondContact O-CG 3.17Å; V238-K242 PolarHBondContact O-N 3.24Å; V238-L262 HydrophobicContact CG1-CD1 4.35Å; V238-L262 HydrophobicContact CG2-CD1 4.32Å; V238-L262 HydrophobicContact CG2-CD2 4.18Å
239	D	96.8	Very high	92.1	Very high	64 Å²	64	39.4 Å²	39.4	34%	0.342	21%	0.206	S	C	.	.	H	α-helix	trans	-64.5	-32.3	177.8	-68.8	-20.9	0	0	0	112.3	T184 T235 V237 K243	T184-D239 HydrophobicContact CG2-CB 3.83Å; T235-D239 WeakPolarHBondContact O-CB 3.43Å; T235-D239 VanDerWaalsContact O-CG 3.25Å; T235-D239 PolarHBondContact O-N 2.9Å; V237-D239 PolarHBondContact O-N 2.79Å; D239-K243 WeakPolarHBondContact O-CG 3.19Å; D239-K243 PolarHBondContact O-N 2.87Å
240	F	97.6	Very high	90.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.4	-51.9	174	169.5	-104	0	0	0	110.2	V177 A180 H181 T184 R236 V237 V238 K242 K243 L244 Q331	V177-F240 HydrophobicContact CG1-CE2 4.49Å; V177-F240 HydrophobicContact CG1-CZ 4.29Å; A180-F240 HydrophobicContact CB-CD2 3.89Å; A180-F240 HydrophobicContact CB-CE2 3.98Å; H181-F240 HydrophobicContact CB-CD2 4.3Å; H181-F240 HydrophobicContact CB-CE2 3.95Å; T184-F240 HydrophobicContact CG2-CB 4.26Å; R236-F240 WeakPolarHBondContact O-CB 3.47Å; R236-F240 PolarHBondContact O-N 3.25Å; V237-F240 WeakPolarHBondContact O-CB 3.07Å; V237-F240 PolarHBondContact O-N 3.42Å; V238-F240 VanDerWaalsContact C-N 3.27Å; V238-F240 PolarHBondContact O-N 2.87Å; F240-K242 VanDerWaalsContact C-N 3.29Å; F240-K242 PolarHBondContact O-N 3.37Å; F240-K243 PolarHBondContact O-N 3.18Å; F240-K243 VanDerWaalsContact O-N 3.09Å; F240-L244 HydrophobicContact CE1-CD1 3.87Å; F240-L244 HydrophobicContact CE1-CG 4.44Å; F240-L244 HydrophobicContact CE2-CD2 4.09Å; F240-L244 HydrophobicContact CZ-CD1 4Å; F240-L244 HydrophobicContact CZ-CD2 4.03Å; F240-L244 HydrophobicContact CZ-CG 4.38Å; F240-Q331 HydrophobicContact CD1-CB 4.4Å; F240-Q331 HydrophobicContact CE1-CB 3.56Å; F240-Q331 HydrophobicContact CZ-CB 3.73Å
241	A	96.4	Very high	88.4	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-57	-44.9	178.8	0	0	0	0	0	111.2	V237 V238 K243 L244 F247 L262 L335	V237-A241 PolarHBondContact O-N 3.48Å; V238-A241 PolarHBondContact O-N 3.36Å; A241-K243 PolarHBondContact O-N 3.11Å; A241-K243 VanDerWaalsContact O-N 3.11Å; A241-L244 WeakPolarHBondContact O-CB 3.43Å; A241-L244 PolarHBondContact O-N 3.26Å; A241-F247 HydrophobicContact CB-CD1 3.72Å; A241-F247 HydrophobicContact CB-CD2 4.45Å; A241-F247 HydrophobicContact CB-CE1 3.6Å; A241-F247 HydrophobicContact CB-CE2 4.33Å; A241-F247 HydrophobicContact CB-CG 4.18Å; A241-F247 HydrophobicContact CB-CZ 3.92Å; A241-F247 WeakPolarHBondContact O-CB 3.4Å; A241-F247 WeakPolarHBondContact O-CD1 3.31Å; A241-L262 HydrophobicContact CB-CD2 3.69Å; A241-L335 HydrophobicContact CB-CD1 4.05Å; A241-L335 HydrophobicContact CB-CD2 3.6Å; A241-L335 HydrophobicContact CB-CG 4.5Å
242	K	94.1	Very high	87.1	Confident	121 Å²	121	55.1 Å²	55.1	53%	0.526	28%	0.279	S	S	.	.	H	α-helix	trans	-61.4	-20.3	178.8	-75	178.6	177.4	178.2	0	115.3	V238 F240 S248	V238-K242 HydrophobicContact CG1-CD 4.11Å; V238-K242 HydrophobicContact CG1-CG 4.47Å; V238-K242 WeakPolarHBondContact O-CG 3.17Å; V238-K242 PolarHBondContact O-N 3.24Å; F240-K242 VanDerWaalsContact C-N 3.29Å; F240-K242 PolarHBondContact O-N 3.37Å; K242-S248 VanDerWaalsContact CA-OG 3.3Å; K242-S248 WeakPolarHBondContact CA-OG 3.35Å; K242-S248 VanDerWaalsContact O-CB 3.27Å; K242-S248 WeakPolarHBondContact O-CB 3.41Å
243	K	94.4	Very high	86.8	Confident	108 Å²	108	52.9 Å²	52.9	47%	0.47	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-4.5	177.4	-72.8	174.2	-179.8	-67.6	0	113	A180 T184 D239 F240 A241	A180-K243 HydrophobicContact CB-CB 3.53Å; A180-K243 HydrophobicContact CB-CD 4.23Å; T184-K243 HydrophobicContact CG2-CD 4.24Å; D239-K243 WeakPolarHBondContact O-CG 3.19Å; D239-K243 PolarHBondContact O-N 2.87Å; F240-K243 PolarHBondContact O-N 3.18Å; F240-K243 VanDerWaalsContact O-N 3.09Å; A241-K243 PolarHBondContact O-N 3.11Å; A241-K243 VanDerWaalsContact O-N 3.11Å
244	L	94.3	Very high	86.6	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.01	27%	0.272	C	S	.	.	S	Bend	trans	-87	131.5	179.7	-60.3	-167.9	0	0	0	110.9	V177 A180 F240 A241 M246 F247 S248 A332 L335	V177-L244 HydrophobicContact CB-CD2 4.28Å; V177-L244 HydrophobicContact CG1-CD2 4.17Å; V177-L244 HydrophobicContact CG2-CD2 4.01Å; A180-L244 HydrophobicContact CB-CD2 3.94Å; F240-L244 HydrophobicContact CE1-CD1 3.87Å; F240-L244 HydrophobicContact CE1-CG 4.44Å; F240-L244 HydrophobicContact CE2-CD2 4.09Å; F240-L244 HydrophobicContact CZ-CD1 4Å; F240-L244 HydrophobicContact CZ-CD2 4.03Å; F240-L244 HydrophobicContact CZ-CG 4.38Å; A241-L244 WeakPolarHBondContact O-CB 3.43Å; A241-L244 PolarHBondContact O-N 3.26Å; L244-M246 PolarHBondContact O-N 2.76Å; L244-F247 HydrophobicContact CB-CB 4.06Å; L244-F247 PolarHBondContact O-N 3.28Å; L244-S248 PolarHBondContact O-N 2.96Å; L244-A332 HydrophobicContact CD1-CB 3.97Å; L244-L335 HydrophobicContact CD1-CD2 3.76Å
245	P	88.7	Confident	86.4	Confident	20 Å²	20	57.9 Å²	57.9	13%	0.13	30%	0.296	C	S	.	.	H	α-helix	trans	-59.2	-45.6	-172.3	21.1	-32	0	0	0	111.9	L173 L176 F247 E249	L173-P245 HydrophobicContact CD1-CG 3.71Å; L176-P245 HydrophobicContact CD1-CG 4.44Å; P245-F247 PolarHBondContact O-N 3.48Å; P245-E249 VanDerWaalsContact O-CB 3.29Å; P245-E249 WeakPolarHBondContact O-CB 3.5Å; P245-E249 PolarHBondContact O-N 3.35Å
246	M	87.9	Confident	86.3	Confident	27 Å²	27	61 Å²	61	13%	0.133	31%	0.307	C	S	.	.	H	α-helix	trans	-78.3	2.3	-178.4	-63.9	-179	-72.1	0	0	114.6	L173 L244 M336 C352 T355 Y356	L173-M246 HydrophobicContact CD1-CE 4.32Å; L173-M246 HydrophobicContact CD2-CE 4.24Å; L244-M246 PolarHBondContact O-N 2.76Å; M246-M336 HydrophobicContact CB-CE 3.91Å; M246-M336 WeakPolarHBondContact O-CE 3.32Å; M246-C352 HydrophobicContact CB-CB 4.25Å; M246-C352 HydrophobicContact SD-CB 4.07Å; M246-T355 HydrophobicContact CE-CG2 3.93Å; M246-T355 HydrophobicContact SD-CG2 4.21Å; M246-Y356 HydrophobicContact CE-CD1 4.08Å; M246-Y356 HydrophobicContact CE-CD2 3.8Å; M246-Y356 HydrophobicContact CE-CE1 3.62Å; M246-Y356 HydrophobicContact CE-CE2 3.35Å; M246-Y356 HydrophobicContact CE-CG 4.14Å
247	F	89.1	Confident	86.2	Confident	2 Å²	2	59 Å²	59	1%	0.009	30%	0.299	C	S	.	.	H	α-helix	trans	-108.3	-43.7	179.1	-172.8	-93.4	0	0	0	112.4	A241 L244 P245 Q258 L261 L262 L335 M336	A241-F247 HydrophobicContact CB-CD1 3.72Å; A241-F247 HydrophobicContact CB-CD2 4.45Å; A241-F247 HydrophobicContact CB-CE1 3.6Å; A241-F247 HydrophobicContact CB-CE2 4.33Å; A241-F247 HydrophobicContact CB-CG 4.18Å; A241-F247 HydrophobicContact CB-CZ 3.92Å; A241-F247 WeakPolarHBondContact O-CB 3.4Å; A241-F247 WeakPolarHBondContact O-CD1 3.31Å; L244-F247 HydrophobicContact CB-CB 4.06Å; L244-F247 PolarHBondContact O-N 3.28Å; P245-F247 PolarHBondContact O-N 3.48Å; F247-Q258 HydrophobicContact CE1-CB 4.22Å; F247-Q258 HydrophobicContact CE1-CG 4.14Å; F247-Q258 HydrophobicContact CE2-CB 4.06Å; F247-Q258 HydrophobicContact CE2-CG 4Å; F247-Q258 HydrophobicContact CZ-CB 3.59Å; F247-Q258 HydrophobicContact CZ-CG 3.78Å; F247-Q258 PolarHBondContact O-NE2 3.08Å; F247-L261 HydrophobicContact CE2-CB 4.36Å; F247-L261 HydrophobicContact CE2-CD1 4.3Å; F247-L262 HydrophobicContact CE1-CD1 4.35Å; F247-L262 HydrophobicContact CZ-CD1 3.88Å; F247-L262 HydrophobicContact CZ-CD2 4.29Å; F247-L262 HydrophobicContact CZ-CG 3.79Å; F247-L335 HydrophobicContact CD2-CD1 4.33Å; F247-L335 HydrophobicContact CD2-CD2 3.77Å; F247-L335 HydrophobicContact CD2-CG 4.17Å; F247-L335 HydrophobicContact CE2-CD1 3.94Å; F247-L335 HydrophobicContact CE2-CD2 4.2Å; F247-L335 HydrophobicContact CE2-CG 4.28Å; F247-L335 HydrophobicContact CG-CD2 4.17Å; F247-M336 HydrophobicContact CB-CE 3.89Å; F247-M336 HydrophobicContact CD2-CE 4.31Å
248	S	78.4	Confident	86.1	Confident	44 Å²	44	61 Å²	61	31%	0.308	31%	0.308	S	S	.	.	H	α-helix	trans	-123.6	-4.9	-173.2	-76.1	0	0	0	0	116.3	K242 L244 D250	K242-S248 VanDerWaalsContact CA-OG 3.3Å; K242-S248 WeakPolarHBondContact CA-OG 3.35Å; K242-S248 VanDerWaalsContact O-CB 3.27Å; K242-S248 WeakPolarHBondContact O-CB 3.41Å; L244-S248 PolarHBondContact O-N 2.96Å; S248-D250 PolarHBondContact O-N 3.37Å
249	E	67.8	Low	86	Confident	128 Å²	128	63.3 Å²	63.3	60%	0.598	32%	0.319	S	S	*	.	S	Bend	trans	-66	133.3	170.7	-73.4	-174.3	169.5	0	0	110.1	P245 H251	P245-E249 VanDerWaalsContact O-CB 3.29Å; P245-E249 WeakPolarHBondContact O-CB 3.5Å; P245-E249 PolarHBondContact O-N 3.35Å; E249-H251 PolarHBondContact O-N 2.84Å; E249-H251 VanDerWaalsContact O-N 3.12Å
250	D	49.8	Very low	85.9	Confident	148 Å²	148	62.3 Å²	62.3	79%	0.791	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.5	117.6	-176.3	-84.2	-35.9	0	0	0	110	S248	S248-D250 PolarHBondContact O-N 3.37Å
251	H	55	Low	85.9	Confident	186 Å²	186	62.3 Å²	62.3	86%	0.861	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.9	12.9	167.9	-48.9	80.8	0	0	0	120.5	E249	E249-H251 PolarHBondContact O-N 2.84Å; E249-H251 VanDerWaalsContact O-N 3.12Å
252	Q	68.3	Low	85.9	Confident	98 Å²	98	63.8 Å²	63.8	46%	0.458	32%	0.321	S	S	.	.	S	Bend	trans	-105.5	-42.1	-179.1	-85.1	159.8	8.6	0	0	117.7
253	L	86.6	Confident	86	Confident	16 Å²	16	60.7 Å²	60.7	8%	0.084	31%	0.308	C	S	.	.	S	Bend	trans	-125.2	134.5	178.8	-68	175.6	0	0	0	112.7	Q258 L261 M336 K348 I349	L253-Q258 HydrophobicContact CB-CG 4.08Å; L253-Q258 PolarHBondContact O-NE2 2.95Å; L253-L261 HydrophobicContact CD1-CD1 4.02Å; L253-M336 HydrophobicContact CD1-SD 4.43Å; L253-K348 HydrophobicContact CD2-CB 4.42Å; L253-I349 HydrophobicContact CD1-CG1 4.38Å; L253-I349 HydrophobicContact CD2-CD1 4.36Å; L253-I349 HydrophobicContact CD2-CG1 3.72Å
254	P	91.1	Very high	86	Confident	41 Å²	41	56.5 Å²	56.5	27%	0.266	30%	0.295	S	S	.	.			trans	-54.2	148.9	170.4	-24.3	34.3	0	0	0	112.2	E256 D257 Q258 S345	P254-E256 PolarHBondContact O-N 3.15Å; P254-D257 HydrophobicContact CB-CB 4.38Å; P254-D257 PolarHBondContact O-N 3.43Å; P254-Q258 WeakPolarHBondContact O-CG 3.36Å; P254-Q258 PolarHBondContact O-N 3.37Å; P254-S345 WeakPolarHBondContact CD-OG 3.14Å
255	C	91.5	Very high	86.1	Confident	76 Å²	76	56.4 Å²	56.4	51%	0.514	30%	0.295	S	S	.	.	H	α-helix	trans	-60.2	-37	179.2	-170.5	0	0	0	0	111.2	Q258 I259	C255-Q258 WeakPolarHBondContact O-CB 3.46Å; C255-Q258 PolarHBondContact O-N 3.12Å; C255-I259 VanDerWaalsContact O-CG1 3.31Å; C255-I259 WeakPolarHBondContact O-CG1 3.46Å; C255-I259 PolarHBondContact O-N 2.79Å
256	E	93.4	Very high	86.6	Confident	122 Å²	122	55.7 Å²	55.7	57%	0.57	29%	0.29	S	S	*	.	H	α-helix	trans	-60.5	-48	176.9	-61.8	73.5	-162.9	0	0	111	P254 Q258 I259 I260	P254-E256 PolarHBondContact O-N 3.15Å; E256-Q258 VanDerWaalsContact C-N 3.33Å; E256-Q258 PolarHBondContact O-N 2.99Å; E256-I259 PolarHBondContact O-N 3.49Å; E256-I260 VanDerWaalsContact O-CG1 3.31Å; E256-I260 WeakPolarHBondContact O-CG1 3.35Å; E256-I260 PolarHBondContact O-N 2.81Å
257	D	94.8	Very high	87	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.8	-41.3	175.7	-73.8	0.6	0	0	0	110.7	P254 I259 I260 L261 L343 T344 S345	P254-D257 HydrophobicContact CB-CB 4.38Å; P254-D257 PolarHBondContact O-N 3.43Å; D257-I259 VanDerWaalsContact C-N 3.33Å; D257-I259 PolarHBondContact O-N 3.03Å; D257-I260 PolarHBondContact O-N 3.45Å; D257-L261 WeakPolarHBondContact O-CB 3.1Å; D257-L261 VanDerWaalsContact O-CG 3.24Å; D257-L261 WeakPolarHBondContact O-CG 3.48Å; D257-L261 PolarHBondContact O-N 2.94Å; D257-L343 HydrophobicContact CB-CD2 3.96Å; D257-T344 PolarHBondContact OD1-N 2.92Å; D257-T344 PolarHBondContact OD1-OG1 3.28Å; D257-T344 PolarHBondContact OD2-OG1 3.49Å; D257-S345 WeakPolarHBondContact OD2-CB 3.37Å; D257-S345 PolarHBondContact OD2-N 2.62Å; D257-S345 PolarHBondContact OD2-OG 3.44Å; D257-S345 VanDerWaalsContact OD2-OG 3.12Å
258	Q	95.1	Very high	87.4	Confident	43 Å²	43	55.1 Å²	55.1	20%	0.201	29%	0.287	C	S	.	.	H	α-helix	trans	-60	-42.6	176.6	-70.1	178.3	38.7	0	0	112.1	F247 L253 P254 C255 E256 L261 L262	F247-Q258 HydrophobicContact CE1-CB 4.22Å; F247-Q258 HydrophobicContact CE1-CG 4.14Å; F247-Q258 HydrophobicContact CE2-CB 4.06Å; F247-Q258 HydrophobicContact CE2-CG 4Å; F247-Q258 HydrophobicContact CZ-CB 3.59Å; F247-Q258 HydrophobicContact CZ-CG 3.78Å; F247-Q258 PolarHBondContact O-NE2 3.08Å; L253-Q258 HydrophobicContact CB-CG 4.08Å; L253-Q258 PolarHBondContact O-NE2 2.95Å; P254-Q258 WeakPolarHBondContact O-CG 3.36Å; P254-Q258 PolarHBondContact O-N 3.37Å; C255-Q258 WeakPolarHBondContact O-CB 3.46Å; C255-Q258 PolarHBondContact O-N 3.12Å; E256-Q258 VanDerWaalsContact C-N 3.33Å; E256-Q258 PolarHBondContact O-N 2.99Å; Q258-L261 PolarHBondContact O-N 3.4Å; Q258-L262 WeakPolarHBondContact O-CB 3.29Å; Q258-L262 VanDerWaalsContact O-CG 3.31Å; Q258-L262 WeakPolarHBondContact O-CG 3.29Å; Q258-L262 PolarHBondContact O-N 3.19Å
259	I	94.7	Very high	88.3	Confident	83 Å²	83	53 Å²	53	43%	0.426	27%	0.272	S	S	.	.	H	α-helix	trans	-63	-46.7	176.6	-68.5	164	0	0	0	110.2	C255 E256 D257 L261 L262 K263	C255-I259 VanDerWaalsContact O-CG1 3.31Å; C255-I259 WeakPolarHBondContact O-CG1 3.46Å; C255-I259 PolarHBondContact O-N 2.79Å; E256-I259 PolarHBondContact O-N 3.49Å; D257-I259 VanDerWaalsContact C-N 3.33Å; D257-I259 PolarHBondContact O-N 3.03Å; I259-L261 PolarHBondContact O-N 2.83Å; I259-L262 PolarHBondContact O-N 3.25Å; I259-K263 HydrophobicContact CG2-CD 4.26Å; I259-K263 HydrophobicContact CG2-CG 4.35Å; I259-K263 WeakPolarHBondContact O-CG 3.34Å; I259-K263 PolarHBondContact O-N 3.08Å
260	I	96.1	Very high	89.7	Confident	43 Å²	43	48.3 Å²	48.3	22%	0.221	25%	0.251	C	S	.	.	H	α-helix	trans	-60	-46.1	179	-68.1	166.3	0	0	0	110.9	E256 D257 K263 G264 R340 G342 L343	E256-I260 VanDerWaalsContact O-CG1 3.31Å; E256-I260 WeakPolarHBondContact O-CG1 3.35Å; E256-I260 PolarHBondContact O-N 2.81Å; D257-I260 PolarHBondContact O-N 3.45Å; I260-K263 PolarHBondContact O-N 2.76Å; I260-G264 PolarHBondContact O-N 3.16Å; I260-R340 HydrophobicContact CG2-CB 3.63Å; I260-R340 HydrophobicContact CG2-CG 4.47Å; I260-G342 WeakPolarHBondContact CD1-O 3.5Å; I260-L343 HydrophobicContact CB-CD2 3.91Å; I260-L343 HydrophobicContact CD1-CD2 4.42Å; I260-L343 HydrophobicContact CG2-CD2 3.66Å; I260-L343 HydrophobicContact CG2-CG 3.97Å
261	L	96.9	Very high	92	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-45.5	177.9	-67.9	173.3	0	0	0	111.5	F247 L253 D257 Q258 I259 G264 C265 L335 S337 R340 L343 I349	F247-L261 HydrophobicContact CE2-CB 4.36Å; F247-L261 HydrophobicContact CE2-CD1 4.3Å; L253-L261 HydrophobicContact CD1-CD1 4.02Å; D257-L261 WeakPolarHBondContact O-CB 3.1Å; D257-L261 VanDerWaalsContact O-CG 3.24Å; D257-L261 WeakPolarHBondContact O-CG 3.48Å; D257-L261 PolarHBondContact O-N 2.94Å; Q258-L261 PolarHBondContact O-N 3.4Å; I259-L261 PolarHBondContact O-N 2.83Å; L261-G264 PolarHBondContact O-N 3.1Å; L261-C265 PolarHBondContact O-N 2.77Å; L261-C265 PolarHBondContact O-SG 3.31Å; L261-L335 HydrophobicContact CB-CD1 4.36Å; L261-L335 WeakPolarHBondContact CD2-O 3.5Å; L261-S337 WeakPolarHBondContact CD2-O 3.5Å; L261-R340 HydrophobicContact CD2-CG 4.34Å; L261-L343 HydrophobicContact CD2-CD1 4.13Å; L261-L343 HydrophobicContact CD2-CD2 4.13Å; L261-L343 HydrophobicContact CG-CD2 4.1Å; L261-I349 HydrophobicContact CD1-CD1 4.13Å; L261-I349 HydrophobicContact CD1-CG1 4.33Å; L261-I349 HydrophobicContact CD2-CD1 4.33Å; L261-I349 HydrophobicContact CD2-CG2 4.24Å
262	L	96.9	Very high	94	Very high	31 Å²	31	32.5 Å²	32.5	16%	0.162	17%	0.172	C	C	.	.	H	α-helix	trans	-61.7	-47.3	177.7	-78.5	168.8	0	0	0	112.1	V238 A241 F247 Q258 I259 G264 C265 C266 L335	V238-L262 HydrophobicContact CG1-CD1 4.35Å; V238-L262 HydrophobicContact CG2-CD1 4.32Å; V238-L262 HydrophobicContact CG2-CD2 4.18Å; A241-L262 HydrophobicContact CB-CD2 3.69Å; F247-L262 HydrophobicContact CE1-CD1 4.35Å; F247-L262 HydrophobicContact CZ-CD1 3.88Å; F247-L262 HydrophobicContact CZ-CD2 4.29Å; F247-L262 HydrophobicContact CZ-CG 3.79Å; Q258-L262 WeakPolarHBondContact O-CB 3.29Å; Q258-L262 VanDerWaalsContact O-CG 3.31Å; Q258-L262 WeakPolarHBondContact O-CG 3.29Å; Q258-L262 PolarHBondContact O-N 3.19Å; I259-L262 PolarHBondContact O-N 3.25Å; L262-G264 VanDerWaalsContact C-N 3.32Å; L262-G264 PolarHBondContact O-N 2.98Å; L262-C265 PolarHBondContact O-N 2.94Å; L262-C266 VanDerWaalsContact O-CB 3.26Å; L262-C266 WeakPolarHBondContact O-CB 3.46Å; L262-C266 PolarHBondContact O-N 2.83Å; L262-L335 HydrophobicContact CD2-CD1 4.23Å
263	K	95.5	Very high	95.3	Very high	57 Å²	57	28.1 Å²	28.1	25%	0.248	15%	0.152	C	C	.	.	H	α-helix	trans	-60.4	-43.5	177	-70.8	-167.2	-178.1	-160.5	0	111.4	I259 I260 E414 V415	I259-K263 HydrophobicContact CG2-CD 4.26Å; I259-K263 HydrophobicContact CG2-CG 4.35Å; I259-K263 WeakPolarHBondContact O-CG 3.34Å; I259-K263 PolarHBondContact O-N 3.08Å; I260-K263 PolarHBondContact O-N 2.76Å; K263-E414 WeakPolarHBondContact CE-O 3.39Å; K263-E414 PolarHBondContact NZ-O 3.23Å; K263-V415 WeakPolarHBondContact CG-O 3.36Å
264	G	95	Very high	95.7	Very high	20 Å²	20	27.7 Å²	27.7	21%	0.206	15%	0.15	C	C	.	.	H	α-helix	trans	-65.2	-43.5	179.7	0	0	0	0	0	114	I260 L261 L262 R340	I260-G264 PolarHBondContact O-N 3.16Å; L261-G264 PolarHBondContact O-N 3.1Å; L262-G264 VanDerWaalsContact C-N 3.32Å; L262-G264 PolarHBondContact O-N 2.98Å; G264-R340 VanDerWaalsContact C-NH1 3.34Å; G264-R340 VanDerWaalsContact O-CZ 3.29Å; G264-R340 PolarHBondContact O-NH1 3.43Å; G264-R340 PolarHBondContact O-NH2 2.99Å
265	C	96.7	Very high	96	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-91.6	-11.7	-172.9	78.5	0	0	0	0	114.2	L261 L262 M267 E268 I269 L334 L335	L261-C265 PolarHBondContact O-N 2.77Å; L261-C265 PolarHBondContact O-SG 3.31Å; L262-C265 PolarHBondContact O-N 2.94Å; C265-M267 PolarHBondContact O-N 3.01Å; C265-E268 WeakPolarHBondContact O-CB 3.45Å; C265-E268 PolarHBondContact O-N 3.3Å; C265-E268 VanDerWaalsContact O-N 3.11Å; C265-I269 HydrophobicContact CB-CD1 4.22Å; C265-I269 HydrophobicContact CB-CG1 4.48Å; C265-I269 PolarHBondContact O-N 2.92Å; C265-L334 WeakPolarHBondContact CB-O 3.4Å; C265-L335 WeakPolarHBondContact SG-CD1 3.46Å
266	C	97.4	Very high	96.1	Very high	4 Å²	4	24.5 Å²	24.5	3%	0.027	13%	0.126	C	C	.	.	H	α-helix	trans	-56.2	-51.5	-167.7	-167.5	0	0	0	0	112.5	L262 E268 I269 M270 V415 F416	L262-C266 VanDerWaalsContact O-CB 3.26Å; L262-C266 WeakPolarHBondContact O-CB 3.46Å; L262-C266 PolarHBondContact O-N 2.83Å; C266-E268 VanDerWaalsContact C-N 3.33Å; C266-E268 PolarHBondContact O-N 2.69Å; C266-I269 PolarHBondContact O-N 2.85Å; C266-M270 WeakPolarHBondContact O-CB 3.27Å; C266-M270 WeakPolarHBondContact O-CG 3.43Å; C266-M270 PolarHBondContact O-N 3.07Å; C266-V415 HydrophobicContact CB-CG1 3.8Å; C266-F416 HydrophobicContact CB-CE1 4.12Å; C266-F416 HydrophobicContact CB-CZ 3.87Å
267	M	96.4	Very high	96.1	Very high	14 Å²	14	19 Å²	19	7%	0.069	10%	0.1	C	C	.	.	H	α-helix	trans	-65.6	-37	179.2	-176.2	58.6	178.4	0	0	112.3	C265 M270 S271 L303 V306 I310 I388 H392 F416	C265-M267 PolarHBondContact O-N 3.01Å; M267-M270 PolarHBondContact O-N 2.93Å; M267-M270 HydrophobicContact SD-CE 4.25Å; M267-S271 WeakPolarHBondContact O-CB 3.26Å; M267-S271 PolarHBondContact O-N 2.95Å; M267-S271 PolarHBondContact O-OG 3Å; M267-L303 HydrophobicContact CE-CD1 4.38Å; M267-L303 HydrophobicContact CE-CD2 4.17Å; M267-V306 HydrophobicContact CE-CG1 3.87Å; M267-I310 HydrophobicContact CE-CD1 4Å; M267-I388 HydrophobicContact CE-CG2 4.48Å; M267-H392 HydrophobicContact CE-CB 4.08Å; M267-H392 HydrophobicContact CG-CB 3.65Å; M267-H392 HydrophobicContact SD-CB 4.43Å; M267-F416 HydrophobicContact CB-CE1 3.8Å; M267-F416 HydrophobicContact CB-CZ 4.13Å
268	E	97.9	Very high	96.2	Very high	3 Å²	3	19.8 Å²	19.8	1%	0.014	10%	0.103	C	C	.	.	H	α-helix	trans	-63.1	-48.9	179.3	-53.6	174.6	-174.4	0	0	110.3	C265 C266 S271 L272 L334 R340 L385 R386	C265-E268 WeakPolarHBondContact O-CB 3.45Å; C265-E268 PolarHBondContact O-N 3.3Å; C265-E268 VanDerWaalsContact O-N 3.11Å; C266-E268 VanDerWaalsContact C-N 3.33Å; C266-E268 PolarHBondContact O-N 2.69Å; E268-S271 PolarHBondContact O-N 3.49Å; E268-L272 WeakPolarHBondContact O-CB 3.47Å; E268-L272 PolarHBondContact O-N 2.83Å; E268-L334 HydrophobicContact CB-CD2 4.39Å; E268-L334 WeakPolarHBondContact OE2-CD2 3.5Å; E268-R340 IonicContact OE1-CZ 3.27Å; E268-R340 IonicContact OE1-NH1 3.77Å; E268-R340 PolarHBondContact OE1-NH1 2.93Å; E268-R340 VanDerWaalsContact OE1-NH1 3.08Å; E268-R340 IonicContact OE1-NH2 3.02Å; E268-R340 PolarHBondContact OE1-NH2 3.32Å; E268-R340 IonicContact OE2-NH2 3.49Å; E268-R340 PolarHBondContact OE2-NH2 3.24Å; E268-L385 HydrophobicContact CB-CB 4.42Å; E268-L385 WeakPolarHBondContact O-CD2 3.31Å; E268-R386 VanDerWaalsContact CD-CD 3.41Å; E268-R386 WeakPolarHBondContact OE1-CD 3.5Å; E268-R386 IonicContact OE1-NE 2.8Å; E268-R386 VanDerWaalsContact OE2-CD 3.23Å; E268-R386 WeakPolarHBondContact OE2-CD 3.24Å; E268-R386 IonicContact OE2-NE 2.87Å
269	I	98.1	Very high	96.1	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	9%	0.094	C	C	.	.	H	α-helix	trans	-66	-42.5	178.3	-69.1	178.7	0	0	0	111.3	V237 C265 C266 S271 L272 R273 Q331 L334 L335	V237-I269 HydrophobicContact CB-CG2 4.47Å; V237-I269 HydrophobicContact CG1-CB 4.22Å; V237-I269 HydrophobicContact CG1-CD1 3.94Å; V237-I269 HydrophobicContact CG1-CG2 4.1Å; V237-I269 HydrophobicContact CG2-CB 4.23Å; V237-I269 HydrophobicContact CG2-CG2 3.66Å; C265-I269 HydrophobicContact CB-CD1 4.22Å; C265-I269 HydrophobicContact CB-CG1 4.48Å; C265-I269 PolarHBondContact O-N 2.92Å; C266-I269 PolarHBondContact O-N 2.85Å; I269-S271 VanDerWaalsContact C-N 3.33Å; I269-S271 PolarHBondContact O-N 3.45Å; I269-L272 PolarHBondContact O-N 3.21Å; I269-R273 HydrophobicContact CG2-CG 4.45Å; I269-R273 WeakPolarHBondContact O-CB 3.34Å; I269-R273 WeakPolarHBondContact O-CG 3.28Å; I269-R273 PolarHBondContact O-N 3.07Å; I269-Q331 HydrophobicContact CD1-CB 4.27Å; I269-Q331 HydrophobicContact CG1-CB 4.32Å; I269-Q331 HydrophobicContact CG1-CG 4.27Å; I269-Q331 HydrophobicContact CG2-CG 4.01Å; I269-L334 HydrophobicContact CG1-CB 4.36Å; I269-L335 HydrophobicContact CD1-CB 4.44Å
270	M	96.6	Very high	96.1	Very high	28 Å²	28	17.6 Å²	17.6	14%	0.138	10%	0.097	C	C	.	.	H	α-helix	trans	-62.1	-41.8	176.1	-73.5	-167.2	-61.5	0	0	111.8	A233 I234 V237 C266 M267 R273 A274 F416	A233-M270 HydrophobicContact CB-CG 4.36Å; A233-M270 HydrophobicContact CB-SD 3.68Å; I234-M270 HydrophobicContact CG1-CE 4.28Å; I234-M270 HydrophobicContact CG1-SD 4.06Å; V237-M270 HydrophobicContact CG2-CG 3.98Å; C266-M270 WeakPolarHBondContact O-CB 3.27Å; C266-M270 WeakPolarHBondContact O-CG 3.43Å; C266-M270 PolarHBondContact O-N 3.07Å; M267-M270 PolarHBondContact O-N 2.93Å; M267-M270 HydrophobicContact SD-CE 4.25Å; M270-R273 PolarHBondContact O-N 3.43Å; M270-A274 PolarHBondContact O-N 2.9Å; M270-F416 HydrophobicContact CE-CE2 4.03Å; M270-F416 HydrophobicContact CE-CZ 3.66Å
271	S	97.6	Very high	95.9	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.014	13%	0.127	C	C	.	.	H	α-helix	trans	-64.5	-43.5	177.2	-62	0	0	0	0	111.7	M267 E268 I269 A274 A275 I388	M267-S271 WeakPolarHBondContact O-CB 3.26Å; M267-S271 PolarHBondContact O-N 2.95Å; M267-S271 PolarHBondContact O-OG 3Å; E268-S271 PolarHBondContact O-N 3.49Å; I269-S271 VanDerWaalsContact C-N 3.33Å; I269-S271 PolarHBondContact O-N 3.45Å; S271-A274 PolarHBondContact O-N 2.91Å; S271-A275 VanDerWaalsContact O-CB 3.26Å; S271-A275 WeakPolarHBondContact O-CB 3.46Å; S271-A275 PolarHBondContact O-N 2.83Å; S271-I388 WeakPolarHBondContact OG-CG2 3.43Å
272	L	97.8	Very high	95.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.3	-48.1	173.1	175.1	59	0	0	0	111.4	E268 I269 A274 A275 I276 L317 V327 L330 Q331 L334 L385	E268-L272 WeakPolarHBondContact O-CB 3.47Å; E268-L272 PolarHBondContact O-N 2.83Å; I269-L272 PolarHBondContact O-N 3.21Å; L272-A274 PolarHBondContact O-N 3Å; L272-A275 PolarHBondContact O-N 3.44Å; L272-I276 HydrophobicContact CD1-CG2 3.88Å; L272-I276 VanDerWaalsContact O-CG1 3.28Å; L272-I276 WeakPolarHBondContact O-CG1 3.35Å; L272-I276 WeakPolarHBondContact O-CG2 3.43Å; L272-I276 PolarHBondContact O-N 2.82Å; L272-L317 HydrophobicContact CD1-CD1 3.73Å; L272-V327 HydrophobicContact CD2-CG1 4.44Å; L272-V327 HydrophobicContact CG-CG1 4.43Å; L272-L330 HydrophobicContact CD1-CD2 3.74Å; L272-L330 HydrophobicContact CD2-CB 4.11Å; L272-L330 HydrophobicContact CD2-CD2 3.69Å; L272-L330 HydrophobicContact CD2-CG 3.85Å; L272-L330 HydrophobicContact CG-CD2 4.39Å; L272-Q331 HydrophobicContact CD2-CG 3.75Å; L272-L334 HydrophobicContact CD2-CD1 4.04Å; L272-L385 HydrophobicContact CB-CD1 4.04Å; L272-L385 HydrophobicContact CB-CD2 3.97Å; L272-L385 HydrophobicContact CD1-CD1 4.2Å; L272-L385 HydrophobicContact CD2-CD1 4.27Å; L272-L385 HydrophobicContact CG-CD1 4.4Å
273	R	95.6	Very high	95.6	Very high	7 Å²	7	29.6 Å²	29.6	3%	0.026	16%	0.155	C	C	.	.	H	α-helix	trans	-63.3	-27.5	177.9	-74.4	178.3	178.4	-164	-6.7	113.3	T184 R236 I269 M270 R277 Q331	T184-R273 PolarHBondContact O-NH1 3.27Å; T184-R273 PolarHBondContact OG1-NH2 3.17Å; T184-R273 VanDerWaalsContact OG1-NH2 3.16Å; R236-R273 PolarHBondContact O-NH1 2.96Å; R236-R273 VanDerWaalsContact O-NH1 3.13Å; I269-R273 HydrophobicContact CG2-CG 4.45Å; I269-R273 WeakPolarHBondContact O-CB 3.34Å; I269-R273 WeakPolarHBondContact O-CG 3.28Å; I269-R273 PolarHBondContact O-N 3.07Å; M270-R273 PolarHBondContact O-N 3.43Å; R273-R277 PolarHBondContact O-NE 3.33Å; R273-R277 PolarHBondContact O-NH2 2.93Å; R273-Q331 VanDerWaalsContact CZ-OE1 3.26Å
274	A	95.1	Very high	95.6	Very high	6 Å²	6	26.9 Å²	26.9	5%	0.05	14%	0.144	C	C	.	.	H	α-helix	trans	-76.5	-48.8	171.3	0	0	0	0	0	110.7	M270 S271 L272 I276 R277 L285 L287 I310	M270-A274 PolarHBondContact O-N 2.9Å; S271-A274 PolarHBondContact O-N 2.91Å; L272-A274 PolarHBondContact O-N 3Å; A274-I276 PolarHBondContact O-N 2.87Å; A274-R277 CarbonylContact O-C 3.49Å; A274-R277 WeakPolarHBondContact O-CA 3.33Å; A274-R277 PolarHBondContact O-N 3.19Å; A274-L285 WeakPolarHBondContact O-CD2 3.41Å; A274-L287 HydrophobicContact CB-CD2 3.97Å; A274-I310 HydrophobicContact CB-CG2 4.3Å
275	A	96.6	Very high	95.6	Very high	1 Å²	1	26 Å²	26	1%	0.008	13%	0.134	C	C	.	.	H	α-helix	trans	-60.7	-39.8	-176.9	0	0	0	0	0	113.3	S271 L272 R277 Y278 L313 G314 L317	S271-A275 VanDerWaalsContact O-CB 3.26Å; S271-A275 WeakPolarHBondContact O-CB 3.46Å; S271-A275 PolarHBondContact O-N 2.83Å; L272-A275 PolarHBondContact O-N 3.44Å; A275-R277 PolarHBondContact O-N 3.32Å; A275-Y278 WeakPolarHBondContact O-CB 3.38Å; A275-Y278 PolarHBondContact O-N 3.23Å; A275-L313 HydrophobicContact CB-CB 4.37Å; A275-L313 HydrophobicContact CB-CD2 3.93Å; A275-L313 HydrophobicContact CB-CG 3.94Å; A275-G314 WeakPolarHBondContact O-CA 3.44Å; A275-L317 HydrophobicContact CB-CD1 4.05Å
276	I	94.9	Very high	95.4	Very high	49 Å²	49	26 Å²	26	25%	0.251	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-15.5	174.6	61.1	116.9	0	0	0	113.3	L272 A274 L317 V327	L272-I276 HydrophobicContact CD1-CG2 3.88Å; L272-I276 VanDerWaalsContact O-CG1 3.28Å; L272-I276 WeakPolarHBondContact O-CG1 3.35Å; L272-I276 WeakPolarHBondContact O-CG2 3.43Å; L272-I276 PolarHBondContact O-N 2.82Å; A274-I276 PolarHBondContact O-N 2.87Å; I276-L317 HydrophobicContact CG2-CD1 4.23Å; I276-V327 HydrophobicContact CG2-CG1 4.27Å; I276-V327 HydrophobicContact CG2-CG2 3.8Å
277	R	93.6	Very high	95.1	Very high	7 Å²	7	26.9 Å²	26.9	3%	0.026	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	30.1	173.1	-64.5	-176.7	-71.2	110.5	14.7	111.6	W191 R273 A274 A275 T286 G289	W191-R277 HydrophobicContact CD2-CB 4.02Å; W191-R277 HydrophobicContact CD2-CG 3.96Å; W191-R277 HydrophobicContact CE3-CB 4.22Å; W191-R277 HydrophobicContact CG-CG 4.05Å; W191-R277 HydrophobicContact CH2-CB 4.17Å; W191-R277 WeakPolarHBondContact CH2-O 3.46Å; W191-R277 HydrophobicContact CZ2-CB 4Å; W191-R277 HydrophobicContact CZ2-CG 4.33Å; W191-R277 HydrophobicContact CZ3-CB 4.31Å; W191-R277 WeakPolarHBondContact CZ3-O 3.49Å; R273-R277 PolarHBondContact O-NE 3.33Å; R273-R277 PolarHBondContact O-NH2 2.93Å; A274-R277 CarbonylContact O-C 3.49Å; A274-R277 WeakPolarHBondContact O-CA 3.33Å; A274-R277 PolarHBondContact O-N 3.19Å; A275-R277 PolarHBondContact O-N 3.32Å; R277-T286 PolarHBondContact NH1-O 3.42Å; R277-T286 PolarHBondContact NH2-O 2.96Å; R277-T286 PolarHBondContact O-N 3.28Å; R277-G289 VanDerWaalsContact NH1-CA 3.33Å
278	Y	95.4	Very high	94.5	Very high	17 Å²	17	27 Å²	27	7%	0.067	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	134.6	165.8	179.2	-110.3	0	0	0	110.4	A275 P280 T284 L285 F311 K315 A318	A275-Y278 WeakPolarHBondContact O-CB 3.38Å; A275-Y278 PolarHBondContact O-N 3.23Å; Y278-P280 HydrophobicContact CD1-CG 4.17Å; Y278-P280 HydrophobicContact CE1-CB 4.22Å; Y278-P280 HydrophobicContact CE1-CG 3.97Å; Y278-T284 WeakPolarHBondContact CA-O 3.23Å; Y278-T284 WeakPolarHBondContact CD2-O 3.33Å; Y278-L285 HydrophobicContact CD2-CD2 3.93Å; Y278-L285 HydrophobicContact CD2-CG 4.43Å; Y278-L285 HydrophobicContact CG-CD2 4.3Å; Y278-F311 HydrophobicContact CD2-CD1 4.31Å; Y278-F311 HydrophobicContact CE2-CD1 4.06Å; Y278-F311 HydrophobicContact CE2-CE1 4.41Å; Y278-K315 HydrophobicContact CD1-CG 4.32Å; Y278-K315 HydrophobicContact CE1-CB 4.28Å; Y278-K315 HydrophobicContact CE1-CG 3.54Å; Y278-K315 HydrophobicContact CE2-CG 4.21Å; Y278-K315 VanDerWaalsContact CZ-CG 3.48Å; Y278-K315 VanDerWaalsContact OH-CE 3.25Å; Y278-K315 WeakPolarHBondContact OH-CE 3.35Å; Y278-K315 WeakPolarHBondContact OH-CG 3.43Å; Y278-A318 HydrophobicContact CD1-CB 4.27Å
279	D	93.8	Very high	93.6	Very high	3 Å²	3	26.9 Å²	26.9	2%	0.016	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	109.7	176.2	-173.3	42.4	0	0	0	110.4	W191 K192 R195 E281 S282 E283 T284	W191-D279 HydrophobicContact CH2-CB 4.02Å; W191-D279 HydrophobicContact CZ3-CB 4.49Å; K192-D279 IonicContact NZ-OD1 3.08Å; K192-D279 PolarHBondContact NZ-OD1 2.98Å; R195-D279 IonicContact CZ-OD2 2.79Å; R195-D279 VanDerWaalsContact NH1-CB 3.33Å; R195-D279 IonicContact NH1-OD2 2.62Å; R195-D279 PolarHBondContact NH1-OD2 3.27Å; R195-D279 IonicContact NH2-OD2 3.51Å; R195-D279 PolarHBondContact NH2-OD2 3.44Å; D279-E281 VanDerWaalsContact C-N 3.26Å; D279-E281 PolarHBondContact O-N 3.46Å; D279-S282 WeakPolarHBondContact OD2-CB 3.26Å; D279-S282 PolarHBondContact OD2-N 3.17Å; D279-S282 PolarHBondContact OD2-OG 3.37Å; D279-E283 VanDerWaalsContact O-CA 3.27Å; D279-E283 WeakPolarHBondContact O-CA 3.37Å; D279-E283 PolarHBondContact O-N 3.07Å; D279-T284 PolarHBondContact N-O 2.92Å; D279-T284 PolarHBondContact O-N 3.39Å
280	P	93.3	Very high	92.8	Very high	76 Å²	76	31.7 Å²	31.7	49%	0.494	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-28.5	-178.7	-24.1	34	0	0	0	114.2	Y278 A318	Y278-P280 HydrophobicContact CD1-CG 4.17Å; Y278-P280 HydrophobicContact CE1-CB 4.22Å; Y278-P280 HydrophobicContact CE1-CG 3.97Å; P280-A318 HydrophobicContact CG-CB 4.32Å
281	E	92.4	Very high	92.5	Very high	180 Å²	180	31.4 Å²	31.4	84%	0.841	16%	0.161	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-44.3	-177.3	-67.3	178.8	-173	0	0	112.4	D279	D279-E281 VanDerWaalsContact C-N 3.26Å; D279-E281 PolarHBondContact O-N 3.46Å
282	S	92.2	Very high	92.3	Very high	32 Å²	32	31.3 Å²	31.3	22%	0.224	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-4.5	179.1	59.7	0	0	0	0	113.7	R195 D279 T284	R195-S282 PolarHBondContact NH1-OG 3.2Å; R195-S282 PolarHBondContact NH2-OG 3.39Å; D279-S282 WeakPolarHBondContact OD2-CB 3.26Å; D279-S282 PolarHBondContact OD2-N 3.17Å; D279-S282 PolarHBondContact OD2-OG 3.37Å; S282-T284 WeakPolarHBondContact O-CG2 3.44Å; S282-T284 PolarHBondContact O-N 3Å; S282-T284 PolarHBondContact OG-OG1 2.96Å
283	E	94.8	Very high	92.1	Very high	115 Å²	115	31.3 Å²	31.3	54%	0.537	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	41.2	-171.8	-58.9	-165.2	118.4	0	0	113.5	D279	D279-E283 VanDerWaalsContact O-CA 3.27Å; D279-E283 WeakPolarHBondContact O-CA 3.37Å; D279-E283 PolarHBondContact O-N 3.07Å
284	T	95.6	Very high	92.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	150.7	-179.2	57.3	0	0	0	0	112.7	R195 F197 Y278 D279 S282 V293 K294	R195-T284 PolarHBondContact NH1-OG1 3.31Å; F197-T284 HydrophobicContact CD1-CG2 4.36Å; F197-T284 HydrophobicContact CE1-CG2 3.87Å; Y278-T284 WeakPolarHBondContact CA-O 3.23Å; Y278-T284 WeakPolarHBondContact CD2-O 3.33Å; D279-T284 PolarHBondContact N-O 2.92Å; D279-T284 PolarHBondContact O-N 3.39Å; S282-T284 WeakPolarHBondContact O-CG2 3.44Å; S282-T284 PolarHBondContact O-N 3Å; S282-T284 PolarHBondContact OG-OG1 2.96Å; T284-V293 VanDerWaalsContact CA-O 3.24Å; T284-V293 WeakPolarHBondContact CA-O 3.37Å; T284-V293 VanDerWaalsContact CB-O 3.26Å; T284-V293 WeakPolarHBondContact CB-O 3.38Å; T284-K294 HydrophobicContact CG2-CG 3.91Å
285	L	95.3	Very high	92.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	144.8	159.8	-67.9	174	0	0	0	108.4	A274 Y278 A292 V293 L298 I310 F311	A274-L285 WeakPolarHBondContact O-CD2 3.41Å; Y278-L285 HydrophobicContact CD2-CD2 3.93Å; Y278-L285 HydrophobicContact CD2-CG 4.43Å; Y278-L285 HydrophobicContact CG-CD2 4.3Å; L285-A292 CarbonylContact O-C 3.58Å; L285-A292 WeakPolarHBondContact O-CA 3.29Å; L285-V293 HydrophobicContact CB-CG2 4.15Å; L285-V293 PolarHBondContact N-O 2.95Å; L285-V293 WeakPolarHBondContact O-CG2 3.47Å; L285-V293 PolarHBondContact O-N 3.06Å; L285-L298 HydrophobicContact CD1-CD2 3.97Å; L285-I310 HydrophobicContact CD1-CB 4.32Å; L285-I310 HydrophobicContact CD1-CG2 3.55Å; L285-F311 HydrophobicContact CB-CE1 4.39Å; L285-F311 HydrophobicContact CB-CE2 4.4Å; L285-F311 HydrophobicContact CB-CZ 4.01Å; L285-F311 HydrophobicContact CD1-CD1 4.25Å; L285-F311 HydrophobicContact CD1-CD2 3.45Å; L285-F311 VanDerWaalsContact CD1-CD2 3.45Å; L285-F311 HydrophobicContact CD1-CE1 4.19Å; L285-F311 HydrophobicContact CD1-CE2 3.36Å; L285-F311 HydrophobicContact CD1-CG 3.9Å; L285-F311 HydrophobicContact CD1-CZ 3.74Å; L285-F311 HydrophobicContact CG-CD1 4Å; L285-F311 HydrophobicContact CG-CD2 4.08Å; L285-F311 HydrophobicContact CG-CE1 3.74Å; L285-F311 HydrophobicContact CG-CE2 3.81Å; L285-F311 HydrophobicContact CG-CG 4.16Å; L285-F311 HydrophobicContact CG-CZ 3.62Å
286	T	93.3	Very high	92	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.3	166.9	-54	0	0	0	0	108.8	W191 R195 R277 G289 I291	W191-T286 HydrophobicContact CE3-CG2 4.14Å; W191-T286 WeakPolarHBondContact CZ3-OG1 3.42Å; R195-T286 HydrophobicContact CB-CG2 3.83Å; R195-T286 WeakPolarHBondContact CD-OG1 3.24Å; R277-T286 PolarHBondContact NH1-O 3.42Å; R277-T286 PolarHBondContact NH2-O 2.96Å; R277-T286 PolarHBondContact O-N 3.28Å; T286-G289 WeakPolarHBondContact CG2-O 3.49Å; T286-I291 CarbonylContact C-O 3.55Å; T286-I291 WeakPolarHBondContact CA-O 3.32Å
287	L	91.2	Very high	91.9	Very high	24 Å²	24	42.4 Å²	42.4	13%	0.126	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	137.7	177.3	-52.1	-177.8	0	0	0	109.9	F226 I229 A274 G289 E290 I291 V293 L298	F226-L287 HydrophobicContact CD1-CD1 3.99Å; F226-L287 HydrophobicContact CE1-CD1 3.93Å; I229-L287 HydrophobicContact CD1-CB 3.39Å; I229-L287 HydrophobicContact CD1-CD1 4.08Å; I229-L287 HydrophobicContact CD1-CG 4.41Å; A274-L287 HydrophobicContact CB-CD2 3.97Å; L287-G289 PolarHBondContact O-N 3.14Å; L287-E290 PolarHBondContact O-N 3.16Å; L287-I291 PolarHBondContact N-O 3.24Å; L287-I291 PolarHBondContact O-N 3Å; L287-I291 VanDerWaalsContact O-N 3.1Å; L287-V293 HydrophobicContact CD1-CG1 4.1Å; L287-V293 HydrophobicContact CD1-CG2 4.04Å; L287-V293 HydrophobicContact CD2-CG2 4.37Å; L287-V293 HydrophobicContact CG-CG1 4.44Å; L287-V293 HydrophobicContact CG-CG2 3.97Å; L287-L298 HydrophobicContact CD1-CD1 3.96Å
288	S	83.3	Confident	91.9	Very high	16 Å²	16	42.3 Å²	42.3	11%	0.112	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	26.9	179.2	-70	0	0	0	0	116.7	A186 I229 R236 E290	A186-S288 VanDerWaalsContact CB-O 3.27Å; A186-S288 WeakPolarHBondContact CB-O 3.28Å; I229-S288 PolarHBondContact O-OG 3.03Å; R236-S288 VanDerWaalsContact NH2-CB 3.32Å; R236-S288 PolarHBondContact NH2-OG 3.08Å; S288-E290 PolarHBondContact O-N 2.79Å
289	G	78.8	Confident	91.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	-19.1	-175.8	0	0	0	0	0	114.5	Q187 R277 T286 L287	Q187-G289 PolarHBondContact OE1-O 3.38Å; R277-G289 VanDerWaalsContact NH1-CA 3.33Å; T286-G289 WeakPolarHBondContact CG2-O 3.49Å; L287-G289 PolarHBondContact O-N 3.14Å
290	E	82.4	Confident	91.8	Very high	102 Å²	102	47 Å²	47	48%	0.477	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-34.8	-159.6	-70	175.9	-175.8	0	0	114.4	R195 K196 L287 S288	R195-E290 CarbonylContact C-O 3.34Å; R195-E290 WeakPolarHBondContact CA-O 3.46Å; K196-E290 PolarHBondContact N-O 2.87Å; L287-E290 PolarHBondContact O-N 3.16Å; S288-E290 PolarHBondContact O-N 2.79Å
291	I	89.3	Confident	91.8	Very high	22 Å²	22	43.5 Å²	43.5	11%	0.113	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	110	-169.4	-52.1	-174.9	0	0	0	109.9	K196 L198 I229 T286 L287 V293	K196-I291 CarbonylContact O-C 3.2Å; K196-I291 WeakPolarHBondContact O-CA 3.43Å; L198-I291 HydrophobicContact CB-CG2 3.92Å; L198-I291 HydrophobicContact CD1-CG2 4.18Å; I229-I291 HydrophobicContact CD1-CD1 4.12Å; I229-I291 HydrophobicContact CG2-CD1 3.71Å; I229-I291 HydrophobicContact CG2-CG1 4.46Å; T286-I291 CarbonylContact C-O 3.55Å; T286-I291 WeakPolarHBondContact CA-O 3.32Å; L287-I291 PolarHBondContact N-O 3.24Å; L287-I291 PolarHBondContact O-N 3Å; L287-I291 VanDerWaalsContact O-N 3.1Å; I291-V293 HydrophobicContact CG2-CG1 3.83Å
292	A	93.1	Very high	91.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	124	172.2	0	0	0	0	0	110.2	R195 K196 F197 L198 L285	R195-A292 HydrophobicContact CB-CB 4.22Å; R195-A292 HydrophobicContact CG-CB 4.09Å; K196-A292 PolarHBondContact O-N 2.84Å; F197-A292 HydrophobicContact CD1-CB 3.91Å; F197-A292 HydrophobicContact CE1-CB 4.11Å; F197-A292 HydrophobicContact CG-CB 4.22Å; L198-A292 PolarHBondContact N-O 2.72Å; L285-A292 CarbonylContact O-C 3.58Å; L285-A292 WeakPolarHBondContact O-CA 3.29Å
293	V	95.1	Very high	91.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	141	-176.3	-60.2	0	0	0	0	110.8	L198 F226 T284 L285 L287 I291 Q297 L298 F311	L198-V293 HydrophobicContact CB-CG1 4.18Å; L198-V293 HydrophobicContact CD2-CG1 4.26Å; F226-V293 HydrophobicContact CE1-CG1 3.65Å; F226-V293 HydrophobicContact CZ-CG1 3.89Å; T284-V293 VanDerWaalsContact CA-O 3.24Å; T284-V293 WeakPolarHBondContact CA-O 3.37Å; T284-V293 VanDerWaalsContact CB-O 3.26Å; T284-V293 WeakPolarHBondContact CB-O 3.38Å; L285-V293 HydrophobicContact CB-CG2 4.15Å; L285-V293 PolarHBondContact N-O 2.95Å; L285-V293 WeakPolarHBondContact O-CG2 3.47Å; L285-V293 PolarHBondContact O-N 3.06Å; L287-V293 HydrophobicContact CD1-CG1 4.1Å; L287-V293 HydrophobicContact CD1-CG2 4.04Å; L287-V293 HydrophobicContact CD2-CG2 4.37Å; L287-V293 HydrophobicContact CG-CG1 4.44Å; L287-V293 HydrophobicContact CG-CG2 3.97Å; I291-V293 HydrophobicContact CG2-CG1 3.83Å; V293-Q297 HydrophobicContact CB-CB 4.47Å; V293-L298 HydrophobicContact CG2-CB 4.13Å; V293-L298 HydrophobicContact CG2-CD2 4.48Å; V293-F311 WeakPolarHBondContact O-CZ 3.45Å
294	K	95.4	Very high	91.6	Very high	109 Å²	109	29.9 Å²	29.9	47%	0.474	14%	0.144	S	C	.	.			trans	-82	162	165.8	-68.6	-173	176.4	-174.6	0	110.6	T284 E296 Q297 L298 F311	T284-K294 HydrophobicContact CG2-CG 3.91Å; K294-E296 VanDerWaalsContact C-N 3.28Å; K294-E296 PolarHBondContact O-N 3.43Å; K294-Q297 HydrophobicContact CB-CG 4.45Å; K294-Q297 PolarHBondContact O-N 3.18Å; K294-Q297 VanDerWaalsContact O-N 3.08Å; K294-L298 PolarHBondContact O-N 3.38Å; K294-L298 VanDerWaalsContact O-N 3.15Å; K294-F311 VanDerWaalsContact C-CZ 3.4Å
295	R	95.3	Very high	91.4	Very high	58 Å²	58	34.8 Å²	34.8	22%	0.219	17%	0.174	C	C	.	.	H	α-helix	trans	-48.8	-49.5	179.2	-177.5	-179.1	-70.3	-102.3	4.8	112.8	Q297 L298 K299 S307 D308 F311 D312	R295-Q297 VanDerWaalsContact C-N 3.34Å; R295-Q297 PolarHBondContact O-N 3.42Å; R295-L298 PolarHBondContact O-N 3.45Å; R295-K299 WeakPolarHBondContact O-CB 3.4Å; R295-K299 PolarHBondContact O-N 3.33Å; R295-S307 PolarHBondContact O-OG 2.98Å; R295-D308 VanDerWaalsContact CD-OD1 3.27Å; R295-D308 WeakPolarHBondContact CD-OD1 3.47Å; R295-D308 IonicContact CZ-OD1 3.67Å; R295-D308 IonicContact NE-OD1 3.37Å; R295-D308 VanDerWaalsContact NH1-CA 3.33Å; R295-D308 PolarHBondContact NH1-O 2.91Å; R295-D308 IonicContact NH1-OD1 2.71Å; R295-D308 PolarHBondContact NH1-OD1 3.48Å; R295-F311 VanDerWaalsContact CA-CZ 3.42Å; R295-F311 HydrophobicContact CB-CD1 4.23Å; R295-F311 HydrophobicContact CB-CD2 4.13Å; R295-F311 HydrophobicContact CB-CE1 4.16Å; R295-F311 HydrophobicContact CB-CE2 4.08Å; R295-F311 HydrophobicContact CB-CG 4.22Å; R295-F311 HydrophobicContact CB-CZ 4.11Å; R295-F311 HydrophobicContact CG-CD2 4.22Å; R295-F311 HydrophobicContact CG-CG 4.37Å; R295-F311 VanDerWaalsContact CZ-CB 3.47Å; R295-F311 VanDerWaalsContact NH2-CB 3.25Å; R295-D312 IonicContact CZ-OD1 2.73Å; R295-D312 IonicContact NH1-OD1 3.01Å; R295-D312 PolarHBondContact NH1-OD1 3Å; R295-D312 IonicContact NH2-OD1 3.4Å; R295-D312 PolarHBondContact NH2-OD1 3.44Å
296	E	93.2	Very high	91.5	Very high	105 Å²	105	34.9 Å²	34.9	49%	0.491	17%	0.174	S	C	.	.	H	α-helix	trans	-66.7	-35.4	-177.2	-164.9	58.4	-159.8	0	0	112.9	K294 K299 N300	K294-E296 VanDerWaalsContact C-N 3.28Å; K294-E296 PolarHBondContact O-N 3.43Å; E296-K299 PolarHBondContact O-N 3.34Å; E296-N300 WeakPolarHBondContact CG-ND2 3.49Å; E296-N300 VanDerWaalsContact O-CB 3.31Å; E296-N300 WeakPolarHBondContact O-CB 3.42Å; E296-N300 PolarHBondContact O-N 3.08Å; E296-N300 PolarHBondContact O-ND2 3.38Å; E296-N300 PolarHBondContact OE1-ND2 2.9Å; E296-N300 PolarHBondContact OE1-OD1 3.38Å
297	Q	93.5	Very high	91.6	Very high	25 Å²	25	34.9 Å²	34.9	12%	0.117	17%	0.174	C	C	.	.	H	α-helix	trans	-67.8	-41.6	178.8	-65	174.9	-64.2	0	0	111.4	L198 V293 K294 R295 G301	L198-Q297 HydrophobicContact CD2-CB 4.26Å; L198-Q297 PolarHBondContact O-NE2 2.94Å; V293-Q297 HydrophobicContact CB-CB 4.47Å; K294-Q297 HydrophobicContact CB-CG 4.45Å; K294-Q297 PolarHBondContact O-N 3.18Å; K294-Q297 VanDerWaalsContact O-N 3.08Å; R295-Q297 VanDerWaalsContact C-N 3.34Å; R295-Q297 PolarHBondContact O-N 3.42Å; Q297-G301 PolarHBondContact O-N 3.3Å
298	L	94.4	Very high	91.8	Very high	4 Å²	4	35.7 Å²	35.7	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-70.3	-38.2	177.7	-174	59.8	0	0	0	111.9	F226 L285 L287 V293 K294 R295 L303 S307 F311	F226-L298 HydrophobicContact CD2-CD1 4.42Å; F226-L298 HydrophobicContact CE2-CD1 3.96Å; F226-L298 HydrophobicContact CZ-CD1 4.21Å; L285-L298 HydrophobicContact CD1-CD2 3.97Å; L287-L298 HydrophobicContact CD1-CD1 3.96Å; V293-L298 HydrophobicContact CG2-CB 4.13Å; V293-L298 HydrophobicContact CG2-CD2 4.48Å; K294-L298 PolarHBondContact O-N 3.38Å; K294-L298 VanDerWaalsContact O-N 3.15Å; R295-L298 PolarHBondContact O-N 3.45Å; L298-L303 HydrophobicContact CD1-CD1 3.59Å; L298-L303 HydrophobicContact CD1-CG 4.22Å; L298-L303 HydrophobicContact CD2-CD1 4.12Å; L298-L303 HydrophobicContact CG-CD1 3.81Å; L298-L303 PolarHBondContact O-N 3.11Å; L298-S307 WeakPolarHBondContact CB-OG 3.5Å; L298-F311 HydrophobicContact CB-CE2 4.11Å; L298-F311 HydrophobicContact CD2-CD2 4.32Å; L298-F311 HydrophobicContact CD2-CE2 3.79Å
299	K	94.3	Very high	92.5	Very high	68 Å²	68	36.8 Å²	36.8	30%	0.296	19%	0.189	S	C	.	.	I	π-helix	trans	-60.4	-52.4	174.4	-179.1	169.4	-175	165	0	111.5	R295 E296 G302 G304 S307 D308	R295-K299 WeakPolarHBondContact O-CB 3.4Å; R295-K299 PolarHBondContact O-N 3.33Å; E296-K299 PolarHBondContact O-N 3.34Å; K299-G302 PolarHBondContact O-N 3.27Å; K299-G304 PolarHBondContact O-N 3.11Å; K299-S307 PolarHBondContact N-OG 2.94Å; K299-D308 IonicContact NZ-OD2 3.05Å
300	N	92.4	Very high	93.4	Very high	50 Å²	50	37 Å²	37	27%	0.267	19%	0.19	S	C	.	.	I	π-helix	trans	-76.4	-27.2	-174.6	-63.1	-11.8	0	0	0	112.4	V218 D219 E296 G302	V218-N300 CarbonylContact C-O 3.58Å; V218-N300 WeakPolarHBondContact CA-O 3.38Å; V218-N300 WeakPolarHBondContact CG1-O 3.26Å; D219-N300 HydrophobicContact CB-CB 4.3Å; D219-N300 PolarHBondContact N-O 3.23Å; E296-N300 WeakPolarHBondContact CG-ND2 3.49Å; E296-N300 VanDerWaalsContact O-CB 3.31Å; E296-N300 WeakPolarHBondContact O-CB 3.42Å; E296-N300 PolarHBondContact O-N 3.08Å; E296-N300 PolarHBondContact O-ND2 3.38Å; E296-N300 PolarHBondContact OE1-ND2 2.9Å; E296-N300 PolarHBondContact OE1-OD1 3.38Å; N300-G302 PolarHBondContact O-N 3.02Å
301	G	91.9	Very high	94.2	Very high	3 Å²	3	32.3 Å²	32.3	3%	0.031	17%	0.168	C	C	.	.	I	π-helix	trans	-77.5	27.3	172.9	0	0	0	0	0	114.4	F223 F226 Q297	F223-G301 WeakPolarHBondContact CD2-O 3.5Å; F226-G301 WeakPolarHBondContact CD2-O 3.25Å; Q297-G301 PolarHBondContact O-N 3.3Å
302	G	91.1	Very high	94.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.184	C	C	.	.	I	π-helix	trans	116	-29.3	166.5	0	0	0	0	0	115.6	K299 N300 G304 R395 M399	K299-G302 PolarHBondContact O-N 3.27Å; N300-G302 PolarHBondContact O-N 3.02Å; G302-G304 VanDerWaalsContact C-N 3.34Å; G302-G304 PolarHBondContact O-N 3.26Å; G302-R395 PolarHBondContact O-NE 3.3Å; G302-R395 PolarHBondContact O-NH2 3.41Å; G302-M399 WeakPolarHBondContact O-CG 3.48Å
303	L	92.9	Very high	94.8	Very high	30 Å²	30	35.5 Å²	35.5	16%	0.157	19%	0.185	C	C	.	.	I	π-helix	trans	-75.8	-16.8	-174.1	-70.7	-170.5	0	0	0	114.6	M267 L298 V305 V306 I310	M267-L303 HydrophobicContact CE-CD1 4.38Å; M267-L303 HydrophobicContact CE-CD2 4.17Å; L298-L303 HydrophobicContact CD1-CD1 3.59Å; L298-L303 HydrophobicContact CD1-CG 4.22Å; L298-L303 HydrophobicContact CD2-CD1 4.12Å; L298-L303 HydrophobicContact CG-CD1 3.81Å; L298-L303 PolarHBondContact O-N 3.11Å; L303-V305 PolarHBondContact O-N 3.02Å; L303-V306 HydrophobicContact CB-CB 4.36Å; L303-V306 VanDerWaalsContact O-CB 3.24Å; L303-V306 WeakPolarHBondContact O-CB 3.46Å; L303-V306 WeakPolarHBondContact O-CG2 3.38Å; L303-V306 PolarHBondContact O-N 3.43Å; L303-V306 VanDerWaalsContact O-N 3.08Å; L303-I310 HydrophobicContact CD1-CD1 3.98Å
304	G	92.9	Very high	94.9	Very high	12 Å²	12	35.5 Å²	35.5	12%	0.124	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	-133.7	177.5	0	0	0	0	0	112.5	K299 G302 V306 S307	K299-G304 PolarHBondContact O-N 3.11Å; G302-G304 VanDerWaalsContact C-N 3.34Å; G302-G304 PolarHBondContact O-N 3.26Å; G304-V306 PolarHBondContact O-N 3.33Å; G304-V306 VanDerWaalsContact O-N 3.14Å; G304-S307 VanDerWaalsContact O-CB 3.24Å; G304-S307 WeakPolarHBondContact O-CB 3.46Å; G304-S307 PolarHBondContact O-N 2.72Å
305	V	91	Very high	95	Very high	103 Å²	103	34 Å²	34	62%	0.624	18%	0.178	S	C	*	.	H	α-helix	trans	-60.6	-21.7	179.9	-61.8	0	0	0	0	114.2	L303 S307 D308	L303-V305 PolarHBondContact O-N 3.02Å; V305-S307 PolarHBondContact O-N 2.91Å; V305-D308 WeakPolarHBondContact O-CB 3.36Å; V305-D308 PolarHBondContact O-N 3.18Å; V305-D308 VanDerWaalsContact O-N 3.11Å
306	V	95.9	Very high	95	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-63.6	-33.2	176.3	-173.6	0	0	0	0	110.4	M267 L303 G304 D308 A309 I310 I388 C391 H392 R395	M267-V306 HydrophobicContact CE-CG1 3.87Å; L303-V306 HydrophobicContact CB-CB 4.36Å; L303-V306 VanDerWaalsContact O-CB 3.24Å; L303-V306 WeakPolarHBondContact O-CB 3.46Å; L303-V306 WeakPolarHBondContact O-CG2 3.38Å; L303-V306 PolarHBondContact O-N 3.43Å; L303-V306 VanDerWaalsContact O-N 3.08Å; G304-V306 PolarHBondContact O-N 3.33Å; G304-V306 VanDerWaalsContact O-N 3.14Å; V306-D308 VanDerWaalsContact C-N 3.25Å; V306-D308 PolarHBondContact O-N 3.23Å; V306-A309 PolarHBondContact O-N 3.34Å; V306-I310 HydrophobicContact CG1-CD1 4.1Å; V306-I310 HydrophobicContact CG1-CG1 4.42Å; V306-I310 WeakPolarHBondContact O-CG1 3.33Å; V306-I310 PolarHBondContact O-N 3.45Å; V306-I310 VanDerWaalsContact O-N 3.11Å; V306-I388 HydrophobicContact CG1-CG2 3.93Å; V306-C391 HydrophobicContact CG2-CB 4.06Å; V306-H392 HydrophobicContact CG1-CB 4.33Å; V306-H392 HydrophobicContact CG2-CB 4.42Å; V306-R395 HydrophobicContact CG2-CB 3.9Å; V306-R395 HydrophobicContact CG2-CG 4.32Å
307	S	96.6	Very high	95.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-56.6	-42	174.2	-179.9	0	0	0	0	111.5	R295 L298 K299 G304 V305 A309 I310 F311	R295-S307 PolarHBondContact O-OG 2.98Å; L298-S307 WeakPolarHBondContact CB-OG 3.5Å; K299-S307 PolarHBondContact N-OG 2.94Å; G304-S307 VanDerWaalsContact O-CB 3.24Å; G304-S307 WeakPolarHBondContact O-CB 3.46Å; G304-S307 PolarHBondContact O-N 2.72Å; V305-S307 PolarHBondContact O-N 2.91Å; S307-A309 VanDerWaalsContact C-N 3.34Å; S307-A309 PolarHBondContact O-N 2.97Å; S307-I310 PolarHBondContact O-N 3.34Å; S307-F311 WeakPolarHBondContact O-CD2 3.24Å; S307-F311 PolarHBondContact O-N 2.94Å
308	D	95.6	Very high	95.3	Very high	42 Å²	42	29.2 Å²	29.2	23%	0.225	17%	0.171	C	C	.	.	H	α-helix	trans	-62.4	-44.6	-177.5	-72.5	-43.1	0	0	0	111.4	R295 K299 V305 V306 I310 F311 D312	R295-D308 VanDerWaalsContact CD-OD1 3.27Å; R295-D308 WeakPolarHBondContact CD-OD1 3.47Å; R295-D308 IonicContact CZ-OD1 3.67Å; R295-D308 IonicContact NE-OD1 3.37Å; R295-D308 VanDerWaalsContact NH1-CA 3.33Å; R295-D308 PolarHBondContact NH1-O 2.91Å; R295-D308 IonicContact NH1-OD1 2.71Å; R295-D308 PolarHBondContact NH1-OD1 3.48Å; K299-D308 IonicContact NZ-OD2 3.05Å; V305-D308 WeakPolarHBondContact O-CB 3.36Å; V305-D308 PolarHBondContact O-N 3.18Å; V305-D308 VanDerWaalsContact O-N 3.11Å; V306-D308 VanDerWaalsContact C-N 3.25Å; V306-D308 PolarHBondContact O-N 3.23Å; D308-I310 PolarHBondContact O-N 2.92Å; D308-F311 PolarHBondContact O-N 3.39Å; D308-D312 WeakPolarHBondContact O-CB 3.5Å; D308-D312 PolarHBondContact O-N 2.91Å
309	A	97.5	Very high	95.2	Very high	39 Å²	39	37 Å²	37	32%	0.322	21%	0.207	S	C	.	.	H	α-helix	trans	-62.5	-41.1	176.5	0	0	0	0	0	113	V306 S307 D312 L313 I388	V306-A309 PolarHBondContact O-N 3.34Å; S307-A309 VanDerWaalsContact C-N 3.34Å; S307-A309 PolarHBondContact O-N 2.97Å; A309-D312 PolarHBondContact O-N 3.02Å; A309-L313 WeakPolarHBondContact O-CB 3.31Å; A309-L313 PolarHBondContact O-N 2.91Å; A309-I388 HydrophobicContact CB-CD1 4.18Å; A309-I388 HydrophobicContact CB-CG1 3.65Å
310	I	98.1	Very high	95.2	Very high	5 Å²	5	35 Å²	35	3%	0.026	20%	0.198	C	C	.	.	H	α-helix	trans	-66.6	-42.3	178.6	-59.7	168.3	0	0	0	110.9	M267 A274 L285 L303 V306 S307 D308 L313 G314 I388	M267-I310 HydrophobicContact CE-CD1 4Å; A274-I310 HydrophobicContact CB-CG2 4.3Å; L285-I310 HydrophobicContact CD1-CB 4.32Å; L285-I310 HydrophobicContact CD1-CG2 3.55Å; L303-I310 HydrophobicContact CD1-CD1 3.98Å; V306-I310 HydrophobicContact CG1-CD1 4.1Å; V306-I310 HydrophobicContact CG1-CG1 4.42Å; V306-I310 WeakPolarHBondContact O-CG1 3.33Å; V306-I310 PolarHBondContact O-N 3.45Å; V306-I310 VanDerWaalsContact O-N 3.11Å; S307-I310 PolarHBondContact O-N 3.34Å; D308-I310 PolarHBondContact O-N 2.92Å; I310-L313 PolarHBondContact O-N 3.06Å; I310-G314 PolarHBondContact O-N 3.16Å; I310-I388 HydrophobicContact CG1-CD1 4.26Å; I310-I388 HydrophobicContact CG1-CG2 4.06Å
311	F	98.1	Very high	95.2	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.009	22%	0.216	C	C	.	.	H	α-helix	trans	-67	-38.6	177.4	-89.2	-95.2	0	0	0	112.2	Y278 L285 V293 K294 R295 L298 S307 D308 L313 G314 K315	Y278-F311 HydrophobicContact CD2-CD1 4.31Å; Y278-F311 HydrophobicContact CE2-CD1 4.06Å; Y278-F311 HydrophobicContact CE2-CE1 4.41Å; L285-F311 HydrophobicContact CB-CE1 4.39Å; L285-F311 HydrophobicContact CB-CE2 4.4Å; L285-F311 HydrophobicContact CB-CZ 4.01Å; L285-F311 HydrophobicContact CD1-CD1 4.25Å; L285-F311 HydrophobicContact CD1-CD2 3.45Å; L285-F311 VanDerWaalsContact CD1-CD2 3.45Å; L285-F311 HydrophobicContact CD1-CE1 4.19Å; L285-F311 HydrophobicContact CD1-CE2 3.36Å; L285-F311 HydrophobicContact CD1-CG 3.9Å; L285-F311 HydrophobicContact CD1-CZ 3.74Å; L285-F311 HydrophobicContact CG-CD1 4Å; L285-F311 HydrophobicContact CG-CD2 4.08Å; L285-F311 HydrophobicContact CG-CE1 3.74Å; L285-F311 HydrophobicContact CG-CE2 3.81Å; L285-F311 HydrophobicContact CG-CG 4.16Å; L285-F311 HydrophobicContact CG-CZ 3.62Å; V293-F311 WeakPolarHBondContact O-CZ 3.45Å; K294-F311 VanDerWaalsContact C-CZ 3.4Å; R295-F311 VanDerWaalsContact CA-CZ 3.42Å; R295-F311 HydrophobicContact CB-CD1 4.23Å; R295-F311 HydrophobicContact CB-CD2 4.13Å; R295-F311 HydrophobicContact CB-CE1 4.16Å; R295-F311 HydrophobicContact CB-CE2 4.08Å; R295-F311 HydrophobicContact CB-CG 4.22Å; R295-F311 HydrophobicContact CB-CZ 4.11Å; R295-F311 HydrophobicContact CG-CD2 4.22Å; R295-F311 HydrophobicContact CG-CG 4.37Å; R295-F311 VanDerWaalsContact CZ-CB 3.47Å; R295-F311 VanDerWaalsContact NH2-CB 3.25Å; L298-F311 HydrophobicContact CB-CE2 4.11Å; L298-F311 HydrophobicContact CD2-CD2 4.32Å; L298-F311 HydrophobicContact CD2-CE2 3.79Å; S307-F311 WeakPolarHBondContact O-CD2 3.24Å; S307-F311 PolarHBondContact O-N 2.94Å; D308-F311 PolarHBondContact O-N 3.39Å; F311-L313 VanDerWaalsContact C-N 3.35Å; F311-G314 PolarHBondContact O-N 3.13Å; F311-K315 WeakPolarHBondContact O-CG 3.37Å; F311-K315 PolarHBondContact O-N 3.43Å
312	D	97.7	Very high	95.3	Very high	84 Å²	84	39.6 Å²	39.6	45%	0.449	22%	0.222	S	C	.	.	H	α-helix	trans	-68.6	-37.7	178.2	-66.6	-10.2	0	0	0	111.1	R295 D308 A309 K315 S316	R295-D312 IonicContact CZ-OD1 2.73Å; R295-D312 IonicContact NH1-OD1 3.01Å; R295-D312 PolarHBondContact NH1-OD1 3Å; R295-D312 IonicContact NH2-OD1 3.4Å; R295-D312 PolarHBondContact NH2-OD1 3.44Å; D308-D312 WeakPolarHBondContact O-CB 3.5Å; D308-D312 PolarHBondContact O-N 2.91Å; A309-D312 PolarHBondContact O-N 3.02Å; D312-K315 PolarHBondContact O-N 3.38Å; D312-S316 WeakPolarHBondContact O-CB 3.37Å; D312-S316 PolarHBondContact O-N 3.03Å
313	L	97.9	Very high	95.5	Very high	5 Å²	5	41.1 Å²	41.1	3%	0.026	23%	0.231	C	C	.	.	H	α-helix	trans	-60.2	-46	168.7	-179.6	65.4	0	0	0	111.4	A275 A309 I310 F311 S316 L317 K381 D384 L385 I388	A275-L313 HydrophobicContact CB-CB 4.37Å; A275-L313 HydrophobicContact CB-CD2 3.93Å; A275-L313 HydrophobicContact CB-CG 3.94Å; A309-L313 WeakPolarHBondContact O-CB 3.31Å; A309-L313 PolarHBondContact O-N 2.91Å; I310-L313 PolarHBondContact O-N 3.06Å; F311-L313 VanDerWaalsContact C-N 3.35Å; L313-S316 WeakPolarHBondContact O-CB 3.48Å; L313-S316 PolarHBondContact O-N 2.93Å; L313-L317 HydrophobicContact CD1-CD1 3.89Å; L313-L317 HydrophobicContact CD1-CD2 4.47Å; L313-L317 HydrophobicContact CD1-CG 3.89Å; L313-L317 HydrophobicContact CD2-CD1 4.29Å; L313-L317 HydrophobicContact CG-CD1 3.79Å; L313-L317 HydrophobicContact CG-CG 4.16Å; L313-L317 WeakPolarHBondContact O-CB 3.21Å; L313-L317 WeakPolarHBondContact O-CG 3.39Å; L313-L317 PolarHBondContact O-N 3.19Å; L313-K381 HydrophobicContact CD1-CB 4.43Å; L313-K381 HydrophobicContact CD1-CD 3.73Å; L313-D384 HydrophobicContact CD1-CB 4.18Å; L313-L385 HydrophobicContact CD2-CD2 3.35Å; L313-L385 HydrophobicContact CD2-CG 3.8Å; L313-I388 HydrophobicContact CB-CD1 4.33Å; L313-I388 HydrophobicContact CD2-CD1 3.89Å
314	G	97.4	Very high	95.7	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.1	-46.3	177.8	0	0	0	0	0	113.1	A275 I310 F311 S316 L317 A318	A275-G314 WeakPolarHBondContact O-CA 3.44Å; I310-G314 PolarHBondContact O-N 3.16Å; F311-G314 PolarHBondContact O-N 3.13Å; G314-S316 VanDerWaalsContact C-N 3.29Å; G314-S316 PolarHBondContact O-N 2.82Å; G314-L317 PolarHBondContact O-N 3.19Å; G314-A318 WeakPolarHBondContact O-CB 3.4Å; G314-A318 PolarHBondContact O-N 3.21Å
315	K	96.9	Very high	95.9	Very high	77 Å²	77	42.7 Å²	42.7	34%	0.335	24%	0.237	S	C	.	.	H	α-helix	trans	-58	-42.1	172.9	-75.7	177.4	175.8	-173.1	0	111.9	Y278 F311 D312	Y278-K315 HydrophobicContact CD1-CG 4.32Å; Y278-K315 HydrophobicContact CE1-CB 4.28Å; Y278-K315 HydrophobicContact CE1-CG 3.54Å; Y278-K315 HydrophobicContact CE2-CG 4.21Å; Y278-K315 VanDerWaalsContact CZ-CG 3.48Å; Y278-K315 VanDerWaalsContact OH-CE 3.25Å; Y278-K315 WeakPolarHBondContact OH-CE 3.35Å; Y278-K315 WeakPolarHBondContact OH-CG 3.43Å; F311-K315 WeakPolarHBondContact O-CG 3.37Å; F311-K315 PolarHBondContact O-N 3.43Å; D312-K315 PolarHBondContact O-N 3.38Å
316	S	96.8	Very high	96.2	Very high	29 Å²	29	37.8 Å²	37.8	20%	0.203	21%	0.207	C	C	.	.	H	α-helix	trans	-67.3	-49.7	178.4	-174.8	0	0	0	0	111.7	D312 L313 G314 A318 Q319 F320 K381	D312-S316 WeakPolarHBondContact O-CB 3.37Å; D312-S316 PolarHBondContact O-N 3.03Å; L313-S316 WeakPolarHBondContact O-CB 3.48Å; L313-S316 PolarHBondContact O-N 2.93Å; G314-S316 VanDerWaalsContact C-N 3.29Å; G314-S316 PolarHBondContact O-N 2.82Å; S316-A318 VanDerWaalsContact C-N 3.32Å; S316-A318 PolarHBondContact O-N 2.84Å; S316-Q319 WeakPolarHBondContact O-CB 3.49Å; S316-Q319 PolarHBondContact O-N 3.4Å; S316-F320 WeakPolarHBondContact O-CD2 3.33Å; S316-K381 WeakPolarHBondContact OG-CE 3.4Å; S316-K381 PolarHBondContact OG-NZ 3.4Å
317	L	96.8	Very high	96.3	Very high	7 Å²	7	38 Å²	38	4%	0.037	21%	0.208	C	C	.	.	H	α-helix	trans	-66.8	-29.5	-177.3	-72.3	179.2	0	0	0	113.3	L272 A275 I276 L313 G314 Q319 F320 L322 K381	L272-L317 HydrophobicContact CD1-CD1 3.73Å; A275-L317 HydrophobicContact CB-CD1 4.05Å; I276-L317 HydrophobicContact CG2-CD1 4.23Å; L313-L317 HydrophobicContact CD1-CD1 3.89Å; L313-L317 HydrophobicContact CD1-CD2 4.47Å; L313-L317 HydrophobicContact CD1-CG 3.89Å; L313-L317 HydrophobicContact CD2-CD1 4.29Å; L313-L317 HydrophobicContact CG-CD1 3.79Å; L313-L317 HydrophobicContact CG-CG 4.16Å; L313-L317 WeakPolarHBondContact O-CB 3.21Å; L313-L317 WeakPolarHBondContact O-CG 3.39Å; L313-L317 PolarHBondContact O-N 3.19Å; G314-L317 PolarHBondContact O-N 3.19Å; L317-Q319 PolarHBondContact O-N 2.74Å; L317-Q319 VanDerWaalsContact O-N 3.1Å; L317-F320 WeakPolarHBondContact O-CB 3.44Å; L317-F320 PolarHBondContact O-N 3.35Å; L317-L322 HydrophobicContact CD2-CD1 3.97Å; L317-K381 HydrophobicContact CD2-CB 4.31Å; L317-K381 HydrophobicContact CD2-CD 3.91Å; L317-K381 HydrophobicContact CD2-CG 3.8Å; L317-K381 HydrophobicContact CG-CD 4.49Å
318	A	94.4	Very high	96.4	Very high	52 Å²	52	38 Å²	38	43%	0.43	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-27.3	173.9	0	0	0	0	0	112.8	Y278 P280 G314 S316	Y278-A318 HydrophobicContact CD1-CB 4.27Å; P280-A318 HydrophobicContact CG-CB 4.32Å; G314-A318 WeakPolarHBondContact O-CB 3.4Å; G314-A318 PolarHBondContact O-N 3.21Å; S316-A318 VanDerWaalsContact C-N 3.32Å; S316-A318 PolarHBondContact O-N 2.84Å
319	Q	92.9	Very high	96.5	Very high	167 Å²	167	36 Å²	36	78%	0.78	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-18.2	178.2	-56.6	176.2	13.7	0	0	113.4	S316 L317	S316-Q319 WeakPolarHBondContact O-CB 3.49Å; S316-Q319 PolarHBondContact O-N 3.4Å; L317-Q319 PolarHBondContact O-N 2.74Å; L317-Q319 VanDerWaalsContact O-N 3.1Å
320	F	94.1	Very high	96.6	Very high	26 Å²	26	34.2 Å²	34.2	11%	0.114	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-21.6	-179.3	-77.5	-105.5	0	0	0	112.6	S316 L317 L322 K368 F374 K377 L378	S316-F320 WeakPolarHBondContact O-CD2 3.33Å; L317-F320 WeakPolarHBondContact O-CB 3.44Å; L317-F320 PolarHBondContact O-N 3.35Å; F320-L322 HydrophobicContact CB-CD2 3.74Å; F320-L322 HydrophobicContact CB-CG 3.88Å; F320-K368 PolarHBondContact O-NZ 3.11Å; F320-K368 VanDerWaalsContact O-NZ 3.13Å; F320-F374 HydrophobicContact CB-CE2 4.4Å; F320-F374 HydrophobicContact CB-CZ 4.24Å; F320-F374 HydrophobicContact CD1-CD2 4.45Å; F320-F374 HydrophobicContact CD1-CE1 4.36Å; F320-F374 AromaticContact CD1-CE2 3.81Å; F320-F374 HydrophobicContact CD1-CE2 3.81Å; F320-F374 AromaticContact CD1-CZ 3.77Å; F320-F374 HydrophobicContact CD1-CZ 3.77Å; F320-F374 HydrophobicContact CG-CE2 4.48Å; F320-F374 HydrophobicContact CG-CZ 4.49Å; F320-K377 HydrophobicContact CE1-CB 4.03Å; F320-K377 HydrophobicContact CZ-CB 4.05Å; F320-L378 HydrophobicContact CD1-CB 4.25Å; F320-L378 HydrophobicContact CD1-CD1 4.06Å; F320-L378 HydrophobicContact CE1-CB 3.95Å; F320-L378 HydrophobicContact CE1-CD1 4.29Å
321	N	92.4	Very high	96.6	Very high	118 Å²	118	34 Å²	34	63%	0.631	18%	0.181	S	C	*	.			trans	49.5	61	-174.7	-172.6	29.3	0	0	0	110.9	K368	N321-K368 PolarHBondContact O-NZ 2.97Å
322	L	95.4	Very high	96.6	Very high	33 Å²	33	33.9 Å²	33.9	17%	0.173	18%	0.181	C	C	.	.			trans	-73.2	144.6	-177.8	-60.7	-177.2	0	0	0	111.1	L317 F320 E326 V327 F374 L378	L317-L322 HydrophobicContact CD2-CD1 3.97Å; F320-L322 HydrophobicContact CB-CD2 3.74Å; F320-L322 HydrophobicContact CB-CG 3.88Å; L322-E326 WeakPolarHBondContact CA-OE2 3.42Å; L322-E326 HydrophobicContact CB-CB 4.34Å; L322-E326 HydrophobicContact CD2-CB 4.1Å; L322-E326 WeakPolarHBondContact CD2-OE2 3.44Å; L322-V327 HydrophobicContact CB-CG2 3.95Å; L322-V327 HydrophobicContact CD1-CG2 4.2Å; L322-F374 HydrophobicContact CD2-CZ 4.18Å; L322-L378 HydrophobicContact CD1-CD1 4.07Å; L322-L378 HydrophobicContact CD2-CD1 3.97Å; L322-L378 HydrophobicContact CD2-CD2 4.04Å
323	D	95.3	Very high	96.6	Very high	32 Å²	32	30 Å²	30	17%	0.171	16%	0.161	C	C	.	.			trans	-95.7	172.9	165.5	63.8	18	0	0	0	112.8	T325 E326 V327 Y363 R367	D323-T325 PolarHBondContact O-N 3.36Å; D323-T325 WeakPolarHBondContact OD1-CB 3.26Å; D323-T325 PolarHBondContact OD1-N 3.36Å; D323-E326 PolarHBondContact N-OE2 3.09Å; D323-E326 PolarHBondContact O-N 2.8Å; D323-E326 WeakPolarHBondContact OD1-CB 3.27Å; D323-E326 VanDerWaalsContact OD1-CG 3.23Å; D323-E326 WeakPolarHBondContact OD1-CG 3.5Å; D323-E326 PolarHBondContact OD1-N 3.03Å; D323-V327 WeakPolarHBondContact O-CG2 3.2Å; D323-V327 PolarHBondContact O-N 3.03Å; D323-Y363 PolarHBondContact OD2-OH 2.93Å; D323-R367 IonicContact OD1-NH1 3.49Å; D323-R367 WeakPolarHBondContact OD2-CD 3.29Å; D323-R367 IonicContact OD2-CZ 3.35Å; D323-R367 IonicContact OD2-NE 2.81Å; D323-R367 PolarHBondContact OD2-NE 3.15Å; D323-R367 IonicContact OD2-NH1 2.76Å; D323-R367 PolarHBondContact OD2-NH1 3.27Å; D323-R367 VanDerWaalsContact OD2-NH1 3.12Å; D323-R367 IonicContact OD2-NH2 3.51Å; D323-R367 PolarHBondContact OD2-NH2 2.98Å
324	D	95.6	Very high	96.6	Very high	61 Å²	61	29.8 Å²	29.8	33%	0.326	16%	0.159	S	C	.	.	H	α-helix	trans	-53.6	-36.2	177.8	-66.4	-16.2	0	0	0	112.2	T178 H181 R182 A328	T178-D324 HydrophobicContact CG2-CB 4.35Å; H181-D324 PolarHBondContact CD2-O 3.13Å; R182-D324 IonicContact CZ-OD2 3.39Å; R182-D324 IonicContact NE-OD2 2.77Å; R182-D324 PolarHBondContact NE-OD2 2.87Å; R182-D324 IonicContact NH2-OD2 2.87Å; R182-D324 PolarHBondContact NH2-OD2 3.36Å; R182-D324 VanDerWaalsContact NH2-OD2 3.08Å; D324-A328 WeakPolarHBondContact O-CB 3.45Å; D324-A328 PolarHBondContact O-N 2.94Å
325	T	97.8	Very high	96.6	Very high	14 Å²	14	29.9 Å²	29.9	9%	0.086	16%	0.16	C	C	.	.	H	α-helix	trans	-69.1	-46.8	-178	-67.3	0	0	0	0	111.2	I174 T178 D323 V327 A328 L329 Y363	I174-T325 HydrophobicContact CG2-CG2 3.38Å; T178-T325 VanDerWaalsContact CG2-OG1 3.31Å; T178-T325 WeakPolarHBondContact CG2-OG1 3.39Å; T178-T325 WeakPolarHBondContact OG1-CB 3.39Å; T178-T325 WeakPolarHBondContact OG1-CG2 3.08Å; T178-T325 PolarHBondContact OG1-OG1 3.06Å; D323-T325 PolarHBondContact O-N 3.36Å; D323-T325 WeakPolarHBondContact OD1-CB 3.26Å; D323-T325 PolarHBondContact OD1-N 3.36Å; T325-V327 VanDerWaalsContact C-N 3.31Å; T325-V327 PolarHBondContact O-N 2.83Å; T325-A328 PolarHBondContact O-N 3.05Å; T325-L329 HydrophobicContact CG2-CD1 3.84Å; T325-L329 HydrophobicContact CG2-CG 4.5Å; T325-L329 WeakPolarHBondContact O-CG 3.13Å; T325-L329 PolarHBondContact O-N 3.37Å; T325-Y363 HydrophobicContact CG2-CD1 3.85Å; T325-Y363 HydrophobicContact CG2-CD2 4.16Å; T325-Y363 HydrophobicContact CG2-CE1 3.55Å; T325-Y363 HydrophobicContact CG2-CE2 3.86Å; T325-Y363 HydrophobicContact CG2-CG 4.14Å
326	E	97.9	Very high	96.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.6	-40.1	176.5	-67	162.3	164.7	0	0	111.2	L322 D323 L330 F360 Y363 I364 R367 K368	L322-E326 WeakPolarHBondContact CA-OE2 3.42Å; L322-E326 HydrophobicContact CB-CB 4.34Å; L322-E326 HydrophobicContact CD2-CB 4.1Å; L322-E326 WeakPolarHBondContact CD2-OE2 3.44Å; D323-E326 PolarHBondContact N-OE2 3.09Å; D323-E326 PolarHBondContact O-N 2.8Å; D323-E326 WeakPolarHBondContact OD1-CB 3.27Å; D323-E326 VanDerWaalsContact OD1-CG 3.23Å; D323-E326 WeakPolarHBondContact OD1-CG 3.5Å; D323-E326 PolarHBondContact OD1-N 3.03Å; E326-L330 VanDerWaalsContact O-CB 3.32Å; E326-L330 WeakPolarHBondContact O-CB 3.4Å; E326-L330 PolarHBondContact O-N 3.24Å; E326-F360 HydrophobicContact CB-CE2 3.96Å; E326-F360 HydrophobicContact CB-CZ 4.4Å; E326-F360 HydrophobicContact CG-CE2 4.09Å; E326-F360 WeakPolarHBondContact O-CZ 3.46Å; E326-Y363 HydrophobicContact CG-CD1 3.99Å; E326-Y363 HydrophobicContact CG-CE1 3.86Å; E326-I364 HydrophobicContact CG-CD1 3.6Å; E326-I364 VanDerWaalsContact OE1-CD1 3.27Å; E326-I364 WeakPolarHBondContact OE1-CD1 3.41Å; E326-R367 IonicContact OE1-CZ 3.05Å; E326-R367 IonicContact OE1-NH1 2.8Å; E326-R367 PolarHBondContact OE1-NH1 3.02Å; E326-R367 IonicContact OE2-NH1 3.35Å; E326-R367 PolarHBondContact OE2-NH1 2.93Å; E326-K368 VanDerWaalsContact OE1-CE 3.23Å; E326-K368 WeakPolarHBondContact OE1-CE 3.14Å
327	V	97.5	Very high	96.5	Very high	5 Å²	5	24.8 Å²	24.8	3%	0.03	13%	0.134	C	C	.	.	H	α-helix	trans	-67.6	-38.5	175.2	178.5	0	0	0	0	111.2	L272 I276 L322 D323 T325 Q331	L272-V327 HydrophobicContact CD2-CG1 4.44Å; L272-V327 HydrophobicContact CG-CG1 4.43Å; I276-V327 HydrophobicContact CG2-CG1 4.27Å; I276-V327 HydrophobicContact CG2-CG2 3.8Å; L322-V327 HydrophobicContact CB-CG2 3.95Å; L322-V327 HydrophobicContact CD1-CG2 4.2Å; D323-V327 WeakPolarHBondContact O-CG2 3.2Å; D323-V327 PolarHBondContact O-N 3.03Å; T325-V327 VanDerWaalsContact C-N 3.31Å; T325-V327 PolarHBondContact O-N 2.83Å; V327-Q331 VanDerWaalsContact O-CG 3.29Å; V327-Q331 WeakPolarHBondContact O-CG 3.5Å; V327-Q331 PolarHBondContact O-N 3.46Å; V327-Q331 VanDerWaalsContact O-N 3.07Å; V327-Q331 PolarHBondContact O-NE2 3.2Å
328	A	98.2	Very high	96.5	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-65.6	-45.8	177.7	0	0	0	0	0	112.2	V177 H181 D324 T325 Q331 A332	V177-A328 HydrophobicContact CG1-CB 3.81Å; V177-A328 WeakPolarHBondContact CG1-O 3.26Å; H181-A328 HydrophobicContact CB-CB 3.42Å; H181-A328 VanDerWaalsContact CB-CB 3.42Å; D324-A328 WeakPolarHBondContact O-CB 3.45Å; D324-A328 PolarHBondContact O-N 2.94Å; T325-A328 PolarHBondContact O-N 3.05Å; A328-Q331 WeakPolarHBondContact O-CB 3.49Å; A328-Q331 PolarHBondContact O-N 3.32Å; A328-A332 PolarHBondContact O-N 3.14Å
329	L	98.4	Very high	96.4	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.8	-39.5	177.5	-69.4	165.6	0	0	0	111.6	I174 V177 T325 Q331 A332 V333 F360	I174-L329 HydrophobicContact CG1-CD1 4.17Å; I174-L329 HydrophobicContact CG1-CD2 4.3Å; V177-L329 HydrophobicContact CB-CD2 4.47Å; V177-L329 HydrophobicContact CG1-CD2 4.29Å; T325-L329 HydrophobicContact CG2-CD1 3.84Å; T325-L329 HydrophobicContact CG2-CG 4.5Å; T325-L329 WeakPolarHBondContact O-CG 3.13Å; T325-L329 PolarHBondContact O-N 3.37Å; L329-Q331 VanDerWaalsContact C-N 3.33Å; L329-Q331 PolarHBondContact O-N 3.42Å; L329-A332 PolarHBondContact O-N 3.08Å; L329-V333 WeakPolarHBondContact O-CG2 3.34Å; L329-V333 PolarHBondContact O-N 3.37Å; L329-F360 HydrophobicContact CB-CB 3.97Å; L329-F360 HydrophobicContact CB-CD1 3.95Å; L329-F360 HydrophobicContact CB-CD2 3.84Å; L329-F360 HydrophobicContact CB-CE1 4.37Å; L329-F360 HydrophobicContact CB-CE2 4.27Å; L329-F360 HydrophobicContact CB-CG 3.67Å; L329-F360 HydrophobicContact CD1-CB 4.06Å; L329-F360 HydrophobicContact CD1-CD2 3.81Å; L329-F360 HydrophobicContact CD1-CG 4.14Å; L329-F360 HydrophobicContact CG-CB 4.45Å; L329-F360 HydrophobicContact CG-CD2 4.48Å; L329-F360 HydrophobicContact CG-CG 4.49Å
330	L	98.3	Very high	96.5	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-61.1	-40.6	174	-170.4	64.1	0	0	0	112	L272 E326 V333 L334 F360 V382 L385	L272-L330 HydrophobicContact CD1-CD2 3.74Å; L272-L330 HydrophobicContact CD2-CB 4.11Å; L272-L330 HydrophobicContact CD2-CD2 3.69Å; L272-L330 HydrophobicContact CD2-CG 3.85Å; L272-L330 HydrophobicContact CG-CD2 4.39Å; E326-L330 VanDerWaalsContact O-CB 3.32Å; E326-L330 WeakPolarHBondContact O-CB 3.4Å; E326-L330 PolarHBondContact O-N 3.24Å; L330-V333 PolarHBondContact O-N 3.29Å; L330-L334 HydrophobicContact CG-CD1 4.39Å; L330-L334 WeakPolarHBondContact O-CD1 3.27Å; L330-L334 VanDerWaalsContact O-CG 3.26Å; L330-L334 WeakPolarHBondContact O-CG 3.42Å; L330-L334 PolarHBondContact O-N 2.9Å; L330-F360 HydrophobicContact CB-CE1 4Å; L330-F360 HydrophobicContact CB-CZ 4.24Å; L330-F360 HydrophobicContact CD1-CE1 4.06Å; L330-V382 HydrophobicContact CD1-CG2 3.46Å; L330-V382 VanDerWaalsContact CD1-CG2 3.46Å; L330-L385 HydrophobicContact CD2-CD1 4.29Å
331	Q	98.4	Very high	96.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.6	-40.9	173.3	-70.6	166.1	95.7	0	0	112.4	H181 F240 I269 L272 R273 V327 A328 L329 L334 L335	H181-Q331 PolarHBondContact CE1-NE2 3.25Å; H181-Q331 PolarHBondContact ND1-NE2 3.41Å; F240-Q331 HydrophobicContact CD1-CB 4.4Å; F240-Q331 HydrophobicContact CE1-CB 3.56Å; F240-Q331 HydrophobicContact CZ-CB 3.73Å; I269-Q331 HydrophobicContact CD1-CB 4.27Å; I269-Q331 HydrophobicContact CG1-CB 4.32Å; I269-Q331 HydrophobicContact CG1-CG 4.27Å; I269-Q331 HydrophobicContact CG2-CG 4.01Å; L272-Q331 HydrophobicContact CD2-CG 3.75Å; R273-Q331 VanDerWaalsContact CZ-OE1 3.26Å; V327-Q331 VanDerWaalsContact O-CG 3.29Å; V327-Q331 WeakPolarHBondContact O-CG 3.5Å; V327-Q331 PolarHBondContact O-N 3.46Å; V327-Q331 VanDerWaalsContact O-N 3.07Å; V327-Q331 PolarHBondContact O-NE2 3.2Å; A328-Q331 WeakPolarHBondContact O-CB 3.49Å; A328-Q331 PolarHBondContact O-N 3.32Å; L329-Q331 VanDerWaalsContact C-N 3.33Å; L329-Q331 PolarHBondContact O-N 3.42Å; Q331-L334 PolarHBondContact O-N 3.42Å; Q331-L335 WeakPolarHBondContact O-CB 3.49Å; Q331-L335 PolarHBondContact O-N 2.88Å
332	A	98	Very high	96.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.4	-39.7	177.9	0	0	0	0	0	112.1	V177 L244 A328 L329 L335 M336 Y356	V177-A332 HydrophobicContact CG1-CB 4.04Å; L244-A332 HydrophobicContact CD1-CB 3.97Å; A328-A332 PolarHBondContact O-N 3.14Å; L329-A332 PolarHBondContact O-N 3.08Å; A332-L335 PolarHBondContact O-N 3.07Å; A332-M336 WeakPolarHBondContact O-CG 3.41Å; A332-M336 PolarHBondContact O-N 3.46Å; A332-Y356 HydrophobicContact CB-CD1 3.9Å; A332-Y356 HydrophobicContact CB-CD2 3.93Å; A332-Y356 HydrophobicContact CB-CE1 4.08Å; A332-Y356 HydrophobicContact CB-CE2 4.07Å; A332-Y356 HydrophobicContact CB-CG 3.84Å
333	V	98.1	Very high	96.5	Very high	4 Å²	4	22.9 Å²	22.9	2%	0.024	14%	0.144	C	C	.	.	H	α-helix	trans	-64.4	-41.3	174.5	171.4	0	0	0	0	111.8	L329 L330 Q353 L357 F360 V382	L329-V333 WeakPolarHBondContact O-CG2 3.34Å; L329-V333 PolarHBondContact O-N 3.37Å; L330-V333 PolarHBondContact O-N 3.29Å; V333-Q353 HydrophobicContact CG1-CG 4.31Å; V333-Q353 PolarHBondContact O-NE2 3.34Å; V333-L357 HydrophobicContact CG1-CD2 3.86Å; V333-L357 HydrophobicContact CG1-CG 4.21Å; V333-L357 HydrophobicContact CG2-CD2 3.86Å; V333-L357 HydrophobicContact CG2-CG 3.94Å; V333-F360 HydrophobicContact CG2-CD1 4.46Å; V333-V382 HydrophobicContact CG1-CG2 4.45Å
334	L	97.9	Very high	96.5	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66.9	-37.6	176.1	-68.3	161.7	0	0	0	112.2	C265 E268 I269 L272 L330 Q331 S337 V382 L385	C265-L334 WeakPolarHBondContact CB-O 3.4Å; E268-L334 HydrophobicContact CB-CD2 4.39Å; E268-L334 WeakPolarHBondContact OE2-CD2 3.5Å; I269-L334 HydrophobicContact CG1-CB 4.36Å; L272-L334 HydrophobicContact CD2-CD1 4.04Å; L330-L334 HydrophobicContact CG-CD1 4.39Å; L330-L334 WeakPolarHBondContact O-CD1 3.27Å; L330-L334 VanDerWaalsContact O-CG 3.26Å; L330-L334 WeakPolarHBondContact O-CG 3.42Å; L330-L334 PolarHBondContact O-N 2.9Å; Q331-L334 PolarHBondContact O-N 3.42Å; L334-S337 PolarHBondContact O-OG 3.43Å; L334-V382 HydrophobicContact CD2-CG1 3.92Å; L334-L385 HydrophobicContact CD1-CD1 3.6Å; L334-L385 HydrophobicContact CD2-CB 4.02Å; L334-L385 HydrophobicContact CD2-CD1 4.34Å
335	L	97.6	Very high	96.4	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-64.3	-48.4	176	177.8	68.2	0	0	0	111.3	A241 L244 F247 L261 L262 C265 I269 Q331 A332 S337	A241-L335 HydrophobicContact CB-CD1 4.05Å; A241-L335 HydrophobicContact CB-CD2 3.6Å; A241-L335 HydrophobicContact CB-CG 4.5Å; L244-L335 HydrophobicContact CD1-CD2 3.76Å; F247-L335 HydrophobicContact CD2-CD1 4.33Å; F247-L335 HydrophobicContact CD2-CD2 3.77Å; F247-L335 HydrophobicContact CD2-CG 4.17Å; F247-L335 HydrophobicContact CE2-CD1 3.94Å; F247-L335 HydrophobicContact CE2-CD2 4.2Å; F247-L335 HydrophobicContact CE2-CG 4.28Å; F247-L335 HydrophobicContact CG-CD2 4.17Å; L261-L335 HydrophobicContact CB-CD1 4.36Å; L261-L335 WeakPolarHBondContact CD2-O 3.5Å; L262-L335 HydrophobicContact CD2-CD1 4.23Å; C265-L335 WeakPolarHBondContact SG-CD1 3.46Å; I269-L335 HydrophobicContact CD1-CB 4.44Å; Q331-L335 WeakPolarHBondContact O-CB 3.49Å; Q331-L335 PolarHBondContact O-N 2.88Å; A332-L335 PolarHBondContact O-N 3.07Å; L335-S337 PolarHBondContact O-N 2.89Å
336	M	96.4	Very high	96.4	Very high	0 Å²	0	26 Å²	26	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-81.1	53.7	-176.4	-63.1	-55.7	-165.4	0	0	112.6	M246 F247 L253 A332 I349 C352 Q353 Y356	M246-M336 HydrophobicContact CB-CE 3.91Å; M246-M336 WeakPolarHBondContact O-CE 3.32Å; F247-M336 HydrophobicContact CB-CE 3.89Å; F247-M336 HydrophobicContact CD2-CE 4.31Å; L253-M336 HydrophobicContact CD1-SD 4.43Å; A332-M336 WeakPolarHBondContact O-CG 3.41Å; A332-M336 PolarHBondContact O-N 3.46Å; M336-I349 HydrophobicContact CB-CG2 4.46Å; M336-C352 HydrophobicContact CE-CB 4.23Å; M336-C352 HydrophobicContact CG-CB 4.24Å; M336-C352 HydrophobicContact SD-CB 4.23Å; M336-Q353 HydrophobicContact CB-CB 3.84Å; M336-Q353 HydrophobicContact CB-CG 4.08Å; M336-Q353 WeakPolarHBondContact O-CB 3.36Å; M336-Q353 WeakPolarHBondContact O-CG 3.39Å; M336-Q353 PolarHBondContact O-NE2 2.88Å; M336-Y356 HydrophobicContact CE-CE2 3.98Å; M336-Y356 HydrophobicContact CG-CD2 3.87Å; M336-Y356 HydrophobicContact CG-CE2 3.75Å
337	S	95.6	Very high	96.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	20%	0.197	C	C	.	.			trans	-94.5	110	-176.4	-67.9	0	0	0	0	111.3	L261 L334 L335 D339 R340 R386	L261-S337 WeakPolarHBondContact CD2-O 3.5Å; L334-S337 PolarHBondContact O-OG 3.43Å; L335-S337 PolarHBondContact O-N 2.89Å; S337-D339 VanDerWaalsContact C-N 3.28Å; S337-D339 WeakPolarHBondContact CB-OD1 3.41Å; S337-D339 PolarHBondContact O-N 3.29Å; S337-R340 WeakPolarHBondContact O-CG 3.45Å; S337-R386 PolarHBondContact OG-NH2 2.97Å
338	S	95.3	Very high	96	Very high	19 Å²	19	36.6 Å²	36.6	13%	0.133	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-12	-176.4	67.3	0	0	0	0	114.5	R340 L343 E350	S338-R340 VanDerWaalsContact C-N 3.25Å; S338-R340 PolarHBondContact O-N 3.08Å; S338-L343 WeakPolarHBondContact O-CD1 3.4Å; S338-E350 WeakPolarHBondContact OG-CG 3.37Å; S338-E350 PolarHBondContact OG-OE1 3.01Å
339	D	94	Very high	95.9	Very high	106 Å²	106	36.6 Å²	36.6	57%	0.567	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	8.6	-176.7	62.2	-57.2	0	0	0	114.1	S337 R386	S337-D339 VanDerWaalsContact C-N 3.28Å; S337-D339 WeakPolarHBondContact CB-OD1 3.41Å; S337-D339 PolarHBondContact O-N 3.29Å; D339-R386 VanDerWaalsContact CG-NH1 3.27Å; D339-R386 IonicContact OD1-CZ 3.91Å; D339-R386 IonicContact OD1-NH1 3.95Å; D339-R386 PolarHBondContact OD1-NH1 3.47Å; D339-R386 IonicContact OD1-NH2 2.76Å; D339-R386 PolarHBondContact OD1-NH2 3.46Å; D339-R386 IonicContact OD2-CZ 3.95Å; D339-R386 IonicContact OD2-NH1 3.8Å; D339-R386 PolarHBondContact OD2-NH1 2.93Å; D339-R386 IonicContact OD2-NH2 2.73Å
340	R	94	Very high	95.8	Very high	45 Å²	45	40.9 Å²	40.9	17%	0.17	24%	0.239	C	C	.	.	S	Bend	trans	-78.5	137.7	177.3	-50.9	-64.6	-179.2	174	-4	110.8	I260 L261 G264 E268 S337 S338 L343	I260-R340 HydrophobicContact CG2-CB 3.63Å; I260-R340 HydrophobicContact CG2-CG 4.47Å; L261-R340 HydrophobicContact CD2-CG 4.34Å; G264-R340 VanDerWaalsContact C-NH1 3.34Å; G264-R340 VanDerWaalsContact O-CZ 3.29Å; G264-R340 PolarHBondContact O-NH1 3.43Å; G264-R340 PolarHBondContact O-NH2 2.99Å; E268-R340 IonicContact OE1-CZ 3.27Å; E268-R340 IonicContact OE1-NH1 3.77Å; E268-R340 PolarHBondContact OE1-NH1 2.93Å; E268-R340 VanDerWaalsContact OE1-NH1 3.08Å; E268-R340 IonicContact OE1-NH2 3.02Å; E268-R340 PolarHBondContact OE1-NH2 3.32Å; E268-R340 IonicContact OE2-NH2 3.49Å; E268-R340 PolarHBondContact OE2-NH2 3.24Å; S337-R340 WeakPolarHBondContact O-CG 3.45Å; S338-R340 VanDerWaalsContact C-N 3.25Å; S338-R340 PolarHBondContact O-N 3.08Å; R340-L343 HydrophobicContact CB-CD1 3.75Å; R340-L343 HydrophobicContact CB-CG 4.04Å; R340-L343 HydrophobicContact CG-CD1 4.35Å; R340-L343 WeakPolarHBondContact O-CD1 3.38Å; R340-L343 WeakPolarHBondContact O-CG 3.24Å
341	S	92.8	Very high	95.7	Very high	111 Å²	111	47.3 Å²	47.3	78%	0.776	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	136.7	177.6	52.1	0	0	0	0	112.1
342	G	94.2	Very high	95.5	Very high	61 Å²	61	48 Å²	48	63%	0.629	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.4	-0.1	175.6	0	0	0	0	0	115.3	I260	I260-G342 WeakPolarHBondContact CD1-O 3.5Å
343	L	95.6	Very high	95.4	Very high	20 Å²	20	49.6 Å²	49.6	11%	0.105	28%	0.279	C	S	.	.			trans	-66.6	137.3	176.5	-69.4	173.9	0	0	0	112	D257 I260 L261 S338 R340 V346 I349	D257-L343 HydrophobicContact CB-CD2 3.96Å; I260-L343 HydrophobicContact CB-CD2 3.91Å; I260-L343 HydrophobicContact CD1-CD2 4.42Å; I260-L343 HydrophobicContact CG2-CD2 3.66Å; I260-L343 HydrophobicContact CG2-CG 3.97Å; L261-L343 HydrophobicContact CD2-CD1 4.13Å; L261-L343 HydrophobicContact CD2-CD2 4.13Å; L261-L343 HydrophobicContact CG-CD2 4.1Å; S338-L343 WeakPolarHBondContact O-CD1 3.4Å; R340-L343 HydrophobicContact CB-CD1 3.75Å; R340-L343 HydrophobicContact CB-CG 4.04Å; R340-L343 HydrophobicContact CG-CD1 4.35Å; R340-L343 WeakPolarHBondContact O-CD1 3.38Å; R340-L343 WeakPolarHBondContact O-CG 3.24Å; L343-V346 HydrophobicContact CB-CG2 4.02Å; L343-I349 HydrophobicContact CB-CD1 4.39Å; L343-I349 HydrophobicContact CD1-CD1 3.78Å; L343-I349 HydrophobicContact CD2-CD1 3.76Å; L343-I349 HydrophobicContact CG-CD1 4.19Å
344	T	95.6	Very high	95.4	Very high	103 Å²	103	54.9 Å²	54.9	63%	0.632	30%	0.303	S	S	*	.	S	Bend	trans	-96.9	-35.9	178.3	62.5	0	0	0	0	112.4	D257	D257-T344 PolarHBondContact OD1-N 2.92Å; D257-T344 PolarHBondContact OD1-OG1 3.28Å; D257-T344 PolarHBondContact OD2-OG1 3.49Å
345	S	93.8	Very high	95.3	Very high	20 Å²	20	57.8 Å²	57.8	14%	0.14	32%	0.321	C	S	.	.			trans	-103.7	43.8	-174.3	-54.4	0	0	0	0	113.9	P254 D257 D347 K348 I349	P254-S345 WeakPolarHBondContact CD-OG 3.14Å; D257-S345 WeakPolarHBondContact OD2-CB 3.37Å; D257-S345 PolarHBondContact OD2-N 2.62Å; D257-S345 PolarHBondContact OD2-OG 3.44Å; D257-S345 VanDerWaalsContact OD2-OG 3.12Å; S345-D347 PolarHBondContact O-N 3.04Å; S345-K348 WeakPolarHBondContact O-CB 3.39Å; S345-K348 PolarHBondContact O-N 3.17Å; S345-I349 WeakPolarHBondContact O-CG1 3.23Å; S345-I349 PolarHBondContact O-N 3.27Å; S345-I349 VanDerWaalsContact O-N 3.11Å
346	V	96.1	Very high	95.3	Very high	50 Å²	50	57.7 Å²	57.7	30%	0.303	32%	0.321	S	S	.	.	H	α-helix	trans	-49.4	-53	-174.1	-177	0	0	0	0	112.6	L343 K348 I349 E350	L343-V346 HydrophobicContact CB-CG2 4.02Å; V346-K348 PolarHBondContact O-N 3.44Å; V346-I349 WeakPolarHBondContact O-CB 3.28Å; V346-I349 PolarHBondContact O-N 3.47Å; V346-E350 WeakPolarHBondContact O-CG 3.15Å; V346-E350 PolarHBondContact O-N 3.47Å
347	D	94.8	Very high	95.4	Very high	117 Å²	117	59.9 Å²	59.9	63%	0.626	33%	0.332	S	S	*	.	H	α-helix	trans	-58.9	-33.5	-179.2	-65.9	-25.3	0	0	0	113.6	S345 K351	S345-D347 PolarHBondContact O-N 3.04Å; D347-K351 WeakPolarHBondContact O-CG 3.45Å; D347-K351 PolarHBondContact O-N 2.71Å
348	K	93.3	Very high	95.5	Very high	110 Å²	110	63.1 Å²	63.1	48%	0.478	35%	0.349	S	S	.	.	H	α-helix	trans	-72.9	-42.4	177.9	-66	-175.9	-175.4	171.7	0	110.2	L253 S345 V346 E350 K351 C352	L253-K348 HydrophobicContact CD2-CB 4.42Å; S345-K348 WeakPolarHBondContact O-CB 3.39Å; S345-K348 PolarHBondContact O-N 3.17Å; V346-K348 PolarHBondContact O-N 3.44Å; K348-E350 VanDerWaalsContact C-N 3.32Å; K348-E350 PolarHBondContact O-N 3.08Å; K348-K351 PolarHBondContact O-N 3.01Å; K348-C352 PolarHBondContact O-N 3.46Å; K348-C352 PolarHBondContact O-SG 3.24Å
349	I	95.8	Very high	95.6	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-62.5	-42.9	178.8	-63.6	164.2	0	0	0	109.8	L253 L261 M336 L343 S345 V346 K351 C352 Q353	L253-I349 HydrophobicContact CD1-CG1 4.38Å; L253-I349 HydrophobicContact CD2-CD1 4.36Å; L253-I349 HydrophobicContact CD2-CG1 3.72Å; L261-I349 HydrophobicContact CD1-CD1 4.13Å; L261-I349 HydrophobicContact CD1-CG1 4.33Å; L261-I349 HydrophobicContact CD2-CD1 4.33Å; L261-I349 HydrophobicContact CD2-CG2 4.24Å; M336-I349 HydrophobicContact CB-CG2 4.46Å; L343-I349 HydrophobicContact CB-CD1 4.39Å; L343-I349 HydrophobicContact CD1-CD1 3.78Å; L343-I349 HydrophobicContact CD2-CD1 3.76Å; L343-I349 HydrophobicContact CG-CD1 4.19Å; S345-I349 WeakPolarHBondContact O-CG1 3.23Å; S345-I349 PolarHBondContact O-N 3.27Å; S345-I349 VanDerWaalsContact O-N 3.11Å; V346-I349 WeakPolarHBondContact O-CB 3.28Å; V346-I349 PolarHBondContact O-N 3.47Å; I349-K351 PolarHBondContact O-N 3.27Å; I349-C352 WeakPolarHBondContact O-CB 3.19Å; I349-C352 PolarHBondContact O-N 2.86Å; I349-Q353 WeakPolarHBondContact O-CB 3.45Å; I349-Q353 PolarHBondContact O-N 3.47Å
350	E	96.1	Very high	95.8	Very high	91 Å²	91	57.2 Å²	57.2	43%	0.425	32%	0.316	S	S	.	.	H	α-helix	trans	-59.5	-46.2	175.9	-71.3	-173.8	168.9	0	0	112.3	S338 V346 K348 C352 Q353 E354	S338-E350 WeakPolarHBondContact OG-CG 3.37Å; S338-E350 PolarHBondContact OG-OE1 3.01Å; V346-E350 WeakPolarHBondContact O-CG 3.15Å; V346-E350 PolarHBondContact O-N 3.47Å; K348-E350 VanDerWaalsContact C-N 3.32Å; K348-E350 PolarHBondContact O-N 3.08Å; E350-C352 VanDerWaalsContact C-N 3.31Å; E350-C352 PolarHBondContact O-N 2.77Å; E350-Q353 PolarHBondContact O-N 3.28Å; E350-E354 WeakPolarHBondContact O-CB 3.32Å; E350-E354 PolarHBondContact O-N 3.02Å
351	K	95.4	Very high	95.9	Very high	136 Å²	136	58.2 Å²	58.2	59%	0.591	32%	0.322	S	S	*	.	H	α-helix	trans	-61.8	-38.9	175.5	-72.1	170.4	-176.2	171.8	0	112.4	D347 K348 I349 T355	D347-K351 WeakPolarHBondContact O-CG 3.45Å; D347-K351 PolarHBondContact O-N 2.71Å; K348-K351 PolarHBondContact O-N 3.01Å; I349-K351 PolarHBondContact O-N 3.27Å; K351-T355 WeakPolarHBondContact O-CB 3.48Å; K351-T355 PolarHBondContact O-N 3.11Å; K351-T355 PolarHBondContact O-OG1 3.06Å
352	C	94.9	Very high	96.1	Very high	13 Å²	13	54 Å²	54	9%	0.088	29%	0.291	C	S	.	.	H	α-helix	trans	-65.4	-43.5	175.9	-64.7	0	0	0	0	111	M246 M336 K348 I349 E350 T355 Y356	M246-C352 HydrophobicContact CB-CB 4.25Å; M246-C352 HydrophobicContact SD-CB 4.07Å; M336-C352 HydrophobicContact CE-CB 4.23Å; M336-C352 HydrophobicContact CG-CB 4.24Å; M336-C352 HydrophobicContact SD-CB 4.23Å; K348-C352 PolarHBondContact O-N 3.46Å; K348-C352 PolarHBondContact O-SG 3.24Å; I349-C352 WeakPolarHBondContact O-CB 3.19Å; I349-C352 PolarHBondContact O-N 2.86Å; E350-C352 VanDerWaalsContact C-N 3.31Å; E350-C352 PolarHBondContact O-N 2.77Å; C352-T355 WeakPolarHBondContact O-CB 3.46Å; C352-T355 PolarHBondContact O-N 3.35Å; C352-Y356 VanDerWaalsContact O-CD2 3.27Å; C352-Y356 WeakPolarHBondContact O-CD2 3.19Å; C352-Y356 PolarHBondContact O-N 3.02Å
353	Q	97.1	Very high	96.3	Very high	34 Å²	34	52.2 Å²	52.2	16%	0.159	27%	0.265	C	S	.	.	H	α-helix	trans	-63.8	-44.7	177.1	-159.8	-176.1	44.2	0	0	111.7	V333 M336 I349 E350 T355 Y356 L357	V333-Q353 HydrophobicContact CG1-CG 4.31Å; V333-Q353 PolarHBondContact O-NE2 3.34Å; M336-Q353 HydrophobicContact CB-CB 3.84Å; M336-Q353 HydrophobicContact CB-CG 4.08Å; M336-Q353 WeakPolarHBondContact O-CB 3.36Å; M336-Q353 WeakPolarHBondContact O-CG 3.39Å; M336-Q353 PolarHBondContact O-NE2 2.88Å; I349-Q353 WeakPolarHBondContact O-CB 3.45Å; I349-Q353 PolarHBondContact O-N 3.47Å; E350-Q353 PolarHBondContact O-N 3.28Å; Q353-T355 VanDerWaalsContact C-N 3.28Å; Q353-T355 PolarHBondContact O-N 3.17Å; Q353-Y356 PolarHBondContact O-N 3.33Å; Q353-L357 HydrophobicContact CG-CD1 4.14Å; Q353-L357 WeakPolarHBondContact O-CB 3.46Å; Q353-L357 WeakPolarHBondContact O-CG 3.31Å; Q353-L357 PolarHBondContact O-N 3.27Å
354	E	96.9	Very high	96.3	Very high	116 Å²	116	51.3 Å²	51.3	54%	0.542	26%	0.26	S	S	.	.	H	α-helix	trans	-57.8	-42.9	176.1	-176	176.6	-158.7	0	0	111	E350 Y356 L357 L358	E350-E354 WeakPolarHBondContact O-CB 3.32Å; E350-E354 PolarHBondContact O-N 3.02Å; E354-Y356 PolarHBondContact O-N 3.44Å; E354-L357 PolarHBondContact O-N 2.63Å; E354-L358 HydrophobicContact CG-CD1 4.05Å; E354-L358 HydrophobicContact CG-CG 4.38Å; E354-L358 WeakPolarHBondContact O-CB 3.46Å; E354-L358 WeakPolarHBondContact O-CG 3.44Å; E354-L358 PolarHBondContact O-N 2.96Å
355	T	96.8	Very high	96.2	Very high	60 Å²	60	47 Å²	47	37%	0.368	23%	0.233	S	C	.	.	H	α-helix	trans	-60.3	-44.4	177	-57.4	0	0	0	0	111.7	L173 M246 K351 C352 Q353 A359	L173-T355 HydrophobicContact CD2-CG2 3.76Å; M246-T355 HydrophobicContact CE-CG2 3.93Å; M246-T355 HydrophobicContact SD-CG2 4.21Å; K351-T355 WeakPolarHBondContact O-CB 3.48Å; K351-T355 PolarHBondContact O-N 3.11Å; K351-T355 PolarHBondContact O-OG1 3.06Å; C352-T355 WeakPolarHBondContact O-CB 3.46Å; C352-T355 PolarHBondContact O-N 3.35Å; Q353-T355 VanDerWaalsContact C-N 3.28Å; Q353-T355 PolarHBondContact O-N 3.17Å; T355-A359 WeakPolarHBondContact O-CB 3.39Å; T355-A359 PolarHBondContact O-N 3.48Å
356	Y	97.8	Very high	96.2	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-68.1	-38.6	174.5	-71.3	-56.3	0	0	0	112.7	L173 V177 M246 A332 M336 C352 Q353 E354 F360	L173-Y356 HydrophobicContact CD1-CD1 4.48Å; L173-Y356 HydrophobicContact CD1-CE1 3.71Å; L173-Y356 HydrophobicContact CD2-CD1 3.96Å; L173-Y356 HydrophobicContact CD2-CE1 4Å; L173-Y356 HydrophobicContact CG-CD1 4.28Å; L173-Y356 HydrophobicContact CG-CE1 3.98Å; V177-Y356 HydrophobicContact CG2-CD1 4.07Å; V177-Y356 HydrophobicContact CG2-CE1 3.42Å; V177-Y356 VanDerWaalsContact CG2-CE1 3.42Å; M246-Y356 HydrophobicContact CE-CD1 4.08Å; M246-Y356 HydrophobicContact CE-CD2 3.8Å; M246-Y356 HydrophobicContact CE-CE1 3.62Å; M246-Y356 HydrophobicContact CE-CE2 3.35Å; M246-Y356 HydrophobicContact CE-CG 4.14Å; A332-Y356 HydrophobicContact CB-CD1 3.9Å; A332-Y356 HydrophobicContact CB-CD2 3.93Å; A332-Y356 HydrophobicContact CB-CE1 4.08Å; A332-Y356 HydrophobicContact CB-CE2 4.07Å; A332-Y356 HydrophobicContact CB-CG 3.84Å; M336-Y356 HydrophobicContact CE-CE2 3.98Å; M336-Y356 HydrophobicContact CG-CD2 3.87Å; M336-Y356 HydrophobicContact CG-CE2 3.75Å; C352-Y356 VanDerWaalsContact O-CD2 3.27Å; C352-Y356 WeakPolarHBondContact O-CD2 3.19Å; C352-Y356 PolarHBondContact O-N 3.02Å; Q353-Y356 PolarHBondContact O-N 3.33Å; E354-Y356 PolarHBondContact O-N 3.44Å; Y356-F360 WeakPolarHBondContact O-CB 3.45Å; Y356-F360 PolarHBondContact O-N 2.8Å
357	L	97.6	Very high	96.1	Very high	45 Å²	45	53.1 Å²	53.1	24%	0.236	25%	0.249	C	C	.	.	H	α-helix	trans	-63.3	-44.7	178.7	-81.6	167.3	0	0	0	112	V333 Q353 E354 F360 E361 W375 L379	V333-L357 HydrophobicContact CG1-CD2 3.86Å; V333-L357 HydrophobicContact CG1-CG 4.21Å; V333-L357 HydrophobicContact CG2-CD2 3.86Å; V333-L357 HydrophobicContact CG2-CG 3.94Å; Q353-L357 HydrophobicContact CG-CD1 4.14Å; Q353-L357 WeakPolarHBondContact O-CB 3.46Å; Q353-L357 WeakPolarHBondContact O-CG 3.31Å; Q353-L357 PolarHBondContact O-N 3.27Å; E354-L357 PolarHBondContact O-N 2.63Å; L357-F360 PolarHBondContact O-N 2.7Å; L357-E361 WeakPolarHBondContact O-CB 3.42Å; L357-E361 PolarHBondContact O-N 3.23Å; L357-W375 HydrophobicContact CD2-CH2 4.17Å; L357-W375 HydrophobicContact CD2-CZ2 4.24Å; L357-L379 HydrophobicContact CD2-CD1 3.77Å
358	L	97.1	Very high	95.9	Very high	69 Å²	69	48.5 Å²	48.5	36%	0.361	22%	0.223	S	C	.	.	H	α-helix	trans	-64.5	-48.9	177.5	-72.2	172	0	0	0	111.3	E354 F360 E361 H362	E354-L358 HydrophobicContact CG-CD1 4.05Å; E354-L358 HydrophobicContact CG-CG 4.38Å; E354-L358 WeakPolarHBondContact O-CB 3.46Å; E354-L358 WeakPolarHBondContact O-CG 3.44Å; E354-L358 PolarHBondContact O-N 2.96Å; L358-F360 PolarHBondContact O-N 3.02Å; L358-E361 PolarHBondContact O-N 3.2Å; L358-H362 WeakPolarHBondContact O-CB 3.45Å; L358-H362 PolarHBondContact O-CD2 3.29Å; L358-H362 PolarHBondContact O-N 3.18Å; L358-H362 PolarHBondContact O-ND1 3.27Å
359	A	98	Very high	95.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-57.5	-38	175.4	0	0	0	0	0	111.5	E170 L173 I174 T355 Y363	E170-A359 HydrophobicContact CB-CB 4.15Å; E170-A359 HydrophobicContact CG-CB 4.1Å; L173-A359 HydrophobicContact CD2-CB 4.42Å; I174-A359 HydrophobicContact CD1-CB 4.3Å; I174-A359 HydrophobicContact CG1-CB 4.12Å; T355-A359 WeakPolarHBondContact O-CB 3.39Å; T355-A359 PolarHBondContact O-N 3.48Å; A359-Y363 WeakPolarHBondContact O-CB 3.38Å; A359-Y363 PolarHBondContact O-N 2.91Å
360	F	98.1	Very high	95.1	Very high	1 Å²	1	54 Å²	54	0%	0.004	25%	0.254	C	S	.	.	H	α-helix	trans	-70	-46.9	177.4	-168.7	-168.6	0	0	0	112.9	E326 L329 L330 V333 Y356 L357 L358 H362 Y363 I364 W375 L378	E326-F360 HydrophobicContact CB-CE2 3.96Å; E326-F360 HydrophobicContact CB-CZ 4.4Å; E326-F360 HydrophobicContact CG-CE2 4.09Å; E326-F360 WeakPolarHBondContact O-CZ 3.46Å; L329-F360 HydrophobicContact CB-CB 3.97Å; L329-F360 HydrophobicContact CB-CD1 3.95Å; L329-F360 HydrophobicContact CB-CD2 3.84Å; L329-F360 HydrophobicContact CB-CE1 4.37Å; L329-F360 HydrophobicContact CB-CE2 4.27Å; L329-F360 HydrophobicContact CB-CG 3.67Å; L329-F360 HydrophobicContact CD1-CB 4.06Å; L329-F360 HydrophobicContact CD1-CD2 3.81Å; L329-F360 HydrophobicContact CD1-CG 4.14Å; L329-F360 HydrophobicContact CG-CB 4.45Å; L329-F360 HydrophobicContact CG-CD2 4.48Å; L329-F360 HydrophobicContact CG-CG 4.49Å; L330-F360 HydrophobicContact CB-CE1 4Å; L330-F360 HydrophobicContact CB-CZ 4.24Å; L330-F360 HydrophobicContact CD1-CE1 4.06Å; V333-F360 HydrophobicContact CG2-CD1 4.46Å; Y356-F360 WeakPolarHBondContact O-CB 3.45Å; Y356-F360 PolarHBondContact O-N 2.8Å; L357-F360 PolarHBondContact O-N 2.7Å; L358-F360 PolarHBondContact O-N 3.02Å; F360-H362 VanDerWaalsContact C-N 3.29Å; F360-H362 PolarHBondContact O-N 2.96Å; F360-Y363 PolarHBondContact O-N 3.24Å; F360-I364 HydrophobicContact CD2-CD1 4.33Å; F360-I364 HydrophobicContact CD2-CG1 3.78Å; F360-I364 HydrophobicContact CE2-CD1 3.83Å; F360-I364 HydrophobicContact CE2-CG1 3.69Å; F360-I364 WeakPolarHBondContact O-CB 3.2Å; F360-I364 WeakPolarHBondContact O-CG1 3.38Å; F360-I364 PolarHBondContact O-N 3.47Å; F360-W375 HydrophobicContact CB-CH2 3.9Å; F360-W375 HydrophobicContact CB-CZ3 4.02Å; F360-W375 AromaticContact CD1-CH2 3.64Å; F360-W375 HydrophobicContact CD1-CH2 3.64Å; F360-W375 AromaticContact CD1-CZ3 3.48Å; F360-W375 HydrophobicContact CD1-CZ3 3.48Å; F360-W375 VanDerWaalsContact CD1-CZ3 3.48Å; F360-W375 AromaticContact CD2-CZ3 3.9Å; F360-W375 HydrophobicContact CD2-CZ3 3.9Å; F360-W375 HydrophobicContact CE1-CH2 4.34Å; F360-W375 AromaticContact CE1-CZ3 3.87Å; F360-W375 HydrophobicContact CE1-CZ3 3.87Å; F360-W375 HydrophobicContact CE2-CZ3 4.24Å; F360-W375 AromaticContact CG-CH2 3.8Å; F360-W375 HydrophobicContact CG-CH2 3.8Å; F360-W375 AromaticContact CG-CZ3 3.5Å; F360-W375 HydrophobicContact CG-CZ3 3.5Å; F360-W375 HydrophobicContact CZ-CZ3 4.24Å; F360-L378 HydrophobicContact CE1-CD2 4.44Å; F360-L378 HydrophobicContact CE2-CD2 3.89Å; F360-L378 HydrophobicContact CZ-CD2 3.52Å; F360-L378 HydrophobicContact CZ-CG 4.17Å
361	E	96.9	Very high	94.7	Very high	65 Å²	65	53.3 Å²	53.3	30%	0.304	25%	0.253	S	S	.	.	H	α-helix	trans	-57.1	-46.3	174.7	179.9	168.5	-156.7	0	0	110.9	L357 L358 Y363 I364 N365 W375	L357-E361 WeakPolarHBondContact O-CB 3.42Å; L357-E361 PolarHBondContact O-N 3.23Å; L358-E361 PolarHBondContact O-N 3.2Å; E361-Y363 PolarHBondContact O-N 2.91Å; E361-I364 PolarHBondContact O-N 3.32Å; E361-N365 WeakPolarHBondContact O-CB 3.32Å; E361-N365 PolarHBondContact O-N 3.27Å; E361-N365 PolarHBondContact O-ND2 3.18Å; E361-W375 HydrophobicContact CB-CD2 4.08Å; E361-W375 HydrophobicContact CB-CH2 4.18Å; E361-W375 HydrophobicContact CB-CZ2 3.71Å; E361-W375 HydrophobicContact CG-CD2 4.16Å; E361-W375 HydrophobicContact CG-CG 4.15Å; E361-W375 HydrophobicContact CG-CZ2 4.45Å
362	H	96.6	Very high	94.2	Very high	24 Å²	24	50.8 Å²	50.8	11%	0.111	25%	0.25	C	S	.	.	H	α-helix	trans	-63.8	-40.9	178.8	-66	170.5	0	0	0	111.9	P164 P166 E170 L358 F360 N365 Y366	P164-H362 WeakPolarHBondContact CB-NE2 3.23Å; P164-H362 VanDerWaalsContact CG-CD2 3.43Å; P164-H362 WeakPolarHBondContact CG-CD2 3.39Å; P164-H362 WeakPolarHBondContact CG-NE2 3.48Å; P164-H362 WeakPolarHBondContact O-CA 3.5Å; P166-H362 HydrophobicContact CB-CB 4.19Å; P166-H362 WeakPolarHBondContact CD-O 3.45Å; P166-H362 HydrophobicContact CG-CB 3.89Å; E170-H362 VanDerWaalsContact CD-ND1 3.28Å; E170-H362 IonicContact OE1-CE1 3.75Å; E170-H362 PolarHBondContact OE1-CE1 3.29Å; E170-H362 VanDerWaalsContact OE1-CE1 3.3Å; E170-H362 IonicContact OE1-CG 3.08Å; E170-H362 IonicContact OE1-ND1 2.77Å; E170-H362 PolarHBondContact OE1-ND1 3Å; E170-H362 IonicContact OE2-CE1 3.12Å; E170-H362 IonicContact OE2-ND1 2.86Å; E170-H362 PolarHBondContact OE2-ND1 3.28Å; L358-H362 WeakPolarHBondContact O-CB 3.45Å; L358-H362 PolarHBondContact O-CD2 3.29Å; L358-H362 PolarHBondContact O-N 3.18Å; L358-H362 PolarHBondContact O-ND1 3.27Å; F360-H362 VanDerWaalsContact C-N 3.29Å; F360-H362 PolarHBondContact O-N 2.96Å; H362-N365 WeakPolarHBondContact O-CB 3.27Å; H362-N365 PolarHBondContact O-N 2.95Å; H362-Y366 PolarHBondContact O-N 3.31Å
363	Y	97.8	Very high	93.9	Very high	22 Å²	22	56.5 Å²	56.5	9%	0.086	28%	0.276	C	S	.	.	H	α-helix	trans	-64.3	-42.4	176.7	-173.8	-100.4	0	0	0	111.8	W171 I174 D323 T325 E326 A359 F360 E361 N365 Y366 R367	W171-Y363 AromaticContact CH2-CD2 3.65Å; W171-Y363 HydrophobicContact CH2-CD2 3.65Å; W171-Y363 AromaticContact CH2-CE2 3.53Å; W171-Y363 HydrophobicContact CH2-CE2 3.53Å; W171-Y363 AromaticContact CZ3-CD2 3.75Å; W171-Y363 HydrophobicContact CZ3-CD2 3.75Å; W171-Y363 AromaticContact CZ3-CE2 3.55Å; W171-Y363 HydrophobicContact CZ3-CE2 3.55Å; I174-Y363 HydrophobicContact CD1-CD2 4.13Å; I174-Y363 HydrophobicContact CD1-CG 4.46Å; I174-Y363 HydrophobicContact CG2-CD2 4.21Å; I174-Y363 HydrophobicContact CG2-CE2 4.4Å; D323-Y363 PolarHBondContact OD2-OH 2.93Å; T325-Y363 HydrophobicContact CG2-CD1 3.85Å; T325-Y363 HydrophobicContact CG2-CD2 4.16Å; T325-Y363 HydrophobicContact CG2-CE1 3.55Å; T325-Y363 HydrophobicContact CG2-CE2 3.86Å; T325-Y363 HydrophobicContact CG2-CG 4.14Å; E326-Y363 HydrophobicContact CG-CD1 3.99Å; E326-Y363 HydrophobicContact CG-CE1 3.86Å; A359-Y363 WeakPolarHBondContact O-CB 3.38Å; A359-Y363 PolarHBondContact O-N 2.91Å; F360-Y363 PolarHBondContact O-N 3.24Å; E361-Y363 PolarHBondContact O-N 2.91Å; Y363-N365 VanDerWaalsContact C-N 3.33Å; Y363-Y366 PolarHBondContact O-N 3.37Å; Y363-R367 WeakPolarHBondContact O-CB 3.3Å; Y363-R367 PolarHBondContact O-N 2.81Å
364	I	96.3	Very high	93.7	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-63.4	-41.1	174	-70.5	-53.1	0	0	0	111.3	E326 F360 E361 Y366 R367 K368 F374 W375 L378	E326-I364 HydrophobicContact CG-CD1 3.6Å; E326-I364 VanDerWaalsContact OE1-CD1 3.27Å; E326-I364 WeakPolarHBondContact OE1-CD1 3.41Å; F360-I364 HydrophobicContact CD2-CD1 4.33Å; F360-I364 HydrophobicContact CD2-CG1 3.78Å; F360-I364 HydrophobicContact CE2-CD1 3.83Å; F360-I364 HydrophobicContact CE2-CG1 3.69Å; F360-I364 WeakPolarHBondContact O-CB 3.2Å; F360-I364 WeakPolarHBondContact O-CG1 3.38Å; F360-I364 PolarHBondContact O-N 3.47Å; E361-I364 PolarHBondContact O-N 3.32Å; I364-Y366 VanDerWaalsContact C-N 3.34Å; I364-Y366 PolarHBondContact O-N 3.22Å; I364-R367 PolarHBondContact O-N 3.5Å; I364-K368 HydrophobicContact CD1-CG 4.42Å; I364-K368 HydrophobicContact CG2-CB 4.29Å; I364-K368 CarbonylContact O-C 3.56Å; I364-K368 WeakPolarHBondContact O-CA 3.22Å; I364-K368 WeakPolarHBondContact O-CB 3.42Å; I364-K368 PolarHBondContact O-N 3.11Å; I364-F374 HydrophobicContact CD1-CD1 4.2Å; I364-F374 HydrophobicContact CD1-CE1 3.76Å; I364-F374 HydrophobicContact CG2-CD1 3.6Å; I364-F374 HydrophobicContact CG2-CE1 4.27Å; I364-W375 HydrophobicContact CB-CE3 4.25Å; I364-W375 HydrophobicContact CG1-CE3 3.94Å; I364-W375 HydrophobicContact CG1-CZ3 4.27Å; I364-W375 HydrophobicContact CG2-CB 3.99Å; I364-W375 HydrophobicContact CG2-CE3 4.44Å; I364-L378 HydrophobicContact CD1-CD2 3.93Å; I364-L378 HydrophobicContact CG1-CD2 4.25Å
365	N	93.3	Very high	93.6	Very high	12 Å²	12	51.5 Å²	51.5	6%	0.064	25%	0.251	C	S	.	.	H	α-helix	trans	-60.4	-45	175.2	-78.5	-23.1	0	0	0	111.2	R163 P164 E361 H362 Y363 H369	R163-N365 HydrophobicContact CB-CB 3.9Å; R163-N365 WeakPolarHBondContact CD-OD1 3.35Å; P164-N365 VanDerWaalsContact O-CB 3.29Å; P164-N365 WeakPolarHBondContact O-CB 3.39Å; P164-N365 PolarHBondContact O-ND2 3.5Å; E361-N365 WeakPolarHBondContact O-CB 3.32Å; E361-N365 PolarHBondContact O-N 3.27Å; E361-N365 PolarHBondContact O-ND2 3.18Å; H362-N365 WeakPolarHBondContact O-CB 3.27Å; H362-N365 PolarHBondContact O-N 2.95Å; Y363-N365 VanDerWaalsContact C-N 3.33Å; N365-H369 WeakPolarHBondContact O-CA 3.46Å; N365-H369 WeakPolarHBondContact O-CB 3.44Å; N365-H369 PolarHBondContact O-N 3.38Å
366	Y	93.4	Very high	93.5	Very high	113 Å²	113	51.7 Å²	51.7	44%	0.443	25%	0.253	S	S	.	.	H	α-helix	trans	-60.4	-52.9	175.1	171	-102.9	0	0	0	112.1	E165 W171 H362 Y363 I364 H369	E165-Y366 HydrophobicContact CG-CD2 4.48Å; W171-Y366 AromaticContact CH2-CD1 3.94Å; W171-Y366 HydrophobicContact CH2-CD1 3.94Å; W171-Y366 AromaticContact CH2-CE1 3.95Å; W171-Y366 HydrophobicContact CH2-CE1 3.95Å; W171-Y366 AromaticContact CZ2-CD1 3.98Å; W171-Y366 HydrophobicContact CZ2-CD1 3.98Å; W171-Y366 HydrophobicContact CZ2-CE1 4.08Å; W171-Y366 HydrophobicContact CZ2-CG 4.26Å; H362-Y366 PolarHBondContact O-N 3.31Å; Y363-Y366 PolarHBondContact O-N 3.37Å; I364-Y366 VanDerWaalsContact C-N 3.34Å; I364-Y366 PolarHBondContact O-N 3.22Å; Y366-H369 PolarHBondContact O-ND1 3.07Å
367	R	94.2	Very high	93.3	Very high	86 Å²	86	57.8 Å²	57.8	33%	0.325	28%	0.279	S	S	.	.	H	α-helix	trans	-83.6	-35.9	-170.1	-170.4	176.5	179.5	-126.3	9.4	114.6	D323 E326 Y363 I364	D323-R367 IonicContact OD1-NH1 3.49Å; D323-R367 WeakPolarHBondContact OD2-CD 3.29Å; D323-R367 IonicContact OD2-CZ 3.35Å; D323-R367 IonicContact OD2-NE 2.81Å; D323-R367 PolarHBondContact OD2-NE 3.15Å; D323-R367 IonicContact OD2-NH1 2.76Å; D323-R367 PolarHBondContact OD2-NH1 3.27Å; D323-R367 VanDerWaalsContact OD2-NH1 3.12Å; D323-R367 IonicContact OD2-NH2 3.51Å; D323-R367 PolarHBondContact OD2-NH2 2.98Å; E326-R367 IonicContact OE1-CZ 3.05Å; E326-R367 IonicContact OE1-NH1 2.8Å; E326-R367 PolarHBondContact OE1-NH1 3.02Å; E326-R367 IonicContact OE2-NH1 3.35Å; E326-R367 PolarHBondContact OE2-NH1 2.93Å; Y363-R367 WeakPolarHBondContact O-CB 3.3Å; Y363-R367 PolarHBondContact O-N 2.81Å; I364-R367 PolarHBondContact O-N 3.5Å
368	K	91.3	Very high	93.3	Very high	19 Å²	19	55.6 Å²	55.6	8%	0.083	27%	0.268	C	S	.	.	H	α-helix	trans	-117.4	24.1	-171.5	-51.8	-80.1	-177.1	163.1	0	111.9	F320 N321 E326 I364 N370 I371 F374	F320-K368 PolarHBondContact O-NZ 3.11Å; F320-K368 VanDerWaalsContact O-NZ 3.13Å; N321-K368 PolarHBondContact O-NZ 2.97Å; E326-K368 VanDerWaalsContact OE1-CE 3.23Å; E326-K368 WeakPolarHBondContact OE1-CE 3.14Å; I364-K368 HydrophobicContact CD1-CG 4.42Å; I364-K368 HydrophobicContact CG2-CB 4.29Å; I364-K368 CarbonylContact O-C 3.56Å; I364-K368 WeakPolarHBondContact O-CA 3.22Å; I364-K368 WeakPolarHBondContact O-CB 3.42Å; I364-K368 PolarHBondContact O-N 3.11Å; K368-N370 PolarHBondContact O-N 3.33Å; K368-I371 HydrophobicContact CB-CD1 4.49Å; K368-I371 HydrophobicContact CD-CD1 4.03Å; K368-I371 PolarHBondContact O-N 3.2Å; K368-F374 HydrophobicContact CB-CB 4.4Å; K368-F374 HydrophobicContact CB-CD1 3.95Å; K368-F374 HydrophobicContact CB-CD2 4.42Å; K368-F374 HydrophobicContact CB-CE1 4.3Å; K368-F374 HydrophobicContact CB-CG 4Å; K368-F374 HydrophobicContact CD-CD2 4.43Å; K368-F374 HydrophobicContact CD-CE1 4.19Å; K368-F374 HydrophobicContact CD-CE2 3.99Å; K368-F374 HydrophobicContact CD-CZ 3.85Å; K368-F374 HydrophobicContact CG-CD1 3.92Å; K368-F374 HydrophobicContact CG-CD2 4.47Å; K368-F374 HydrophobicContact CG-CE1 3.74Å; K368-F374 HydrophobicContact CG-CE2 4.32Å; K368-F374 HydrophobicContact CG-CG 4.28Å; K368-F374 HydrophobicContact CG-CZ 3.94Å
369	H	85.6	Confident	93.2	Very high	94 Å²	94	54.9 Å²	54.9	44%	0.435	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-35.9	179.1	51.5	-80.5	0	0	0	113.7	R163 N365 Y366 I371	R163-H369 PolarHBondContact NH1-O 3.22Å; N365-H369 WeakPolarHBondContact O-CA 3.46Å; N365-H369 WeakPolarHBondContact O-CB 3.44Å; N365-H369 PolarHBondContact O-N 3.38Å; Y366-H369 PolarHBondContact O-ND1 3.07Å; H369-I371 VanDerWaalsContact C-N 3.29Å; H369-I371 PolarHBondContact O-N 3.19Å
370	N	86.7	Confident	93.1	Very high	132 Å²	132	60 Å²	60	71%	0.706	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-8.7	-177.5	-65.9	-40.3	0	0	0	114.6	K368 P372	K368-N370 PolarHBondContact O-N 3.33Å; N370-P372 WeakPolarHBondContact O-CD 3.32Å
371	I	88	Confident	93.1	Very high	76 Å²	76	61.1 Å²	61.1	39%	0.39	29%	0.294	S	S	.	.	S	Bend	trans	-101.5	112.9	-178.8	-51.7	177.2	0	0	0	109.2	K368 H369 H373 F374	K368-I371 HydrophobicContact CB-CD1 4.49Å; K368-I371 HydrophobicContact CD-CD1 4.03Å; K368-I371 PolarHBondContact O-N 3.2Å; H369-I371 VanDerWaalsContact C-N 3.29Å; H369-I371 PolarHBondContact O-N 3.19Å; I371-H373 PolarHBondContact O-N 3.23Å; I371-F374 HydrophobicContact CB-CB 4.03Å; I371-F374 HydrophobicContact CB-CD2 4.16Å; I371-F374 HydrophobicContact CB-CG 4.47Å; I371-F374 HydrophobicContact CD1-CD2 3.91Å; I371-F374 HydrophobicContact CD1-CE2 4.22Å; I371-F374 HydrophobicContact CG2-CB 4.02Å; I371-F374 HydrophobicContact CG2-CD2 3.92Å; I371-F374 HydrophobicContact CG2-CG 4.45Å
372	P	85	Confident	93.1	Very high	84 Å²	84	59 Å²	59	55%	0.545	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	137.6	177.7	-22	33.8	0	0	0	111.6	N370 F374	N370-P372 WeakPolarHBondContact O-CD 3.32Å; P372-F374 PolarHBondContact O-N 2.73Å; P372-F374 VanDerWaalsContact O-N 3.1Å
373	H	88.5	Confident	93	Very high	133 Å²	133	61.4 Å²	61.4	62%	0.616	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	22.8	175	-46.2	-68.6	0	0	0	114.6	I371 P376 K377	I371-H373 PolarHBondContact O-N 3.23Å; H373-P376 HydrophobicContact CB-CG 3.99Å; H373-P376 WeakPolarHBondContact O-CD 3.36Å; H373-P376 WeakPolarHBondContact O-CG 3.31Å; H373-K377 WeakPolarHBondContact O-CB 3.4Å; H373-K377 VanDerWaalsContact O-CG 3.24Å; H373-K377 WeakPolarHBondContact O-CG 3.24Å; H373-K377 PolarHBondContact O-N 3.14Å
374	F	92.6	Very high	93	Very high	13 Å²	13	63.4 Å²	63.4	6%	0.057	31%	0.314	C	S	.	.	H	α-helix	trans	-61.8	-50.2	178.4	-171.5	-85.6	0	0	0	111.6	F320 L322 I364 K368 I371 P372 K377 L378	F320-F374 HydrophobicContact CB-CE2 4.4Å; F320-F374 HydrophobicContact CB-CZ 4.24Å; F320-F374 HydrophobicContact CD1-CD2 4.45Å; F320-F374 HydrophobicContact CD1-CE1 4.36Å; F320-F374 AromaticContact CD1-CE2 3.81Å; F320-F374 HydrophobicContact CD1-CE2 3.81Å; F320-F374 AromaticContact CD1-CZ 3.77Å; F320-F374 HydrophobicContact CD1-CZ 3.77Å; F320-F374 HydrophobicContact CG-CE2 4.48Å; F320-F374 HydrophobicContact CG-CZ 4.49Å; L322-F374 HydrophobicContact CD2-CZ 4.18Å; I364-F374 HydrophobicContact CD1-CD1 4.2Å; I364-F374 HydrophobicContact CD1-CE1 3.76Å; I364-F374 HydrophobicContact CG2-CD1 3.6Å; I364-F374 HydrophobicContact CG2-CE1 4.27Å; K368-F374 HydrophobicContact CB-CB 4.4Å; K368-F374 HydrophobicContact CB-CD1 3.95Å; K368-F374 HydrophobicContact CB-CD2 4.42Å; K368-F374 HydrophobicContact CB-CE1 4.3Å; K368-F374 HydrophobicContact CB-CG 4Å; K368-F374 HydrophobicContact CD-CD2 4.43Å; K368-F374 HydrophobicContact CD-CE1 4.19Å; K368-F374 HydrophobicContact CD-CE2 3.99Å; K368-F374 HydrophobicContact CD-CZ 3.85Å; K368-F374 HydrophobicContact CG-CD1 3.92Å; K368-F374 HydrophobicContact CG-CD2 4.47Å; K368-F374 HydrophobicContact CG-CE1 3.74Å; K368-F374 HydrophobicContact CG-CE2 4.32Å; K368-F374 HydrophobicContact CG-CG 4.28Å; K368-F374 HydrophobicContact CG-CZ 3.94Å; I371-F374 HydrophobicContact CB-CB 4.03Å; I371-F374 HydrophobicContact CB-CD2 4.16Å; I371-F374 HydrophobicContact CB-CG 4.47Å; I371-F374 HydrophobicContact CD1-CD2 3.91Å; I371-F374 HydrophobicContact CD1-CE2 4.22Å; I371-F374 HydrophobicContact CG2-CB 4.02Å; I371-F374 HydrophobicContact CG2-CD2 3.92Å; I371-F374 HydrophobicContact CG2-CG 4.45Å; P372-F374 PolarHBondContact O-N 2.73Å; P372-F374 VanDerWaalsContact O-N 3.1Å; F374-K377 PolarHBondContact O-N 3.17Å; F374-L378 HydrophobicContact CD1-CD2 4.5Å; F374-L378 HydrophobicContact CE1-CB 4.48Å; F374-L378 HydrophobicContact CE1-CD2 3.85Å; F374-L378 WeakPolarHBondContact O-CB 3.43Å; F374-L378 PolarHBondContact O-N 2.73Å
375	W	94.1	Very high	93	Very high	32 Å²	32	63.3 Å²	63.3	12%	0.121	31%	0.314	C	S	.	.	H	α-helix	trans	-53.3	-58	178.3	174	-125.5	0	0	0	113.7	L357 F360 E361 I364 K377 L378 L379	L357-W375 HydrophobicContact CD2-CH2 4.17Å; L357-W375 HydrophobicContact CD2-CZ2 4.24Å; F360-W375 HydrophobicContact CB-CH2 3.9Å; F360-W375 HydrophobicContact CB-CZ3 4.02Å; F360-W375 AromaticContact CD1-CH2 3.64Å; F360-W375 HydrophobicContact CD1-CH2 3.64Å; F360-W375 AromaticContact CD1-CZ3 3.48Å; F360-W375 HydrophobicContact CD1-CZ3 3.48Å; F360-W375 VanDerWaalsContact CD1-CZ3 3.48Å; F360-W375 AromaticContact CD2-CZ3 3.9Å; F360-W375 HydrophobicContact CD2-CZ3 3.9Å; F360-W375 HydrophobicContact CE1-CH2 4.34Å; F360-W375 AromaticContact CE1-CZ3 3.87Å; F360-W375 HydrophobicContact CE1-CZ3 3.87Å; F360-W375 HydrophobicContact CE2-CZ3 4.24Å; F360-W375 AromaticContact CG-CH2 3.8Å; F360-W375 HydrophobicContact CG-CH2 3.8Å; F360-W375 AromaticContact CG-CZ3 3.5Å; F360-W375 HydrophobicContact CG-CZ3 3.5Å; F360-W375 HydrophobicContact CZ-CZ3 4.24Å; E361-W375 HydrophobicContact CB-CD2 4.08Å; E361-W375 HydrophobicContact CB-CH2 4.18Å; E361-W375 HydrophobicContact CB-CZ2 3.71Å; E361-W375 HydrophobicContact CG-CD2 4.16Å; E361-W375 HydrophobicContact CG-CG 4.15Å; E361-W375 HydrophobicContact CG-CZ2 4.45Å; I364-W375 HydrophobicContact CB-CE3 4.25Å; I364-W375 HydrophobicContact CG1-CE3 3.94Å; I364-W375 HydrophobicContact CG1-CZ3 4.27Å; I364-W375 HydrophobicContact CG2-CB 3.99Å; I364-W375 HydrophobicContact CG2-CE3 4.44Å; W375-K377 VanDerWaalsContact C-N 3.3Å; W375-K377 PolarHBondContact O-N 3.06Å; W375-L378 PolarHBondContact O-N 2.76Å; W375-L378 VanDerWaalsContact O-N 3.11Å; W375-L379 HydrophobicContact CH2-CD1 4.33Å; W375-L379 HydrophobicContact CZ2-CD1 4.28Å; W375-L379 HydrophobicContact CZ2-CD2 4.49Å; W375-L379 PolarHBondContact O-N 3.1Å
376	P	94.4	Very high	93.1	Very high	64 Å²	64	65.1 Å²	65.1	42%	0.416	32%	0.32	S	S	.	.	H	α-helix	trans	-63	-35.4	-179.4	22.8	-33.9	0	0	0	112.6	H373 L378 L379 M380	H373-P376 HydrophobicContact CB-CG 3.99Å; H373-P376 WeakPolarHBondContact O-CD 3.36Å; H373-P376 WeakPolarHBondContact O-CG 3.31Å; P376-L378 VanDerWaalsContact C-N 3.34Å; P376-L378 PolarHBondContact O-N 3.1Å; P376-L379 PolarHBondContact O-N 2.93Å; P376-M380 WeakPolarHBondContact O-CG 3.36Å; P376-M380 PolarHBondContact O-N 2.93Å; P376-M380 VanDerWaalsContact O-N 3.17Å
377	K	95.1	Very high	93.2	Very high	127 Å²	127	65.1 Å²	65.1	55%	0.552	33%	0.325	S	S	*	.	H	α-helix	trans	-64.5	-38.7	175.1	-75.1	177.8	178.7	-178.8	0	112.4	F320 H373 F374 W375	F320-K377 HydrophobicContact CE1-CB 4.03Å; F320-K377 HydrophobicContact CZ-CB 4.05Å; H373-K377 WeakPolarHBondContact O-CB 3.4Å; H373-K377 VanDerWaalsContact O-CG 3.24Å; H373-K377 WeakPolarHBondContact O-CG 3.24Å; H373-K377 PolarHBondContact O-N 3.14Å; F374-K377 PolarHBondContact O-N 3.17Å; W375-K377 VanDerWaalsContact C-N 3.3Å; W375-K377 PolarHBondContact O-N 3.06Å
378	L	96.2	Very high	93.4	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-69.8	-41.2	176.8	-178.6	55.9	0	0	0	110.9	F320 L322 F360 I364 F374 W375 P376 M380 K381	F320-L378 HydrophobicContact CD1-CB 4.25Å; F320-L378 HydrophobicContact CD1-CD1 4.06Å; F320-L378 HydrophobicContact CE1-CB 3.95Å; F320-L378 HydrophobicContact CE1-CD1 4.29Å; L322-L378 HydrophobicContact CD1-CD1 4.07Å; L322-L378 HydrophobicContact CD2-CD1 3.97Å; L322-L378 HydrophobicContact CD2-CD2 4.04Å; F360-L378 HydrophobicContact CE1-CD2 4.44Å; F360-L378 HydrophobicContact CE2-CD2 3.89Å; F360-L378 HydrophobicContact CZ-CD2 3.52Å; F360-L378 HydrophobicContact CZ-CG 4.17Å; I364-L378 HydrophobicContact CD1-CD2 3.93Å; I364-L378 HydrophobicContact CG1-CD2 4.25Å; F374-L378 HydrophobicContact CD1-CD2 4.5Å; F374-L378 HydrophobicContact CE1-CB 4.48Å; F374-L378 HydrophobicContact CE1-CD2 3.85Å; F374-L378 WeakPolarHBondContact O-CB 3.43Å; F374-L378 PolarHBondContact O-N 2.73Å; W375-L378 PolarHBondContact O-N 2.76Å; W375-L378 VanDerWaalsContact O-N 3.11Å; P376-L378 VanDerWaalsContact C-N 3.34Å; P376-L378 PolarHBondContact O-N 3.1Å; L378-M380 VanDerWaalsContact C-N 3.25Å; L378-M380 PolarHBondContact O-N 3.36Å; L378-K381 HydrophobicContact CD1-CG 4.35Å; L378-K381 WeakPolarHBondContact O-CB 3.18Å; L378-K381 WeakPolarHBondContact O-CG 3.26Å; L378-K381 PolarHBondContact O-N 2.98Å
379	L	95.6	Very high	93.6	Very high	54 Å²	54	61 Å²	61	28%	0.283	31%	0.314	S	S	.	.	H	α-helix	trans	-61.7	-33.5	178.7	-167.4	64.1	0	0	0	112.3	L357 W375 P376 K381 V382	L357-L379 HydrophobicContact CD2-CD1 3.77Å; W375-L379 HydrophobicContact CH2-CD1 4.33Å; W375-L379 HydrophobicContact CZ2-CD1 4.28Å; W375-L379 HydrophobicContact CZ2-CD2 4.49Å; W375-L379 PolarHBondContact O-N 3.1Å; P376-L379 PolarHBondContact O-N 2.93Å; L379-K381 PolarHBondContact O-N 3.36Å; L379-K381 VanDerWaalsContact O-N 3.16Å; L379-V382 HydrophobicContact CD1-CG2 4.16Å; L379-V382 VanDerWaalsContact O-CB 3.23Å; L379-V382 WeakPolarHBondContact O-CB 3.43Å; L379-V382 WeakPolarHBondContact O-CG2 3.37Å; L379-V382 PolarHBondContact O-N 2.8Å
380	M	96.6	Very high	94	Very high	106 Å²	106	59.4 Å²	59.4	52%	0.522	32%	0.317	S	S	.	.	H	α-helix	trans	-61.5	-20.4	172.6	-65.6	-61.2	90.2	0	0	113.8	P376 L378 V382 T383 D384	P376-M380 WeakPolarHBondContact O-CG 3.36Å; P376-M380 PolarHBondContact O-N 2.93Å; P376-M380 VanDerWaalsContact O-N 3.17Å; L378-M380 VanDerWaalsContact C-N 3.25Å; L378-M380 PolarHBondContact O-N 3.36Å; M380-V382 PolarHBondContact O-N 3.38Å; M380-T383 WeakPolarHBondContact O-CB 3.45Å; M380-T383 PolarHBondContact O-N 3.34Å; M380-T383 VanDerWaalsContact O-N 3.12Å; M380-D384 PolarHBondContact O-N 3.45Å
381	K	96.9	Very high	94.3	Very high	26 Å²	26	55.7 Å²	55.7	11%	0.113	30%	0.301	C	S	.	.	H	α-helix	trans	-68.1	-23	173.4	-57.4	-70.2	136.8	-156.3	0	112.3	L313 S316 L317 L378 L379 T383 D384 L385	L313-K381 HydrophobicContact CD1-CB 4.43Å; L313-K381 HydrophobicContact CD1-CD 3.73Å; S316-K381 WeakPolarHBondContact OG-CE 3.4Å; S316-K381 PolarHBondContact OG-NZ 3.4Å; L317-K381 HydrophobicContact CD2-CB 4.31Å; L317-K381 HydrophobicContact CD2-CD 3.91Å; L317-K381 HydrophobicContact CD2-CG 3.8Å; L317-K381 HydrophobicContact CG-CD 4.49Å; L378-K381 HydrophobicContact CD1-CG 4.35Å; L378-K381 WeakPolarHBondContact O-CB 3.18Å; L378-K381 WeakPolarHBondContact O-CG 3.26Å; L378-K381 PolarHBondContact O-N 2.98Å; L379-K381 PolarHBondContact O-N 3.36Å; L379-K381 VanDerWaalsContact O-N 3.16Å; K381-T383 VanDerWaalsContact C-N 3.32Å; K381-D384 WeakPolarHBondContact CD-OD2 3.4Å; K381-D384 WeakPolarHBondContact CE-OD2 3.49Å; K381-D384 IonicContact NZ-OD2 3.91Å; K381-D384 PolarHBondContact NZ-OD2 2.96Å; K381-D384 PolarHBondContact O-N 3.31Å; K381-L385 WeakPolarHBondContact O-CG 3.34Å; K381-L385 PolarHBondContact O-N 3.37Å; K381-L385 VanDerWaalsContact O-N 3.08Å
382	V	96.4	Very high	94.7	Very high	20 Å²	20	52.3 Å²	52.3	12%	0.121	28%	0.283	C	S	.	.	H	α-helix	trans	-61.3	-44.7	169.8	177.6	0	0	0	0	109.7	L330 V333 L334 L379 M380 D384 L385 R386	L330-V382 HydrophobicContact CD1-CG2 3.46Å; L330-V382 VanDerWaalsContact CD1-CG2 3.46Å; V333-V382 HydrophobicContact CG1-CG2 4.45Å; L334-V382 HydrophobicContact CD2-CG1 3.92Å; L379-V382 HydrophobicContact CD1-CG2 4.16Å; L379-V382 VanDerWaalsContact O-CB 3.23Å; L379-V382 WeakPolarHBondContact O-CB 3.43Å; L379-V382 WeakPolarHBondContact O-CG2 3.37Å; L379-V382 PolarHBondContact O-N 2.8Å; M380-V382 PolarHBondContact O-N 3.38Å; V382-D384 PolarHBondContact O-N 3.3Å; V382-L385 WeakPolarHBondContact O-CB 3.19Å; V382-L385 PolarHBondContact O-N 3.44Å; V382-R386 HydrophobicContact CG1-CG 4.43Å; V382-R386 WeakPolarHBondContact O-CG 3.4Å; V382-R386 PolarHBondContact O-N 2.94Å
383	T	95.4	Very high	95	Very high	75 Å²	75	50.6 Å²	50.6	46%	0.46	28%	0.276	S	S	.	.	H	α-helix	trans	-61.3	-45.3	177.8	-49.8	0	0	0	0	111.7	M380 K381 L385 R386 M387	M380-T383 WeakPolarHBondContact O-CB 3.45Å; M380-T383 PolarHBondContact O-N 3.34Å; M380-T383 VanDerWaalsContact O-N 3.12Å; K381-T383 VanDerWaalsContact C-N 3.32Å; T383-L385 VanDerWaalsContact C-N 3.26Å; T383-L385 PolarHBondContact O-N 3.43Å; T383-R386 PolarHBondContact O-N 3.37Å; T383-M387 WeakPolarHBondContact O-CG 3.46Å; T383-M387 PolarHBondContact O-N 2.95Å
384	D	96.7	Very high	95.2	Very high	64 Å²	64	47.6 Å²	47.6	34%	0.342	27%	0.27	S	S	.	.	H	α-helix	trans	-56.2	-43.1	175.2	-63.7	-24	0	0	0	111.2	L313 M380 K381 V382 M387 I388	L313-D384 HydrophobicContact CD1-CB 4.18Å; M380-D384 PolarHBondContact O-N 3.45Å; K381-D384 WeakPolarHBondContact CD-OD2 3.4Å; K381-D384 WeakPolarHBondContact CE-OD2 3.49Å; K381-D384 IonicContact NZ-OD2 3.91Å; K381-D384 PolarHBondContact NZ-OD2 2.96Å; K381-D384 PolarHBondContact O-N 3.31Å; V382-D384 PolarHBondContact O-N 3.3Å; D384-M387 PolarHBondContact O-N 3.35Å; D384-I388 WeakPolarHBondContact O-CG1 3.48Å; D384-I388 PolarHBondContact O-N 3.32Å
385	L	97.8	Very high	95.2	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-68	-41.4	178.8	-75.4	165.8	0	0	0	113.1	E268 L272 L313 L330 L334 K381 V382 T383 M387 I388 G389	E268-L385 HydrophobicContact CB-CB 4.42Å; E268-L385 WeakPolarHBondContact O-CD2 3.31Å; L272-L385 HydrophobicContact CB-CD1 4.04Å; L272-L385 HydrophobicContact CB-CD2 3.97Å; L272-L385 HydrophobicContact CD1-CD1 4.2Å; L272-L385 HydrophobicContact CD2-CD1 4.27Å; L272-L385 HydrophobicContact CG-CD1 4.4Å; L313-L385 HydrophobicContact CD2-CD2 3.35Å; L313-L385 HydrophobicContact CD2-CG 3.8Å; L330-L385 HydrophobicContact CD2-CD1 4.29Å; L334-L385 HydrophobicContact CD1-CD1 3.6Å; L334-L385 HydrophobicContact CD2-CB 4.02Å; L334-L385 HydrophobicContact CD2-CD1 4.34Å; K381-L385 WeakPolarHBondContact O-CG 3.34Å; K381-L385 PolarHBondContact O-N 3.37Å; K381-L385 VanDerWaalsContact O-N 3.08Å; V382-L385 WeakPolarHBondContact O-CB 3.19Å; V382-L385 PolarHBondContact O-N 3.44Å; T383-L385 VanDerWaalsContact C-N 3.26Å; T383-L385 PolarHBondContact O-N 3.43Å; L385-M387 VanDerWaalsContact C-N 3.29Å; L385-M387 PolarHBondContact O-N 3.44Å; L385-I388 HydrophobicContact CD2-CD1 4.42Å; L385-I388 WeakPolarHBondContact O-CB 3.5Å; L385-I388 PolarHBondContact O-N 3.41Å; L385-G389 PolarHBondContact O-N 3.04Å
386	R	95.6	Very high	95.1	Very high	50 Å²	50	47.4 Å²	47.4	19%	0.189	27%	0.269	C	S	.	.	H	α-helix	trans	-60	-41.2	173.5	-64.8	-45.9	-161.3	85	14.2	111.5	E268 S337 D339 V382 T383 G389 A390	E268-R386 VanDerWaalsContact CD-CD 3.41Å; E268-R386 WeakPolarHBondContact OE1-CD 3.5Å; E268-R386 IonicContact OE1-NE 2.8Å; E268-R386 VanDerWaalsContact OE2-CD 3.23Å; E268-R386 WeakPolarHBondContact OE2-CD 3.24Å; E268-R386 IonicContact OE2-NE 2.87Å; S337-R386 PolarHBondContact OG-NH2 2.97Å; D339-R386 VanDerWaalsContact CG-NH1 3.27Å; D339-R386 IonicContact OD1-CZ 3.91Å; D339-R386 IonicContact OD1-NH1 3.95Å; D339-R386 PolarHBondContact OD1-NH1 3.47Å; D339-R386 IonicContact OD1-NH2 2.76Å; D339-R386 PolarHBondContact OD1-NH2 3.46Å; D339-R386 IonicContact OD2-CZ 3.95Å; D339-R386 IonicContact OD2-NH1 3.8Å; D339-R386 PolarHBondContact OD2-NH1 2.93Å; D339-R386 IonicContact OD2-NH2 2.73Å; V382-R386 HydrophobicContact CG1-CG 4.43Å; V382-R386 WeakPolarHBondContact O-CG 3.4Å; V382-R386 PolarHBondContact O-N 2.94Å; T383-R386 PolarHBondContact O-N 3.37Å; R386-G389 PolarHBondContact O-N 2.9Å; R386-A390 PolarHBondContact O-N 3.48Å
387	M	95.6	Very high	94.9	Very high	112 Å²	112	49.9 Å²	49.9	55%	0.552	28%	0.279	S	S	*	.	H	α-helix	trans	-63.8	-42.2	176.1	-70.2	-56	-56.5	0	0	111.9	T383 D384 L385 G389 A390 C391	T383-M387 WeakPolarHBondContact O-CG 3.46Å; T383-M387 PolarHBondContact O-N 2.95Å; D384-M387 PolarHBondContact O-N 3.35Å; L385-M387 VanDerWaalsContact C-N 3.29Å; L385-M387 PolarHBondContact O-N 3.44Å; M387-G389 VanDerWaalsContact C-N 3.31Å; M387-G389 PolarHBondContact O-N 2.97Å; M387-A390 PolarHBondContact O-N 2.91Å; M387-C391 WeakPolarHBondContact O-CB 3.42Å; M387-C391 PolarHBondContact O-N 3.46Å; M387-C391 PolarHBondContact O-SG 3.42Å
388	I	97.2	Very high	94.7	Very high	5 Å²	5	48.5 Å²	48.5	3%	0.026	27%	0.274	C	S	.	.	H	α-helix	trans	-58	-44.6	173.5	-71.7	165.6	0	0	0	110.9	M267 S271 V306 A309 I310 L313 D384 L385 C391 H392	M267-I388 HydrophobicContact CE-CG2 4.48Å; S271-I388 WeakPolarHBondContact OG-CG2 3.43Å; V306-I388 HydrophobicContact CG1-CG2 3.93Å; A309-I388 HydrophobicContact CB-CD1 4.18Å; A309-I388 HydrophobicContact CB-CG1 3.65Å; I310-I388 HydrophobicContact CG1-CD1 4.26Å; I310-I388 HydrophobicContact CG1-CG2 4.06Å; L313-I388 HydrophobicContact CB-CD1 4.33Å; L313-I388 HydrophobicContact CD2-CD1 3.89Å; D384-I388 WeakPolarHBondContact O-CG1 3.48Å; D384-I388 PolarHBondContact O-N 3.32Å; L385-I388 HydrophobicContact CD2-CD1 4.42Å; L385-I388 WeakPolarHBondContact O-CB 3.5Å; L385-I388 PolarHBondContact O-N 3.41Å; I388-C391 PolarHBondContact O-N 3.26Å; I388-H392 WeakPolarHBondContact O-CB 3.13Å; I388-H392 PolarHBondContact O-N 3.06Å
389	G	95.4	Very high	94.4	Very high	14 Å²	14	48.7 Å²	48.7	14%	0.144	28%	0.275	C	S	.	.	H	α-helix	trans	-57.9	-48.5	175.9	0	0	0	0	0	112.7	L385 R386 M387 H392 A393	L385-G389 PolarHBondContact O-N 3.04Å; R386-G389 PolarHBondContact O-N 2.9Å; M387-G389 VanDerWaalsContact C-N 3.31Å; M387-G389 PolarHBondContact O-N 2.97Å; G389-H392 PolarHBondContact O-N 3.19Å; G389-A393 PolarHBondContact O-N 3.3Å; G389-A393 VanDerWaalsContact O-N 3.08Å
390	A	93.4	Very high	94.1	Very high	61 Å²	61	48.8 Å²	48.8	50%	0.504	27%	0.273	S	S	.	.	H	α-helix	trans	-63.8	-44.1	177.9	0	0	0	0	0	112.7	R386 M387 H392 A393 S394	R386-A390 PolarHBondContact O-N 3.48Å; M387-A390 PolarHBondContact O-N 2.91Å; A390-H392 VanDerWaalsContact C-N 3.3Å; A390-H392 PolarHBondContact O-N 3.11Å; A390-A393 PolarHBondContact O-N 3.3Å; A390-S394 PolarHBondContact O-N 3.4Å
391	C	94.8	Very high	93.8	Very high	54 Å²	54	49.9 Å²	49.9	37%	0.365	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-36.7	176	-69.7	0	0	0	0	112	V306 M387 I388 S394 R395	V306-C391 HydrophobicContact CG2-CB 4.06Å; M387-C391 WeakPolarHBondContact O-CB 3.42Å; M387-C391 PolarHBondContact O-N 3.46Å; M387-C391 PolarHBondContact O-SG 3.42Å; I388-C391 PolarHBondContact O-N 3.26Å; C391-S394 PolarHBondContact O-N 2.96Å; C391-R395 WeakPolarHBondContact O-CB 3.4Å; C391-R395 PolarHBondContact O-N 3.31Å
392	H	95.5	Very high	93.5	Very high	4 Å²	4	51.8 Å²	51.8	2%	0.019	30%	0.295	C	S	.	.	H	α-helix	trans	-64.8	-42.2	175.3	175.4	-96.7	0	0	0	112.6	M267 V306 I388 G389 A390 S394 R395 F396 F416	M267-H392 HydrophobicContact CE-CB 4.08Å; M267-H392 HydrophobicContact CG-CB 3.65Å; M267-H392 HydrophobicContact SD-CB 4.43Å; V306-H392 HydrophobicContact CG1-CB 4.33Å; V306-H392 HydrophobicContact CG2-CB 4.42Å; I388-H392 WeakPolarHBondContact O-CB 3.13Å; I388-H392 PolarHBondContact O-N 3.06Å; G389-H392 PolarHBondContact O-N 3.19Å; A390-H392 VanDerWaalsContact C-N 3.3Å; A390-H392 PolarHBondContact O-N 3.11Å; H392-S394 VanDerWaalsContact C-N 3.29Å; H392-S394 PolarHBondContact O-N 3.03Å; H392-R395 CarbonylContact O-C 3.58Å; H392-R395 PolarHBondContact O-N 2.97Å; H392-R395 VanDerWaalsContact O-N 3.1Å; H392-F396 WeakPolarHBondContact O-CB 3.41Å; H392-F396 PolarHBondContact O-N 3.44Å; H392-F416 AromaticContact CE1-CD1 3.65Å; H392-F416 AromaticContact CE1-CE1 3.88Å; H392-F416 AromaticContact CE1-CG 3.81Å; H392-F416 AromaticContact ND1-CD1 3.9Å
393	A	92.4	Very high	93.1	Very high	48 Å²	48	51.2 Å²	51.2	40%	0.397	29%	0.291	S	S	.	.	H	α-helix	trans	-56.7	-44.9	176.5	0	0	0	0	0	111.4	G389 A390 F396	G389-A393 PolarHBondContact O-N 3.3Å; G389-A393 VanDerWaalsContact O-N 3.08Å; A390-A393 PolarHBondContact O-N 3.3Å; A393-F396 PolarHBondContact O-N 3.11Å
394	S	91.3	Very high	92.9	Very high	70 Å²	70	50.4 Å²	50.4	49%	0.49	29%	0.287	S	S	.	.	H	α-helix	trans	-63.6	-44.8	173.3	175.6	0	0	0	0	112.2	A390 C391 H392 F396 L397 H398	A390-S394 PolarHBondContact O-N 3.4Å; C391-S394 PolarHBondContact O-N 2.96Å; H392-S394 VanDerWaalsContact C-N 3.29Å; H392-S394 PolarHBondContact O-N 3.03Å; S394-F396 VanDerWaalsContact C-N 3.29Å; S394-F396 PolarHBondContact O-N 3.37Å; S394-L397 PolarHBondContact O-N 3.12Å; S394-H398 PolarHBondContact O-CD2 2.9Å
395	R	93.1	Very high	92.5	Very high	34 Å²	34	52.5 Å²	52.5	13%	0.128	30%	0.299	C	S	.	.	H	α-helix	trans	-64.7	-32.2	179.8	-178.7	58.6	-173.3	150.2	9.9	112.9	V218 G302 V306 C391 H392 L397 H398 M399 E402	V218-R395 VanDerWaalsContact CG2-NH2 3.31Å; G302-R395 PolarHBondContact O-NE 3.3Å; G302-R395 PolarHBondContact O-NH2 3.41Å; V306-R395 HydrophobicContact CG2-CB 3.9Å; V306-R395 HydrophobicContact CG2-CG 4.32Å; C391-R395 WeakPolarHBondContact O-CB 3.4Å; C391-R395 PolarHBondContact O-N 3.31Å; H392-R395 CarbonylContact O-C 3.58Å; H392-R395 PolarHBondContact O-N 2.97Å; H392-R395 VanDerWaalsContact O-N 3.1Å; R395-L397 VanDerWaalsContact C-N 3.28Å; R395-L397 PolarHBondContact O-N 3.02Å; R395-H398 VanDerWaalsContact NH1-CB 3.3Å; R395-H398 WeakPolarHBondContact O-CB 3.3Å; R395-H398 PolarHBondContact O-N 3.29Å; R395-H398 VanDerWaalsContact O-N 3.1Å; R395-M399 HydrophobicContact CG-CG 4.37Å; R395-M399 PolarHBondContact O-N 3.23Å; R395-E402 IonicContact CZ-OE2 2.93Å; R395-E402 VanDerWaalsContact CZ-OE2 3.26Å; R395-E402 IonicContact NH1-OE1 2.73Å; R395-E402 PolarHBondContact NH1-OE1 2.9Å; R395-E402 VanDerWaalsContact NH1-OE1 3.14Å; R395-E402 IonicContact NH1-OE2 2.58Å; R395-E402 PolarHBondContact NH1-OE2 3.23Å; R395-E402 IonicContact NH2-OE2 2.81Å; R395-E402 PolarHBondContact NH2-OE2 3.33Å
396	F	92.5	Very high	92.1	Very high	7 Å²	7	61.4 Å²	61.4	3%	0.031	34%	0.34	C	S	.	.	H	α-helix	trans	-59.5	-37.9	178.6	175.2	-98.6	0	0	0	112.7	H392 A393 S394 H398 M399 K400 F408 F412 L413 F416 E417	H392-F396 WeakPolarHBondContact O-CB 3.41Å; H392-F396 PolarHBondContact O-N 3.44Å; A393-F396 PolarHBondContact O-N 3.11Å; S394-F396 VanDerWaalsContact C-N 3.29Å; S394-F396 PolarHBondContact O-N 3.37Å; F396-H398 VanDerWaalsContact C-N 3.32Å; F396-H398 PolarHBondContact O-N 3.46Å; F396-M399 HydrophobicContact CB-CE 4.01Å; F396-M399 HydrophobicContact CD2-CE 4.07Å; F396-M399 PolarHBondContact O-N 3.26Å; F396-K400 HydrophobicContact CE1-CD 4.12Å; F396-K400 HydrophobicContact CE1-CG 4.28Å; F396-K400 HydrophobicContact CZ-CD 4.25Å; F396-K400 HydrophobicContact CZ-CG 4.25Å; F396-K400 PolarHBondContact O-N 3.17Å; F396-F408 HydrophobicContact CE2-CE1 4.41Å; F396-F412 AromaticContact CD2-CE1 3.64Å; F396-F412 HydrophobicContact CD2-CE1 3.64Å; F396-F412 AromaticContact CD2-CZ 3.83Å; F396-F412 HydrophobicContact CD2-CZ 3.83Å; F396-F412 AromaticContact CE2-CD1 3.97Å; F396-F412 HydrophobicContact CE2-CD1 3.97Å; F396-F412 AromaticContact CE2-CE1 3.35Å; F396-F412 HydrophobicContact CE2-CE1 3.35Å; F396-F412 AromaticContact CE2-CZ 3.98Å; F396-F412 HydrophobicContact CE2-CZ 3.98Å; F396-L413 HydrophobicContact CE2-CD2 4.22Å; F396-L413 HydrophobicContact CZ-CD2 3.87Å; F396-F416 HydrophobicContact CD2-CB 4.11Å; F396-F416 HydrophobicContact CE2-CB 4.04Å; F396-F416 HydrophobicContact CG-CB 4.41Å; F396-F416 HydrophobicContact CZ-CB 4.28Å; F396-E417 HydrophobicContact CE1-CB 4.18Å; F396-E417 HydrophobicContact CZ-CB 4.2Å
397	L	90.6	Very high	91.9	Very high	117 Å²	117	61.3 Å²	61.3	61%	0.613	34%	0.343	S	S	*	.	H	α-helix	trans	-61.1	-40.3	174.5	-61.2	177.5	0	0	0	112.2	S394 R395 K400	S394-L397 PolarHBondContact O-N 3.12Å; R395-L397 VanDerWaalsContact C-N 3.28Å; R395-L397 PolarHBondContact O-N 3.02Å; L397-K400 PolarHBondContact O-N 3.05Å
398	H	89.6	Confident	91.7	Very high	97 Å²	97	56.4 Å²	56.4	45%	0.449	32%	0.319	S	S	.	.	H	α-helix	trans	-68.2	-41.6	175.2	-68.6	-85.6	0	0	0	112.1	S394 R395 F396 K400 V401 E402	S394-H398 PolarHBondContact O-CD2 2.9Å; R395-H398 VanDerWaalsContact NH1-CB 3.3Å; R395-H398 WeakPolarHBondContact O-CB 3.3Å; R395-H398 PolarHBondContact O-N 3.29Å; R395-H398 VanDerWaalsContact O-N 3.1Å; F396-H398 VanDerWaalsContact C-N 3.32Å; F396-H398 PolarHBondContact O-N 3.46Å; H398-K400 PolarHBondContact O-N 3.05Å; H398-V401 PolarHBondContact O-N 3.24Å; H398-E402 WeakPolarHBondContact O-CG 3.36Å; H398-E402 PolarHBondContact O-N 3.36Å
399	M	90.1	Very high	91.6	Very high	4 Å²	4	57 Å²	57	2%	0.02	32%	0.323	C	S	.	.	H	α-helix	trans	-57.2	-40	175.8	-69.4	-170.3	-72.2	0	0	111.4	F223 G302 R395 F396 V401 E402 C403 F408 F412	F223-M399 HydrophobicContact CE2-SD 4.15Å; G302-M399 WeakPolarHBondContact O-CG 3.48Å; R395-M399 HydrophobicContact CG-CG 4.37Å; R395-M399 PolarHBondContact O-N 3.23Å; F396-M399 HydrophobicContact CB-CE 4.01Å; F396-M399 HydrophobicContact CD2-CE 4.07Å; F396-M399 PolarHBondContact O-N 3.26Å; M399-V401 PolarHBondContact O-N 3.17Å; M399-E402 PolarHBondContact O-N 2.94Å; M399-C403 VanDerWaalsContact O-CB 3.3Å; M399-C403 WeakPolarHBondContact O-CB 3.43Å; M399-C403 PolarHBondContact O-N 3.05Å; M399-F408 HydrophobicContact CB-CE1 4.23Å; M399-F408 HydrophobicContact CB-CZ 4.08Å; M399-F408 WeakPolarHBondContact O-CZ 3.49Å; M399-F412 HydrophobicContact CE-CZ 4.28Å
400	K	90.4	Very high	91.5	Very high	56 Å²	56	61.6 Å²	61.6	24%	0.243	35%	0.35	C	S	.	.	H	α-helix	trans	-62.6	-26.6	176.8	-84	-155	162.2	-151.9	0	114.3	F396 L397 H398 E417	F396-K400 HydrophobicContact CE1-CD 4.12Å; F396-K400 HydrophobicContact CE1-CG 4.28Å; F396-K400 HydrophobicContact CZ-CD 4.25Å; F396-K400 HydrophobicContact CZ-CG 4.25Å; F396-K400 PolarHBondContact O-N 3.17Å; L397-K400 PolarHBondContact O-N 3.05Å; H398-K400 PolarHBondContact O-N 3.05Å; K400-E417 IonicContact NZ-OE1 3.39Å; K400-E417 PolarHBondContact NZ-OE1 2.8Å; K400-E417 IonicContact NZ-OE2 3.28Å; K400-E417 PolarHBondContact NZ-OE2 3.46Å
401	V	90.3	Very high	91.5	Very high	129 Å²	129	60.9 Å²	60.9	78%	0.782	34%	0.338	S	S	*	.	H	α-helix	trans	-85.5	-39.4	177.1	178.5	0	0	0	0	110.8	H398 M399	H398-V401 PolarHBondContact O-N 3.24Å; M399-V401 PolarHBondContact O-N 3.17Å
402	E	88.8	Confident	91.5	Very high	67 Å²	67	58.7 Å²	58.7	31%	0.313	32%	0.322	S	S	.	.	H	α-helix	trans	-83.2	-27.1	-172.7	-68.6	162.5	-164.4	0	0	113.4	V218 R395 H398 M399	V218-E402 HydrophobicContact CG2-CB 3.99Å; V218-E402 WeakPolarHBondContact CG2-OE2 3.44Å; R395-E402 IonicContact CZ-OE2 2.93Å; R395-E402 VanDerWaalsContact CZ-OE2 3.26Å; R395-E402 IonicContact NH1-OE1 2.73Å; R395-E402 PolarHBondContact NH1-OE1 2.9Å; R395-E402 VanDerWaalsContact NH1-OE1 3.14Å; R395-E402 IonicContact NH1-OE2 2.58Å; R395-E402 PolarHBondContact NH1-OE2 3.23Å; R395-E402 IonicContact NH2-OE2 2.81Å; R395-E402 PolarHBondContact NH2-OE2 3.33Å; H398-E402 WeakPolarHBondContact O-CG 3.36Å; H398-E402 PolarHBondContact O-N 3.36Å; M399-E402 PolarHBondContact O-N 2.94Å
403	C	89.8	Confident	91.4	Very high	7 Å²	7	60.2 Å²	60.2	5%	0.047	33%	0.33	C	S	.	.	S	Bend	trans	-112.7	145.1	-174.3	-62.4	0	0	0	0	112.8	V218 L220 F223 M399 N405 F408	V218-C403 VanDerWaalsContact CG1-SG 3.6Å; L220-C403 HydrophobicContact CD2-CB 4.45Å; F223-C403 HydrophobicContact CD1-CB 4.21Å; F223-C403 HydrophobicContact CE1-CB 3.8Å; F223-C403 HydrophobicContact CZ-CB 4.16Å; M399-C403 VanDerWaalsContact O-CB 3.3Å; M399-C403 WeakPolarHBondContact O-CB 3.43Å; M399-C403 PolarHBondContact O-N 3.05Å; C403-N405 PolarHBondContact O-N 3.16Å; C403-F408 HydrophobicContact CB-CE2 3.66Å; C403-F408 HydrophobicContact CB-CZ 3.81Å
404	P	89.9	Confident	91.5	Very high	59 Å²	59	63.6 Å²	63.6	38%	0.383	34%	0.338	S	S	.	.			trans	-59.3	133.6	170.7	-22.4	31.9	0	0	0	112.6	E406 L407 F408	P404-E406 PolarHBondContact O-N 3.44Å; P404-E406 VanDerWaalsContact O-N 3.11Å; P404-L407 HydrophobicContact CB-CG 4.39Å; P404-L407 HydrophobicContact CG-CD1 4.25Å; P404-L407 PolarHBondContact O-N 3.14Å; P404-F408 WeakPolarHBondContact O-CD2 3.25Å
405	N	88.3	Confident	91.6	Very high	108 Å²	108	61.2 Å²	61.2	58%	0.578	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-55.1	-31.4	179.4	-79.5	-25.9	0	0	0	113.6	C403 L407 F408	C403-N405 PolarHBondContact O-N 3.16Å; N405-L407 PolarHBondContact O-N 2.77Å; N405-F408 PolarHBondContact O-N 3.02Å; N405-F408 VanDerWaalsContact O-N 3.17Å
406	E	89.5	Confident	91.6	Very high	187 Å²	187	61 Å²	61	87%	0.874	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-64.6	-22.7	-179.7	-63.7	166.6	-174.2	0	0	113.6	P404 F408	P404-E406 PolarHBondContact O-N 3.44Å; P404-E406 VanDerWaalsContact O-N 3.11Å; E406-F408 VanDerWaalsContact C-N 3.33Å
407	L	90.7	Very high	91.3	Very high	48 Å²	48	64.4 Å²	64.4	25%	0.251	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-80.2	-16.6	178.6	-65.2	-177.9	0	0	0	112.6	L220 F223 T227 P404 N405 P409	L220-L407 HydrophobicContact CD2-CD1 4.31Å; F223-L407 HydrophobicContact CD1-CB 4Å; F223-L407 HydrophobicContact CD1-CD1 3.88Å; F223-L407 HydrophobicContact CE1-CB 3.69Å; F223-L407 HydrophobicContact CE1-CD1 4.32Å; T227-L407 WeakPolarHBondContact CB-O 3.4Å; T227-L407 WeakPolarHBondContact CG2-O 3.34Å; T227-L407 PolarHBondContact OG1-O 3.39Å; P404-L407 HydrophobicContact CB-CG 4.39Å; P404-L407 HydrophobicContact CG-CD1 4.25Å; P404-L407 PolarHBondContact O-N 3.14Å; N405-L407 PolarHBondContact O-N 2.77Å; L407-P409 WeakPolarHBondContact O-CD 3.31Å
408	F	92.8	Very high	90.6	Very high	9 Å²	9	67 Å²	67	4%	0.039	35%	0.345	C	S	.	.	S	Bend	trans	-82.4	120.9	-178.9	-67.8	-93.4	0	0	0	110.9	F223 F396 M399 C403 P404 N405 E406 F412 L413	F223-F408 HydrophobicContact CE1-CE1 4.48Å; F223-F408 HydrophobicContact CE1-CE2 4.33Å; F223-F408 HydrophobicContact CE1-CZ 4.28Å; F223-F408 HydrophobicContact CE2-CE1 4.43Å; F223-F408 HydrophobicContact CZ-CD1 4.02Å; F223-F408 AromaticContact CZ-CE1 3.61Å; F223-F408 HydrophobicContact CZ-CE1 3.61Å; F223-F408 HydrophobicContact CZ-CE2 4.19Å; F223-F408 HydrophobicContact CZ-CG 4.48Å; F223-F408 AromaticContact CZ-CZ 3.71Å; F223-F408 HydrophobicContact CZ-CZ 3.71Å; F396-F408 HydrophobicContact CE2-CE1 4.41Å; M399-F408 HydrophobicContact CB-CE1 4.23Å; M399-F408 HydrophobicContact CB-CZ 4.08Å; M399-F408 WeakPolarHBondContact O-CZ 3.49Å; C403-F408 HydrophobicContact CB-CE2 3.66Å; C403-F408 HydrophobicContact CB-CZ 3.81Å; P404-F408 WeakPolarHBondContact O-CD2 3.25Å; N405-F408 PolarHBondContact O-N 3.02Å; N405-F408 VanDerWaalsContact O-N 3.17Å; E406-F408 VanDerWaalsContact C-N 3.33Å; F408-F412 AromaticContact CD1-CD1 3.73Å; F408-F412 HydrophobicContact CD1-CD1 3.73Å; F408-F412 AromaticContact CD1-CE1 3.61Å; F408-F412 HydrophobicContact CD1-CE1 3.61Å; F408-F412 HydrophobicContact CE1-CD1 4.5Å; F408-F412 AromaticContact CE1-CE1 3.94Å; F408-F412 HydrophobicContact CE1-CE1 3.94Å; F408-L413 HydrophobicContact CB-CD1 3.99Å; F408-L413 HydrophobicContact CB-CD2 3.77Å; F408-L413 HydrophobicContact CB-CG 3.84Å; F408-L413 HydrophobicContact CD1-CD2 4.07Å; F408-L413 HydrophobicContact CG-CD2 4.04Å
409	P	94.2	Very high	89	Confident	18 Å²	18	69.6 Å²	69.6	12%	0.117	36%	0.357	C	S	.	.			trans	-64.9	142.3	176.3	-24.3	37.3	0	0	0	111.4	T227 I230 T231 L407 L411 F412 L413	T227-P409 WeakPolarHBondContact O-CG 3.07Å; I230-P409 HydrophobicContact CG2-CB 4.41Å; I230-P409 HydrophobicContact CG2-CG 3.73Å; T231-P409 VanDerWaalsContact OG1-CB 3.25Å; T231-P409 WeakPolarHBondContact OG1-CB 3.49Å; L407-P409 WeakPolarHBondContact O-CD 3.31Å; P409-L411 VanDerWaalsContact C-N 3.32Å; P409-L411 PolarHBondContact O-N 3.28Å; P409-F412 HydrophobicContact CB-CB 4.23Å; P409-F412 HydrophobicContact CG-CB 4.49Å; P409-F412 WeakPolarHBondContact O-CA 3.46Å; P409-F412 VanDerWaalsContact O-CB 3.31Å; P409-F412 WeakPolarHBondContact O-CB 3.37Å; P409-F412 PolarHBondContact O-N 3.46Å; P409-L413 PolarHBondContact O-N 2.83Å; P409-L413 VanDerWaalsContact O-N 3.17Å
410	P	94.3	Very high	86.7	Confident	110 Å²	110	78.8 Å²	78.8	71%	0.714	40%	0.4	S	S	*	.	H	α-helix	trans	-54.9	-43.5	-177.4	-29	35.1	0	0	0	113.9	F412 L413 E414	P410-F412 VanDerWaalsContact C-N 3.27Å; P410-F412 PolarHBondContact O-N 2.86Å; P410-L413 PolarHBondContact O-N 2.86Å; P410-E414 PolarHBondContact O-N 2.94Å
411	L	93.6	Very high	84	Confident	46 Å²	46	86 Å²	86	24%	0.241	45%	0.449	C	S	.	.	H	α-helix	trans	-65	-31.4	178	-176.6	63.1	0	0	0	112.5	T231 I234 P409 V415	T231-L411 HydrophobicContact CG2-CB 4.32Å; T231-L411 HydrophobicContact CG2-CD2 3.92Å; I234-L411 HydrophobicContact CB-CD2 4.04Å; I234-L411 HydrophobicContact CB-CG 4.49Å; I234-L411 HydrophobicContact CD1-CG 4.41Å; I234-L411 HydrophobicContact CG2-CD1 4.47Å; I234-L411 HydrophobicContact CG2-CD2 3.71Å; I234-L411 HydrophobicContact CG2-CG 3.92Å; P409-L411 VanDerWaalsContact C-N 3.32Å; P409-L411 PolarHBondContact O-N 3.28Å; L411-V415 HydrophobicContact CD1-CG2 4.27Å; L411-V415 WeakPolarHBondContact O-CB 3.31Å; L411-V415 VanDerWaalsContact O-CG2 3.29Å; L411-V415 WeakPolarHBondContact O-CG2 3.29Å; L411-V415 PolarHBondContact O-N 3Å; L411-V415 VanDerWaalsContact O-N 3.14Å
412	F	94.1	Very high	83.7	Confident	8 Å²	8	83.9 Å²	83.9	4%	0.035	43%	0.432	C	S	.	.	H	α-helix	trans	-67.7	-43.5	176.3	177.8	-101	0	0	0	110.7	I230 I234 F396 M399 F408 P409 P410 V415 F416	I230-F412 HydrophobicContact CD1-CD2 3.26Å; I230-F412 HydrophobicContact CD1-CE2 3.23Å; I230-F412 HydrophobicContact CD1-CG 4.24Å; I230-F412 HydrophobicContact CD1-CZ 4.17Å; I230-F412 HydrophobicContact CG1-CD2 3.79Å; I230-F412 HydrophobicContact CG1-CE2 4.21Å; I230-F412 HydrophobicContact CG2-CB 4.17Å; I230-F412 HydrophobicContact CG2-CD2 4.26Å; I230-F412 HydrophobicContact CG2-CG 4.42Å; I234-F412 HydrophobicContact CD1-CB 4.21Å; I234-F412 HydrophobicContact CD1-CD2 4.21Å; F396-F412 AromaticContact CD2-CE1 3.64Å; F396-F412 HydrophobicContact CD2-CE1 3.64Å; F396-F412 AromaticContact CD2-CZ 3.83Å; F396-F412 HydrophobicContact CD2-CZ 3.83Å; F396-F412 AromaticContact CE2-CD1 3.97Å; F396-F412 HydrophobicContact CE2-CD1 3.97Å; F396-F412 AromaticContact CE2-CE1 3.35Å; F396-F412 HydrophobicContact CE2-CE1 3.35Å; F396-F412 AromaticContact CE2-CZ 3.98Å; F396-F412 HydrophobicContact CE2-CZ 3.98Å; M399-F412 HydrophobicContact CE-CZ 4.28Å; F408-F412 AromaticContact CD1-CD1 3.73Å; F408-F412 HydrophobicContact CD1-CD1 3.73Å; F408-F412 AromaticContact CD1-CE1 3.61Å; F408-F412 HydrophobicContact CD1-CE1 3.61Å; F408-F412 HydrophobicContact CE1-CD1 4.5Å; F408-F412 AromaticContact CE1-CE1 3.94Å; F408-F412 HydrophobicContact CE1-CE1 3.94Å; P409-F412 HydrophobicContact CB-CB 4.23Å; P409-F412 HydrophobicContact CG-CB 4.49Å; P409-F412 WeakPolarHBondContact O-CA 3.46Å; P409-F412 VanDerWaalsContact O-CB 3.31Å; P409-F412 WeakPolarHBondContact O-CB 3.37Å; P409-F412 PolarHBondContact O-N 3.46Å; P410-F412 VanDerWaalsContact C-N 3.27Å; P410-F412 PolarHBondContact O-N 2.86Å; F412-V415 PolarHBondContact O-N 3.31Å; F412-F416 AromaticContact CD2-CD2 3.33Å; F412-F416 HydrophobicContact CD2-CD2 3.33Å; F412-F416 AromaticContact CD2-CE2 3.52Å; F412-F416 HydrophobicContact CD2-CE2 3.52Å; F412-F416 AromaticContact CE2-CD2 3.26Å; F412-F416 HydrophobicContact CE2-CD2 3.26Å; F412-F416 AromaticContact CE2-CE2 3.48Å; F412-F416 HydrophobicContact CE2-CE2 3.48Å; F412-F416 VanDerWaalsContact CE2-CE2 3.48Å; F412-F416 HydrophobicContact CE2-CG 4.25Å; F412-F416 HydrophobicContact CG-CD2 4.04Å; F412-F416 AromaticContact CZ-CD2 3.97Å; F412-F416 HydrophobicContact CZ-CD2 3.97Å; F412-F416 WeakPolarHBondContact O-CD2 3.31Å; F412-F416 PolarHBondContact O-N 2.94Å
413	L	94	Very high	83.4	Confident	36 Å²	36	84.8 Å²	84.8	19%	0.188	44%	0.439	C	S	.	.	H	α-helix	trans	-63	-47.3	173.5	-63.6	177.5	0	0	0	111	F396 F408 P409 P410 V415 F416 E417	F396-L413 HydrophobicContact CE2-CD2 4.22Å; F396-L413 HydrophobicContact CZ-CD2 3.87Å; F408-L413 HydrophobicContact CB-CD1 3.99Å; F408-L413 HydrophobicContact CB-CD2 3.77Å; F408-L413 HydrophobicContact CB-CG 3.84Å; F408-L413 HydrophobicContact CD1-CD2 4.07Å; F408-L413 HydrophobicContact CG-CD2 4.04Å; P409-L413 PolarHBondContact O-N 2.83Å; P409-L413 VanDerWaalsContact O-N 3.17Å; P410-L413 PolarHBondContact O-N 2.86Å; L413-V415 PolarHBondContact O-N 3.12Å; L413-V415 VanDerWaalsContact O-N 3.16Å; L413-F416 PolarHBondContact O-N 3.19Å; L413-E417 WeakPolarHBondContact O-CA 3.4Å; L413-E417 WeakPolarHBondContact O-CB 2.99Å; L413-E417 PolarHBondContact O-N 2.58Å
414	E	93.6	Very high	83.1	Confident	119 Å²	119	89.1 Å²	89.1	56%	0.556	46%	0.46	S	S	*	.	H	α-helix	trans	-55.2	-38.3	179.3	-172.9	-175.6	158.4	0	0	113	K263 P410	K263-E414 WeakPolarHBondContact CE-O 3.39Å; K263-E414 PolarHBondContact NZ-O 3.23Å; P410-E414 PolarHBondContact O-N 2.94Å
415	V	93.6	Very high	82.7	Confident	20 Å²	20	90.9 Å²	90.9	12%	0.121	47%	0.465	C	S	.	.	H	α-helix	trans	-79.9	-41.9	-177.8	171.5	0	0	0	0	112.9	I234 K263 C266 L411 F412 L413	I234-V415 HydrophobicContact CG2-CG2 3.92Å; K263-V415 WeakPolarHBondContact CG-O 3.36Å; C266-V415 HydrophobicContact CB-CG1 3.8Å; L411-V415 HydrophobicContact CD1-CG2 4.27Å; L411-V415 WeakPolarHBondContact O-CB 3.31Å; L411-V415 VanDerWaalsContact O-CG2 3.29Å; L411-V415 WeakPolarHBondContact O-CG2 3.29Å; L411-V415 PolarHBondContact O-N 3Å; L411-V415 VanDerWaalsContact O-N 3.14Å; F412-V415 PolarHBondContact O-N 3.31Å; L413-V415 PolarHBondContact O-N 3.12Å; L413-V415 VanDerWaalsContact O-N 3.16Å
416	F	92.7	Very high	82.3	Confident	28 Å²	28	89.8 Å²	89.8	12%	0.123	46%	0.458	C	S	.	.	H	α-helix	trans	-107.7	-14	-169.3	-63.9	-64.7	0	0	0	115.1	I234 C266 M267 M270 H392 F396 F412 L413 E418	I234-F416 HydrophobicContact CD1-CE2 4.13Å; C266-F416 HydrophobicContact CB-CE1 4.12Å; C266-F416 HydrophobicContact CB-CZ 3.87Å; M267-F416 HydrophobicContact CB-CE1 3.8Å; M267-F416 HydrophobicContact CB-CZ 4.13Å; M270-F416 HydrophobicContact CE-CE2 4.03Å; M270-F416 HydrophobicContact CE-CZ 3.66Å; H392-F416 AromaticContact CE1-CD1 3.65Å; H392-F416 AromaticContact CE1-CE1 3.88Å; H392-F416 AromaticContact CE1-CG 3.81Å; H392-F416 AromaticContact ND1-CD1 3.9Å; F396-F416 HydrophobicContact CD2-CB 4.11Å; F396-F416 HydrophobicContact CE2-CB 4.04Å; F396-F416 HydrophobicContact CG-CB 4.41Å; F396-F416 HydrophobicContact CZ-CB 4.28Å; F412-F416 AromaticContact CD2-CD2 3.33Å; F412-F416 HydrophobicContact CD2-CD2 3.33Å; F412-F416 AromaticContact CD2-CE2 3.52Å; F412-F416 HydrophobicContact CD2-CE2 3.52Å; F412-F416 AromaticContact CE2-CD2 3.26Å; F412-F416 HydrophobicContact CE2-CD2 3.26Å; F412-F416 AromaticContact CE2-CE2 3.48Å; F412-F416 HydrophobicContact CE2-CE2 3.48Å; F412-F416 VanDerWaalsContact CE2-CE2 3.48Å; F412-F416 HydrophobicContact CE2-CG 4.25Å; F412-F416 HydrophobicContact CG-CD2 4.04Å; F412-F416 AromaticContact CZ-CD2 3.97Å; F412-F416 HydrophobicContact CZ-CD2 3.97Å; F412-F416 WeakPolarHBondContact O-CD2 3.31Å; F412-F416 PolarHBondContact O-N 2.94Å; L413-F416 PolarHBondContact O-N 3.19Å; F416-E418 PolarHBondContact O-N 2.81Å
417	E	87.4	Confident	81.8	Confident	80 Å²	80	83.3 Å²	83.3	37%	0.374	43%	0.43	S	S	.	.	S	Bend	trans	-78.5	118.2	170.4	-168.6	161.5	-164.5	0	0	109.2	F396 K400 L413 Q419	F396-E417 HydrophobicContact CE1-CB 4.18Å; F396-E417 HydrophobicContact CZ-CB 4.2Å; K400-E417 IonicContact NZ-OE1 3.39Å; K400-E417 PolarHBondContact NZ-OE1 2.8Å; K400-E417 IonicContact NZ-OE2 3.28Å; K400-E417 PolarHBondContact NZ-OE2 3.46Å; L413-E417 WeakPolarHBondContact O-CA 3.4Å; L413-E417 WeakPolarHBondContact O-CB 2.99Å; L413-E417 PolarHBondContact O-N 2.58Å; E417-Q419 PolarHBondContact O-N 3.34Å
418	E	74.6	Confident	81.2	Confident	172 Å²	172	85.9 Å²	85.9	80%	0.804	44%	0.443	S	S	*	.			trans	-63.5	122.9	169.5	-69.9	-177	175.7	0	0	108.1	F416 E420	F416-E418 PolarHBondContact O-N 2.81Å; E418-E420 PolarHBondContact O-N 3.29Å
419	Q	56.4	Low	80.3	Confident	150 Å²	150	91.8 Å²	91.8	70%	0.701	47%	0.474	S	S	*	.			trans	-76	114.1	166.8	-71.8	178.2	-11.3	0	0	106.2	E417 V421	E417-Q419 PolarHBondContact O-N 3.34Å; Q419-V421 PolarHBondContact O-N 3.07Å; Q419-V421 VanDerWaalsContact O-N 3.07Å
420	E	41.7	Very low	79.1	Confident	197 Å²	197	97.9 Å²	97.9	92%	0.921	50%	0.504	S	S	*	.			trans	-54.2	116	164.1	-70.6	-174.3	164.8	0	0	107.3	E418	E418-E420 PolarHBondContact O-N 3.29Å
421	V	33.8	Very low	77.8	Confident	209 Å²	209	96.8 Å²	96.8	100%	1.267	49%	0.485	S	S	*	.			trans	-86	0	172.4	177.3	0	0	0	0	109.2	Q419	Q419-V421 PolarHBondContact O-N 3.07Å; Q419-V421 VanDerWaalsContact O-N 3.07Å

Retrieved 421 of 421 residues in 572 ms (Link to these results)

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