A0A077Z1V2_TRITR Loading...

Homeobox protein engrailed-like

AlphaFold DB , UniProt , Accession A0A077Z1V2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 263 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	65.1	Low	58.4	Low	231 Å²	231	177.8 Å²	177.8	100%	1.138	89%	0.889	S	S	*	*				0	102.4	0	-73.3	179.7	170.8	0	0	108.4
2	H	46.7	Very low	58	Low	197 Å²	197	178.1 Å²	178.1	91%	0.912	89%	0.885	S	S	*	*			trans	-78.2	131	175.5	-81.9	-105.3	0	0	0	109.5
3	Y	61.1	Low	58.2	Low	234 Å²	234	172.5 Å²	172.5	92%	0.918	88%	0.884	S	S	*	*			trans	-117.4	117	161.8	-89.5	-82.9	0	0	0	108.8
4	S	53.1	Low	58.7	Low	109 Å²	109	169.2 Å²	169.2	76%	0.762	88%	0.884	S	S	*	*			trans	-113.1	126.8	175.1	-159.5	0	0	0	0	109.6
5	S	49.7	Very low	58.2	Low	122 Å²	122	170 Å²	170	85%	0.853	89%	0.888	S	S	*	*			trans	48.1	138.3	144.7	-60.3	0	0	0	0	123.7
6	G	66	Low	58.2	Low	72 Å²	72	164.6 Å²	164.6	74%	0.742	89%	0.886	S	S	*	*			trans	-171.8	120.6	154.2	0	0	0	0	0	112.8
7	P	58.5	Low	58.5	Low	132 Å²	132	160.8 Å²	160.8	86%	0.857	88%	0.876	S	S	*	*	P	Polyproline II helix	trans	-92.4	172.6	-171.7	35.8	-33.2	0	0	0	115.5
8	K	53.6	Low	58.1	Low	209 Å²	209	160.7 Å²	160.7	91%	0.909	87%	0.874	S	S	*	*	P	Polyproline II helix	trans	-73.6	144.8	-162.1	-57.4	-172.3	175.5	-177.2	0	115.6
9	K	67.9	Low	58	Low	211 Å²	211	156.4 Å²	156.4	92%	0.917	87%	0.871	S	S	*	*	P	Polyproline II helix	trans	-99.2	127.1	162.5	-73.1	-174.2	177.7	-178.3	0	111.6
10	K	59.1	Low	57.6	Low	192 Å²	192	158 Å²	158	84%	0.835	87%	0.871	S	S	*	*	P	Polyproline II helix	trans	-89.2	127.4	175.8	-170	172.9	-175.7	179.3	0	108.2
11	R	61.9	Low	57.3	Low	247 Å²	247	160.8 Å²	160.8	93%	0.932	87%	0.869	S	S	*	*			trans	-109.1	118.8	168.6	-69	-176.8	83.6	-175	5.1	108.4
12	Q	52.9	Low	57	Low	181 Å²	181	155.6 Å²	155.6	85%	0.846	85%	0.85	S	S	*	*			trans	-85.3	147.2	162.4	-73.5	-176.8	-27.9	0	0	108.7
13	A	60.7	Low	57.2	Low	105 Å²	105	153 Å²	153	87%	0.868	84%	0.843	S	S	*	*			trans	-139.2	133.4	166.2	0	0	0	0	0	108.6
14	S	65.5	Low	57	Low	127 Å²	127	148.7 Å²	148.7	89%	0.888	84%	0.836	S	S	*	*			trans	-67.5	153.4	-168.8	-61.9	0	0	0	0	115.2
15	L	51.9	Low	57	Low	181 Å²	181	151.5 Å²	151.5	95%	0.948	84%	0.843	S	S	*	*			trans	-74.8	138.6	166.4	-64.5	165.1	0	0	0	110
16	G	58	Low	57.2	Low	83 Å²	83	150.7 Å²	150.7	86%	0.856	84%	0.837	S	S	*	*			trans	-121.1	136.8	169.7	0	0	0	0	0	109.3
17	S	62.7	Low	56.6	Low	101 Å²	101	155.4 Å²	155.4	71%	0.706	84%	0.844	S	S	*	*			trans	-92.7	151.6	-164.2	-116.5	0	0	0	0	113.9
18	D	51.7	Low	56	Low	158 Å²	158	154.8 Å²	154.8	85%	0.845	84%	0.843	S	S	*	*			trans	66.6	130.9	139.8	-51.6	-40.5	0	0	0	122.6
19	G	55.5	Low	55.6	Low	79 Å²	79	150.8 Å²	150.8	81%	0.814	84%	0.84	S	S	*	*			trans	-173.6	81.9	172.2	0	0	0	0	0	111
20	E	49.8	Very low	54.4	Low	188 Å²	188	144.2 Å²	144.2	88%	0.879	83%	0.832	S	S	*	*			trans	-59	152.5	167.1	-125	-179.5	93.9	0	0	111.8
21	R	51.3	Low	54.1	Low	217 Å²	217	139.5 Å²	139.5	82%	0.819	83%	0.829	S	S	*	*				146	128.6	119.2	-158.4	166.6	-171	156.2	3.8	115.6
22	T	59.5	Low	53.7	Low	123 Å²	123	136 Å²	136	76%	0.755	83%	0.829	S	S	*	*			trans	82.3	122.2	147.9	41.7	0	0	0	0	123.1
23	D	50.7	Low	53.6	Low	142 Å²	142	134.2 Å²	134.2	76%	0.759	83%	0.825	S	S	*	*			trans	-69.5	179.5	167.5	-56.4	-86.3	0	0	0	114.9
24	D	56.7	Low	53	Low	144 Å²	144	140.6 Å²	140.6	77%	0.77	83%	0.827	S	S	*	*			trans	88.6	102.4	159.8	-57.8	-55.1	0	0	0	118.4
25	D	53.2	Low	52.3	Low	168 Å²	168	139.9 Å²	139.9	90%	0.898	82%	0.822	S	S	*	*			trans	-155.9	110.2	130	-102.7	-46.9	0	0	0	110.5
26	S	54.2	Low	52.5	Low	104 Å²	104	137.1 Å²	137.1	73%	0.727	81%	0.814	S	S	*	*			trans	-68.6	151.4	164.7	-66.3	0	0	0	0	109.6
27	L	53.7	Low	52.1	Low	172 Å²	172	138.5 Å²	138.5	90%	0.901	81%	0.811	S	S	*	*			trans	179.6	124	133.1	-92.6	159.6	0	0	0	110.7
28	S	45.7	Very low	51.5	Low	118 Å²	118	145.6 Å²	145.6	83%	0.825	82%	0.822	S	S	*	*			trans	-114.1	126.9	173.1	170.9	0	0	0	0	108.1
29	C	45.7	Very low	51.4	Low	125 Å²	125	143.6 Å²	143.6	85%	0.845	82%	0.821	S	S	*	*			trans	171.4	150.6	153.3	55.1	0	0	0	0	106.8
30	G	43	Very low	51	Low	73 Å²	73	144.9 Å²	144.9	75%	0.753	82%	0.815	S	S	*	*			cis	-163.5	165.8	4.6	0	0	0	0	0	107.9
31	A	52.6	Low	50.8	Low	94 Å²	94	143 Å²	143	78%	0.777	81%	0.811	S	S	*	*			trans	-61.4	147.1	175.7	0	0	0	0	0	112.1
32	D	53.8	Low	50.7	Low	174 Å²	174	139.5 Å²	139.5	93%	0.93	81%	0.809	S	S	*	*			trans	-143	129.1	143.8	-94.1	-50.8	0	0	0	111.1
33	D	49.8	Very low	50.4	Low	143 Å²	143	139.3 Å²	139.3	77%	0.765	81%	0.807	S	S	*	*			trans	-85.1	136.4	-172.8	-164.8	-65.2	0	0	0	109.4
34	R	48.2	Very low	50.2	Low	238 Å²	238	140 Å²	140	90%	0.898	81%	0.805	S	S	*	*			trans	-176.8	97.8	145.1	-106	165.9	-174.8	-132.7	1.1	111.6
35	S	50.4	Low	49.6	Very low	113 Å²	113	141.2 Å²	141.2	79%	0.79	81%	0.81	S	S	*	*			trans	-85.7	151.2	146.7	-67.6	0	0	0	0	109.4
36	P	56.8	Low	49.6	Very low	122 Å²	122	140 Å²	140	79%	0.792	80%	0.803	S	S	*	*			trans	-134.4	127.2	131.5	29.7	-14.9	0	0	0	112.1
37	S	49.4	Very low	49	Very low	112 Å²	112	143 Å²	143	78%	0.783	81%	0.811	S	S	*	*			trans	-48.3	134	156.9	51.5	0	0	0	0	112.4
38	R	49.2	Very low	48.4	Very low	250 Å²	250	137.8 Å²	137.8	94%	0.943	80%	0.798	S	S	*	*			trans	-152.2	127.5	143.8	-113.4	169.1	-173.2	-111.4	0.9	110.1
39	S	49.7	Very low	48.4	Very low	117 Å²	117	136.9 Å²	136.9	82%	0.818	80%	0.797	S	S	*	*			trans	-61.8	160	-175	-93.3	0	0	0	0	114.8
40	P	47.6	Very low	48.5	Very low	105 Å²	105	139.9 Å²	139.9	68%	0.682	80%	0.799	S	S	*	*			trans	-86.5	141.3	-177.6	34.8	-31.1	0	0	0	111.8
41	N	45.8	Very low	48.8	Very low	150 Å²	150	147.5 Å²	147.5	80%	0.802	81%	0.805	S	S	*	*			trans	175.7	145.6	137.4	-84.7	-22.3	0	0	0	110
42	D	48.4	Very low	48.7	Very low	143 Å²	143	149.3 Å²	149.3	77%	0.765	81%	0.806	S	S	*	*			trans	91.3	117.5	154.1	-77.2	-49.2	0	0	0	121.2
43	V	54	Low	48.1	Very low	118 Å²	118	144.2 Å²	144.2	72%	0.715	80%	0.795	S	S	*	*			trans	59.4	103.2	148.5	-97.2	0	0	0	0	120.2
44	H	46.7	Very low	47.8	Very low	158 Å²	158	147.5 Å²	147.5	73%	0.731	80%	0.796	S	S	*	*				-178.7	108	99.1	-106.1	-86.8	0	0	0	110.7	L46	H44-L46 PolarHBondContact O-N 3.42Å
45	I	43	Very low	47.6	Very low	169 Å²	169	144 Å²	144	87%	0.867	80%	0.795	S	S	*	*			trans	-74.4	101	158.6	-67.5	174.5	0	0	0	106.1
46	L	55	Low	47.3	Very low	142 Å²	142	149.1 Å²	149.1	74%	0.743	80%	0.798	S	S	*	*			trans	-152.7	107.2	158.8	-75.2	-176.3	0	0	0	109.5	H44	H44-L46 PolarHBondContact O-N 3.42Å
47	D	41.4	Very low	47	Very low	168 Å²	168	147.6 Å²	147.6	90%	0.898	79%	0.79	S	S	*	*			trans	39.4	84.8	136.7	-118.4	-6.8	0	0	0	117.9
48	G	40.8	Very low	47.1	Very low	62 Å²	62	149.9 Å²	149.9	64%	0.639	79%	0.794	S	S	*	*			trans	-136.3	4.9	177.6	0	0	0	0	0	115.8	E50	G48-E50 VanDerWaalsContact C-N 3.3Å; G48-E50 PolarHBondContact O-N 3.22Å
49	A	45.7	Very low	47.2	Very low	98 Å²	98	141 Å²	141	81%	0.81	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-4.9	-172.8	0	0	0	0	0	114.9
50	E	47.3	Very low	48.1	Very low	189 Å²	189	141.6 Å²	141.6	88%	0.883	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-5.1	-174.5	-76.8	-114.7	120.7	0	0	115	G48	G48-E50 VanDerWaalsContact C-N 3.3Å; G48-E50 PolarHBondContact O-N 3.22Å
51	R	49.9	Very low	49.3	Very low	233 Å²	233	142.4 Å²	142.4	88%	0.879	77%	0.768	S	S	*	*	S	Bend	trans	-106.4	-3.6	-171.5	-129.4	174.4	-169.5	164.8	2.9	117.2
52	V	49.7	Very low	50.5	Low	132 Å²	132	144.5 Å²	144.5	80%	0.8	77%	0.77	S	S	*	*	S	Bend	trans	-105.9	7.5	178.1	-162.1	0	0	0	0	112.4
53	G	41.2	Very low	51.7	Low	66 Å²	66	145.3 Å²	145.3	68%	0.68	77%	0.767	S	S	*	*	S	Bend	trans	-93.6	-2.9	178	0	0	0	0	0	115.9
54	R	43.8	Very low	53.2	Low	212 Å²	212	141.2 Å²	141.2	80%	0.8	74%	0.744	S	S	*	*	S	Bend	trans	-105.1	2.2	-167.3	-164.2	167.2	-94.2	-107.2	3.3	115.7
55	L	43	Very low	54.7	Low	166 Å²	166	138.4 Å²	138.4	87%	0.869	74%	0.737	S	S	*	*	S	Bend	trans	-102.9	7.9	176.9	-68	179.5	0	0	0	115.2
56	Y	45.4	Very low	56.6	Low	220 Å²	220	135.9 Å²	135.9	86%	0.863	73%	0.726	S	S	*	*	S	Bend	trans	-107.7	44.1	160.3	-60.5	-79.3	0	0	0	110.5	N58	Y56-N58 PolarHBondContact O-N 3.02Å
57	S	50.1	Low	57.9	Low	89 Å²	89	129.7 Å²	129.7	62%	0.622	69%	0.693	S	S	*	*			trans	-71.9	99.2	171.4	57.4	0	0	0	0	110	G59	S57-G59 VanDerWaalsContact C-N 3.33Å; S57-G59 PolarHBondContact O-N 3.38Å
58	N	51.1	Low	59.7	Low	160 Å²	160	124.5 Å²	124.5	86%	0.856	67%	0.665	S	S	*	*			trans	48	38.1	142.7	-64.5	-18.7	0	0	0	118.4	Y56 Q60	Y56-N58 PolarHBondContact O-N 3.02Å; N58-Q60 VanDerWaalsContact C-N 3.34Å; N58-Q60 PolarHBondContact O-N 2.72Å
59	G	52.2	Low	61.5	Low	64 Å²	64	127.4 Å²	127.4	66%	0.66	67%	0.665	S	S	*	*			trans	-68.7	96.6	153.9	0	0	0	0	0	107.8	S57 L61	S57-G59 VanDerWaalsContact C-N 3.33Å; S57-G59 PolarHBondContact O-N 3.38Å; G59-L61 VanDerWaalsContact C-N 3.26Å; G59-L61 PolarHBondContact O-N 2.65Å
60	Q	67.3	Low	63	Low	129 Å²	129	128 Å²	128	60%	0.603	65%	0.646	S	S	*	*			trans	-59.7	86.4	179.9	-177.1	174.2	-14.2	0	0	109.9	N58 K62 N67	N58-Q60 VanDerWaalsContact C-N 3.34Å; N58-Q60 PolarHBondContact O-N 2.72Å; Q60-K62 PolarHBondContact O-N 3.03Å; Q60-K62 VanDerWaalsContact O-N 3.13Å; Q60-N67 WeakPolarHBondContact CG-ND2 3.23Å; Q60-N67 WeakPolarHBondContact CG-OD1 3.41Å; Q60-N67 PolarHBondContact NE2-OD1 3.07Å
61	L	72.8	Confident	64.3	Low	123 Å²	123	125.5 Å²	125.5	64%	0.644	65%	0.647	S	S	*	*			trans	-57.6	121.1	178.1	-69.2	173.7	0	0	0	107.7	G59 F63 S64 N67	G59-L61 VanDerWaalsContact C-N 3.26Å; G59-L61 PolarHBondContact O-N 2.65Å; L61-F63 CarbonylContact O-C 3.5Å; L61-F63 PolarHBondContact O-N 3.03Å; L61-S64 PolarHBondContact O-N 3.49Å; L61-N67 PolarHBondContact O-ND2 3.11Å
62	K	71.8	Confident	65.5	Low	193 Å²	193	117.6 Å²	117.6	84%	0.839	62%	0.622	S	S	*	*	S	Bend	trans	-46.4	-28.9	177.8	-168.3	178.8	78.5	178.7	0	112.5	Q60	Q60-K62 PolarHBondContact O-N 3.03Å; Q60-K62 VanDerWaalsContact O-N 3.13Å
63	F	73.3	Confident	66.5	Low	161 Å²	161	115.5 Å²	115.5	71%	0.706	60%	0.602	S	S	*	*	S	Bend	trans	-114.9	77.1	170.4	-149.8	-97.4	0	0	0	110.7	L61 I68 F73	L61-F63 CarbonylContact O-C 3.5Å; L61-F63 PolarHBondContact O-N 3.03Å; F63-I68 HydrophobicContact CD1-CD1 3.69Å; F63-I68 HydrophobicContact CD2-CD1 3.98Å; F63-I68 HydrophobicContact CD2-CG1 4.2Å; F63-I68 HydrophobicContact CE1-CD1 3.53Å; F63-I68 HydrophobicContact CE2-CD1 3.83Å; F63-I68 HydrophobicContact CE2-CG1 4.13Å; F63-I68 HydrophobicContact CG-CD1 3.92Å; F63-I68 HydrophobicContact CG-CG1 4.49Å; F63-I68 HydrophobicContact CZ-CD1 3.6Å; F63-I68 HydrophobicContact CZ-CG1 4.36Å; F63-F73 HydrophobicContact CD2-CZ 4.29Å; F63-F73 HydrophobicContact CE2-CZ 4.27Å
64	S	84.8	Confident	67.8	Low	32 Å²	32	114.4 Å²	114.4	22%	0.224	59%	0.591	C	S	.	*			trans	-113.3	153.3	168	-179.7	0	0	0	0	109	L61 D66 N67 I68	L61-S64 PolarHBondContact O-N 3.49Å; S64-D66 PolarHBondContact O-N 3.33Å; S64-D66 PolarHBondContact OG-N 3.4Å; S64-D66 PolarHBondContact OG-OD2 3.13Å; S64-N67 PolarHBondContact O-N 3.06Å; S64-I68 WeakPolarHBondContact O-CD1 3.4Å; S64-I68 WeakPolarHBondContact O-CG1 3.19Å; S64-I68 PolarHBondContact O-N 2.74Å
65	V	79.7	Confident	68.8	Low	99 Å²	99	107.8 Å²	107.8	60%	0.6	58%	0.576	S	S	*	*	H	α-helix	trans	-51.1	-45.5	172.3	177.3	0	0	0	0	110	N67 I68 L69	V65-N67 PolarHBondContact O-N 3.1Å; V65-I68 PolarHBondContact O-N 3.32Å; V65-L69 HydrophobicContact CG1-CD1 3.64Å; V65-L69 HydrophobicContact CG1-CG 4.27Å; V65-L69 WeakPolarHBondContact O-CB 3.45Å; V65-L69 VanDerWaalsContact O-CG 3.25Å; V65-L69 WeakPolarHBondContact O-CG 3.29Å; V65-L69 PolarHBondContact O-N 3.11Å
66	D	82.7	Confident	69.5	Low	116 Å²	116	106.6 Å²	106.6	62%	0.62	57%	0.566	S	S	*	*	H	α-helix	trans	-66.7	-23.3	-179.9	-50.1	-63.9	0	0	0	113.9	S64 R70	S64-D66 PolarHBondContact O-N 3.33Å; S64-D66 PolarHBondContact OG-N 3.4Å; S64-D66 PolarHBondContact OG-OD2 3.13Å; D66-R70 WeakPolarHBondContact O-CG 3.38Å; D66-R70 PolarHBondContact O-NE 2.92Å
67	N	81	Confident	70	Confident	12 Å²	12	101 Å²	101	6%	0.064	56%	0.559	C	S	.	*	H	α-helix	trans	-86.5	-39.7	175.3	-78.1	-26.4	0	0	0	111.8	Q60 L61 S64 V65 L69 R70 F73	Q60-N67 WeakPolarHBondContact CG-ND2 3.23Å; Q60-N67 WeakPolarHBondContact CG-OD1 3.41Å; Q60-N67 PolarHBondContact NE2-OD1 3.07Å; L61-N67 PolarHBondContact O-ND2 3.11Å; S64-N67 PolarHBondContact O-N 3.06Å; V65-N67 PolarHBondContact O-N 3.1Å; N67-L69 VanDerWaalsContact C-N 3.29Å; N67-L69 PolarHBondContact O-N 3.19Å; N67-R70 PolarHBondContact O-N 3.31Å; N67-R70 VanDerWaalsContact OD1-CZ 3.28Å; N67-R70 PolarHBondContact OD1-NH2 3.28Å; N67-F73 WeakPolarHBondContact O-CB 3.46Å; N67-F73 WeakPolarHBondContact O-CD2 3.48Å; N67-F73 WeakPolarHBondContact O-CG 3.33Å
68	I	80.3	Confident	69.9	Low	59 Å²	59	105.9 Å²	105.9	30%	0.303	56%	0.564	S	S	.	*	H	α-helix	trans	-69.7	-29.8	-177.8	-61.1	156.5	0	0	0	111.5	F63 S64 V65 R70 F73	F63-I68 HydrophobicContact CD1-CD1 3.69Å; F63-I68 HydrophobicContact CD2-CD1 3.98Å; F63-I68 HydrophobicContact CD2-CG1 4.2Å; F63-I68 HydrophobicContact CE1-CD1 3.53Å; F63-I68 HydrophobicContact CE2-CD1 3.83Å; F63-I68 HydrophobicContact CE2-CG1 4.13Å; F63-I68 HydrophobicContact CG-CD1 3.92Å; F63-I68 HydrophobicContact CG-CG1 4.49Å; F63-I68 HydrophobicContact CZ-CD1 3.6Å; F63-I68 HydrophobicContact CZ-CG1 4.36Å; S64-I68 WeakPolarHBondContact O-CD1 3.4Å; S64-I68 WeakPolarHBondContact O-CG1 3.19Å; S64-I68 PolarHBondContact O-N 2.74Å; V65-I68 PolarHBondContact O-N 3.32Å; I68-R70 VanDerWaalsContact C-N 3.33Å; I68-F73 HydrophobicContact CB-CD1 4.27Å; I68-F73 HydrophobicContact CB-CE1 4.05Å; I68-F73 HydrophobicContact CB-CE2 4.29Å; I68-F73 HydrophobicContact CB-CZ 4.06Å; I68-F73 HydrophobicContact CG1-CD2 4.48Å; I68-F73 HydrophobicContact CG1-CE1 3.9Å; I68-F73 HydrophobicContact CG1-CE2 3.78Å; I68-F73 HydrophobicContact CG1-CZ 3.46Å; I68-F73 VanDerWaalsContact CG1-CZ 3.46Å; I68-F73 HydrophobicContact CG2-CD1 3.98Å; I68-F73 HydrophobicContact CG2-CE1 3.74Å; I68-F73 HydrophobicContact CG2-CZ 4.22Å
69	L	78.3	Confident	69.9	Low	122 Å²	122	102 Å²	102	64%	0.639	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-7.6	179.6	-68.1	176.5	0	0	0	114.1	V65 N67	V65-L69 HydrophobicContact CG1-CD1 3.64Å; V65-L69 HydrophobicContact CG1-CG 4.27Å; V65-L69 WeakPolarHBondContact O-CB 3.45Å; V65-L69 VanDerWaalsContact O-CG 3.25Å; V65-L69 WeakPolarHBondContact O-CG 3.29Å; V65-L69 PolarHBondContact O-N 3.11Å; N67-L69 VanDerWaalsContact C-N 3.29Å; N67-L69 PolarHBondContact O-N 3.19Å
70	R	77.1	Confident	69.7	Low	110 Å²	110	106.1 Å²	106.1	42%	0.415	56%	0.555	S	S	.	*	S	Bend	trans	-71.5	147.6	-178.6	-54.1	-173.5	177.1	176.3	-3.7	112	D66 N67 I68 D72 F73	D66-R70 WeakPolarHBondContact O-CG 3.38Å; D66-R70 PolarHBondContact O-NE 2.92Å; N67-R70 PolarHBondContact O-N 3.31Å; N67-R70 VanDerWaalsContact OD1-CZ 3.28Å; N67-R70 PolarHBondContact OD1-NH2 3.28Å; I68-R70 VanDerWaalsContact C-N 3.33Å; R70-D72 WeakPolarHBondContact CB-OD1 3.32Å; R70-D72 PolarHBondContact O-N 3.04Å; R70-D72 VanDerWaalsContact O-N 3.14Å; R70-F73 VanDerWaalsContact O-CB 3.32Å; R70-F73 WeakPolarHBondContact O-CB 3.33Å; R70-F73 PolarHBondContact O-N 2.79Å; R70-F73 VanDerWaalsContact O-N 3.07Å
71	P	75.7	Confident	68.8	Low	138 Å²	138	107.6 Å²	107.6	90%	0.896	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-26.3	179.4	-23.2	33.3	0	0	0	114.4
72	D	74.8	Confident	67.7	Low	67 Å²	67	107.9 Å²	107.9	36%	0.358	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.8	-1.6	-178.6	64	-46	0	0	0	113.7	R70 G74 C75 H76	R70-D72 WeakPolarHBondContact CB-OD1 3.32Å; R70-D72 PolarHBondContact O-N 3.04Å; R70-D72 VanDerWaalsContact O-N 3.14Å; D72-G74 PolarHBondContact O-N 3.48Å; D72-C75 WeakPolarHBondContact O-CB 3.4Å; D72-C75 PolarHBondContact O-N 2.89Å; D72-H76 IonicContact OD2-CE1 3.3Å; D72-H76 PolarHBondContact OD2-CE1 3.44Å; D72-H76 VanDerWaalsContact OD2-CE1 3.3Å; D72-H76 IonicContact OD2-ND1 4Å
73	F	69.3	Low	66.6	Low	88 Å²	88	102.1 Å²	102.1	39%	0.386	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.9	121.7	-178.4	-171.4	-102.4	0	0	0	111.6	F63 N67 I68 R70 C75	F63-F73 HydrophobicContact CD2-CZ 4.29Å; F63-F73 HydrophobicContact CE2-CZ 4.27Å; N67-F73 WeakPolarHBondContact O-CB 3.46Å; N67-F73 WeakPolarHBondContact O-CD2 3.48Å; N67-F73 WeakPolarHBondContact O-CG 3.33Å; I68-F73 HydrophobicContact CB-CD1 4.27Å; I68-F73 HydrophobicContact CB-CE1 4.05Å; I68-F73 HydrophobicContact CB-CE2 4.29Å; I68-F73 HydrophobicContact CB-CZ 4.06Å; I68-F73 HydrophobicContact CG1-CD2 4.48Å; I68-F73 HydrophobicContact CG1-CE1 3.9Å; I68-F73 HydrophobicContact CG1-CE2 3.78Å; I68-F73 HydrophobicContact CG1-CZ 3.46Å; I68-F73 VanDerWaalsContact CG1-CZ 3.46Å; I68-F73 HydrophobicContact CG2-CD1 3.98Å; I68-F73 HydrophobicContact CG2-CE1 3.74Å; I68-F73 HydrophobicContact CG2-CZ 4.22Å; R70-F73 VanDerWaalsContact O-CB 3.32Å; R70-F73 WeakPolarHBondContact O-CB 3.33Å; R70-F73 PolarHBondContact O-N 2.79Å; R70-F73 VanDerWaalsContact O-N 3.07Å; F73-C75 VanDerWaalsContact C-N 3.32Å; F73-C75 PolarHBondContact O-N 3.31Å
74	G	69.3	Low	65.3	Low	43 Å²	43	99.4 Å²	99.4	44%	0.443	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	83.9	-6.1	-177	0	0	0	0	0	115.4	D72	D72-G74 PolarHBondContact O-N 3.48Å
75	C	64.6	Low	63	Low	73 Å²	73	103 Å²	103	49%	0.493	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.9	-41.1	176.2	-66.8	0	0	0	0	112.1	D72 F73 S77 R78 S79	D72-C75 WeakPolarHBondContact O-CB 3.4Å; D72-C75 PolarHBondContact O-N 2.89Å; F73-C75 VanDerWaalsContact C-N 3.32Å; F73-C75 PolarHBondContact O-N 3.31Å; C75-S77 PolarHBondContact O-N 3.04Å; C75-R78 PolarHBondContact O-N 2.89Å; C75-R78 VanDerWaalsContact O-N 3.09Å; C75-S79 PolarHBondContact O-N 2.94Å
76	H	57.7	Low	61.4	Low	141 Å²	141	104.5 Å²	104.5	65%	0.653	59%	0.588	S	S	*	*	H	α-helix	trans	-59.5	-30.5	-179.2	-65.5	91	0	0	0	113.6	D72	D72-H76 IonicContact OD2-CE1 3.3Å; D72-H76 PolarHBondContact OD2-CE1 3.44Å; D72-H76 VanDerWaalsContact OD2-CE1 3.3Å; D72-H76 IonicContact OD2-ND1 4Å
77	S	55.9	Low	59.3	Low	103 Å²	103	108.5 Å²	108.5	72%	0.72	60%	0.6	S	S	*	*	H	α-helix	trans	-84.5	-10.7	-178.4	-153.5	0	0	0	0	113.8	C75	C75-S77 PolarHBondContact O-N 3.04Å
78	R	48.5	Very low	57.3	Low	190 Å²	190	112.2 Å²	112.2	72%	0.717	63%	0.627	S	S	*	*	H	α-helix	trans	-104	-25	-179.2	-74.6	-178.4	163.6	-175.3	-3.6	113.4	C75 L80 M81	C75-R78 PolarHBondContact O-N 2.89Å; C75-R78 VanDerWaalsContact O-N 3.09Å; R78-L80 VanDerWaalsContact C-N 3.28Å; R78-L80 PolarHBondContact O-N 3.4Å; R78-M81 PolarHBondContact O-N 3.26Å
79	S	50.5	Low	55.7	Low	80 Å²	80	118.3 Å²	118.3	56%	0.559	65%	0.653	S	S	*	*	H	α-helix	trans	-61.3	-35	-177.9	-164.1	0	0	0	0	112.8	C75 M81 I82 A83	C75-S79 PolarHBondContact O-N 2.94Å; S79-M81 VanDerWaalsContact C-N 3.25Å; S79-M81 PolarHBondContact O-N 2.86Å; S79-I82 PolarHBondContact O-N 3.22Å; S79-A83 PolarHBondContact O-N 3.41Å
80	L	48.6	Very low	53.7	Low	149 Å²	149	117.7 Å²	117.7	78%	0.78	66%	0.659	S	S	*	*	H	α-helix	trans	-72	-10.7	176	-67	176.5	0	0	0	114.8	R78	R78-L80 VanDerWaalsContact C-N 3.28Å; R78-L80 PolarHBondContact O-N 3.4Å
81	M	49.1	Very low	52	Low	161 Å²	161	122.1 Å²	122.1	79%	0.793	68%	0.682	S	S	*	*	H	α-helix	trans	-100.4	-7.7	175.2	-70.2	-147.5	-176.9	0	0	113.9	R78 S79	R78-M81 PolarHBondContact O-N 3.26Å; S79-M81 VanDerWaalsContact C-N 3.25Å; S79-M81 PolarHBondContact O-N 2.86Å
82	I	48.1	Very low	50.5	Low	128 Å²	128	120 Å²	120	66%	0.656	68%	0.676	S	S	*	*	H	α-helix	trans	-104	-26.6	178	-59	176.3	0	0	0	110.6	S79 S84 C85	S79-I82 PolarHBondContact O-N 3.22Å; I82-S84 PolarHBondContact O-N 3.14Å; I82-C85 PolarHBondContact O-N 2.87Å
83	A	49.2	Very low	48.7	Very low	73 Å²	73	122.9 Å²	122.9	60%	0.603	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	-9.7	176.5	0	0	0	0	0	115	S79	S79-A83 PolarHBondContact O-N 3.41Å
84	S	45.2	Very low	47.3	Very low	103 Å²	103	128.4 Å²	128.4	72%	0.72	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	4.6	178.5	58.7	0	0	0	0	114.3	I82	I82-S84 PolarHBondContact O-N 3.14Å
85	C	38.5	Very low	45.9	Very low	109 Å²	109	130.7 Å²	130.7	74%	0.736	73%	0.732	S	S	*	*	S	Bend	trans	-134.1	51.8	-179.3	-164.7	0	0	0	0	111.9	I82	I82-C85 PolarHBondContact O-N 2.87Å
86	V	45.5	Very low	44.5	Very low	130 Å²	130	132.4 Å²	132.4	79%	0.788	75%	0.745	S	S	*	*			trans	-144.6	70.9	161.6	-77.6	0	0	0	0	108.2
87	K	38.6	Very low	43.7	Very low	199 Å²	199	131.7 Å²	131.7	87%	0.865	75%	0.752	S	S	*	*			trans	-88	117.7	173.5	-164.9	131.1	-178.7	173.4	0	108.1
88	S	39.7	Very low	42.7	Very low	91 Å²	91	131.6 Å²	131.6	64%	0.636	76%	0.758	S	S	*	*			trans	71.5	92.8	157	-46.6	0	0	0	0	117.2
89	H	45.3	Very low	42.3	Very low	186 Å²	186	128.2 Å²	128.2	86%	0.861	76%	0.764	S	S	*	*			trans	-152.8	108.7	133.2	-92.5	-73.5	0	0	0	108.4
90	S	37	Very low	41.5	Very low	109 Å²	109	133.9 Å²	133.9	76%	0.762	78%	0.781	S	S	*	*			trans	-74.4	125.7	176.5	58	0	0	0	0	110.5
91	F	40.6	Very low	40.8	Very low	204 Å²	204	130.6 Å²	130.6	90%	0.895	78%	0.776	S	S	*	*			trans	-143	135.1	151.7	-81.3	-74.9	0	0	0	109.3
92	A	45.3	Very low	40.1	Very low	93 Å²	93	129.3 Å²	129.3	77%	0.769	78%	0.782	S	S	*	*			trans	-74.6	161.2	-162.7	0	0	0	0	0	114.2
93	P	37.3	Very low	39.7	Very low	127 Å²	127	132.5 Å²	132.5	83%	0.825	79%	0.787	S	S	*	*			trans	-85.2	133.1	177	34.2	-28.9	0	0	0	110.5
94	F	39.5	Very low	38.9	Very low	205 Å²	205	135.6 Å²	135.6	90%	0.899	80%	0.799	S	S	*	*			trans	-112.6	129.3	169	-171.3	-97.5	0	0	0	109.8
95	S	39.3	Very low	38.6	Very low	91 Å²	91	138 Å²	138	64%	0.636	80%	0.803	S	S	*	*			trans	-95.7	143.6	-171.2	-61	0	0	0	0	113.2
96	S	35.8	Very low	38.4	Very low	109 Å²	109	138.1 Å²	138.1	76%	0.762	81%	0.805	S	S	*	*			trans	71.8	162.2	146.6	-69.4	0	0	0	0	120.2
97	P	40.3	Very low	38.1	Very low	125 Å²	125	140.9 Å²	140.9	81%	0.812	81%	0.806	S	S	*	*			cis	-132.9	-177.2	-28.5	31.5	-10.2	0	0	0	113.7
98	A	35.1	Very low	38	Very low	102 Å²	102	136.8 Å²	136.8	84%	0.843	80%	0.803	S	S	*	*			trans	-39.1	139.1	-176.2	0	0	0	0	0	119.6
99	S	40.4	Very low	38.2	Very low	119 Å²	119	142 Å²	142	83%	0.832	81%	0.81	S	S	*	*			trans	-158.1	138.3	139.2	61.8	0	0	0	0	111.5
100	E	32.8	Very low	38.1	Very low	199 Å²	199	139.4 Å²	139.4	93%	0.93	81%	0.81	S	S	*	*			trans	-48.5	128.8	170.3	-94.8	165.8	132.5	0	0	112.9
101	A	34.4	Very low	38	Very low	80 Å²	80	142 Å²	142	66%	0.661	82%	0.815	S	S	*	*			trans	-164	106.6	151.7	0	0	0	0	0	110.3	Y103	A101-Y103 PolarHBondContact O-N 2.96Å
102	S	34	Very low	38.1	Very low	134 Å²	134	141.9 Å²	141.9	94%	0.937	82%	0.815	S	S	*	*			trans	-53.6	120.4	162.3	-57.4	0	0	0	0	110.2
103	Y	39.2	Very low	37.7	Very low	194 Å²	194	142.2 Å²	142.2	76%	0.761	82%	0.817	S	S	*	*			trans	-133.9	116.2	163.7	67.1	-87.7	0	0	0	111	A101 L105	A101-Y103 PolarHBondContact O-N 2.96Å; Y103-L105 HydrophobicContact CD2-CB 4.36Å
104	T	33.6	Very low	37.7	Very low	139 Å²	139	139.7 Å²	139.7	85%	0.853	81%	0.814	S	S	*	*			trans	-65.1	126.9	159.6	48.7	0	0	0	0	108.7
105	L	38.6	Very low	37.6	Very low	153 Å²	153	135 Å²	135	80%	0.801	81%	0.807	S	S	*	*			trans	-128.5	98.5	169	-168.8	63.6	0	0	0	110.8	Y103	Y103-L105 HydrophobicContact CD2-CB 4.36Å
106	S	34.6	Very low	37.8	Very low	111 Å²	111	137.9 Å²	137.9	78%	0.776	82%	0.815	S	S	*	*			trans	-61.2	137.3	171.8	-52.7	0	0	0	0	111.5
107	K	40	Very low	37.7	Very low	188 Å²	188	136.6 Å²	136.6	82%	0.817	82%	0.819	S	S	*	*			trans	-111.8	110.2	166.1	-154.7	160.7	-172.1	171.5	0	108
108	S	36.2	Very low	37.9	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	82%	0.816	S	S	*	*			trans	-69	140.1	-177.4	41.7	0	0	0	0	112.5
109	Y	43.7	Very low	38.1	Very low	201 Å²	201	138.5 Å²	138.5	79%	0.788	82%	0.816	S	S	*	*			trans	-118	145.3	160.2	-68.9	-84.1	0	0	0	107.5
110	P	43.7	Very low	38.7	Very low	131 Å²	131	138.4 Å²	138.4	85%	0.851	81%	0.81	S	S	*	*			trans	-73.7	134.7	-174.4	29.7	-32.1	0	0	0	111.4
111	D	34.3	Very low	39.5	Very low	163 Å²	163	134.1 Å²	134.1	87%	0.872	80%	0.8	S	S	*	*			trans	-61	132.7	175.1	-77.1	-58.9	0	0	0	112.4
112	F	43.2	Very low	40.1	Very low	203 Å²	203	135.9 Å²	135.9	89%	0.89	81%	0.808	S	S	*	*			trans	-126.4	101.2	153.2	-152.8	-91.7	0	0	0	108
113	A	36.2	Very low	40.9	Very low	99 Å²	99	136.5 Å²	136.5	82%	0.818	80%	0.799	S	S	*	*			trans	-70.8	129.4	175.2	0	0	0	0	0	110.2
114	G	37.3	Very low	41.7	Very low	75 Å²	75	132 Å²	132	77%	0.773	79%	0.794	S	S	*	*			trans	-170.1	91.5	177	0	0	0	0	0	111.1
115	S	37.4	Very low	43.2	Very low	107 Å²	107	131.3 Å²	131.3	75%	0.748	79%	0.792	S	S	*	*			trans	-43.5	129.4	179	-172	0	0	0	0	115.4
116	N	42.8	Very low	44.7	Very low	150 Å²	150	128.5 Å²	128.5	80%	0.802	78%	0.781	S	S	*	*				169.7	122.6	120.1	-80.3	-14.4	0	0	0	110.5
117	G	33.7	Very low	46.6	Very low	82 Å²	82	130.3 Å²	130.3	85%	0.845	78%	0.781	S	S	*	*			trans	-71.5	125.1	-174	0	0	0	0	0	113.9
118	I	44.3	Very low	48.3	Very low	147 Å²	147	123.7 Å²	123.7	75%	0.754	75%	0.751	S	S	*	*			trans	-136.1	105.9	150.3	-63.7	177.9	0	0	0	104.7	V120	I118-V120 VanDerWaalsContact C-N 3.26Å; I118-V120 HydrophobicContact CG2-CG1 4.27Å; I118-V120 PolarHBondContact O-N 3.3Å
119	S	39.8	Very low	50.4	Low	120 Å²	120	121.7 Å²	121.7	84%	0.839	74%	0.736	S	S	*	*			trans	-67.3	88.1	171.7	52.9	0	0	0	0	108.5
120	V	53.4	Low	52	Low	117 Å²	117	115.5 Å²	115.5	71%	0.709	73%	0.726	S	S	*	*			trans	-67.1	125.7	165.2	-73.6	0	0	0	0	107.7	I118 S122	I118-V120 VanDerWaalsContact C-N 3.26Å; I118-V120 HydrophobicContact CG2-CG1 4.27Å; I118-V120 PolarHBondContact O-N 3.3Å; V120-S122 PolarHBondContact O-N 3.29Å; V120-S122 VanDerWaalsContact O-N 3.15Å
121	P	48.6	Very low	53.9	Low	109 Å²	109	116.3 Å²	116.3	71%	0.708	71%	0.712	S	S	*	*			trans	-61.5	124.1	174.8	26	-31.1	0	0	0	107.2	L123	P121-L123 VanDerWaalsContact C-N 3.27Å; P121-L123 PolarHBondContact O-N 3.33Å
122	S	48.5	Very low	56.2	Low	118 Å²	118	108.7 Å²	108.7	83%	0.825	67%	0.671	S	S	*	*			trans	-62.7	91.5	174.6	45.8	0	0	0	0	108.7	V120	V120-S122 PolarHBondContact O-N 3.29Å; V120-S122 VanDerWaalsContact O-N 3.15Å
123	L	50.4	Low	57.8	Low	146 Å²	146	101.5 Å²	101.5	76%	0.764	64%	0.639	S	S	*	*			trans	-53.9	130.4	164.5	-86.8	129.5	0	0	0	107.1	P121	P121-L123 VanDerWaalsContact C-N 3.27Å; P121-L123 PolarHBondContact O-N 3.33Å
124	P	56.1	Low	59.6	Low	101 Å²	101	100.1 Å²	100.1	66%	0.656	62%	0.622	S	S	*	*			trans	-54.1	136.3	178.4	22.9	-32.2	0	0	0	108.1	V126	P124-V126 PolarHBondContact O-N 3.35Å
125	P	64.5	Low	61.4	Low	123 Å²	123	97.9 Å²	97.9	80%	0.799	59%	0.593	S	S	*	*			trans	-57	112.8	179.9	22.9	-31.7	0	0	0	107.5	L127	P125-L127 VanDerWaalsContact C-N 3.31Å; P125-L127 PolarHBondContact O-N 2.67Å
126	V	69.5	Low	63.1	Low	94 Å²	94	97.9 Å²	97.9	57%	0.57	58%	0.577	S	S	*	*			trans	-67	98.3	-179.4	-166	0	0	0	0	106.1	P124 W128	P124-V126 PolarHBondContact O-N 3.35Å; V126-W128 PolarHBondContact O-N 3.29Å
127	L	75.8	Confident	64.3	Low	150 Å²	150	94.1 Å²	94.1	79%	0.785	55%	0.552	S	S	*	*			trans	-73.2	98.7	-178.7	-176.9	64.7	0	0	0	107.6	P125	P125-L127 VanDerWaalsContact C-N 3.31Å; P125-L127 PolarHBondContact O-N 2.67Å
128	W	75	Confident	66.2	Low	48 Å²	48	90.8 Å²	90.8	18%	0.182	52%	0.515	C	S	.	.			trans	-62.5	140.1	175.8	-65.2	86.4	0	0	0	109.4	V126 A130 V132 Y133 Q226 Q230	V126-W128 PolarHBondContact O-N 3.29Å; W128-A130 PolarHBondContact O-N 2.78Å; W128-V132 HydrophobicContact CB-CB 4.03Å; W128-V132 HydrophobicContact CB-CG1 4.17Å; W128-V132 HydrophobicContact CB-CG2 4.31Å; W128-V132 HydrophobicContact CD2-CG1 4.33Å; W128-V132 HydrophobicContact CE3-CG1 4.13Å; W128-V132 HydrophobicContact CE3-CG2 4.21Å; W128-V132 HydrophobicContact CG-CG1 4.38Å; W128-Y133 HydrophobicContact CB-CD2 4.46Å; W128-Y133 HydrophobicContact CB-CE2 3.68Å; W128-Y133 WeakPolarHBondContact O-CE2 3.28Å; W128-Q226 HydrophobicContact CH2-CB 4.48Å; W128-Q230 HydrophobicContact CZ2-CG 3.99Å
129	P	80.9	Confident	67.1	Low	72 Å²	72	86.7 Å²	86.7	47%	0.468	50%	0.495	S	S	.	.			trans	-50.1	138.4	171.1	-28.9	35.8	0	0	0	110.9	W131 V132	P129-W131 VanDerWaalsContact CB-CD1 3.45Å; P129-W131 HydrophobicContact CB-CG 4.48Å; P129-W131 PolarHBondContact O-N 2.9Å; P129-V132 HydrophobicContact CB-CG2 4.45Å; P129-V132 WeakPolarHBondContact O-CB 3.36Å; P129-V132 WeakPolarHBondContact O-CG2 3.4Å; P129-V132 PolarHBondContact O-N 3.02Å
130	A	77.2	Confident	68.3	Low	70 Å²	70	85.1 Å²	85.1	58%	0.579	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-29.4	-169.8	0	0	0	0	0	114.4	W128 V132 Y133 C134	W128-A130 PolarHBondContact O-N 2.78Å; A130-V132 VanDerWaalsContact C-N 3.27Å; A130-V132 PolarHBondContact O-N 3.47Å; A130-Y133 PolarHBondContact O-N 3.47Å; A130-C134 PolarHBondContact O-SG 3.49Å
131	W	83.5	Confident	68.5	Low	149 Å²	149	86.4 Å²	86.4	56%	0.564	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-27.9	178.7	72.4	-96.5	0	0	0	113.3	P129 C134 T135 L223	P129-W131 VanDerWaalsContact CB-CD1 3.45Å; P129-W131 HydrophobicContact CB-CG 4.48Å; P129-W131 PolarHBondContact O-N 2.9Å; W131-C134 WeakPolarHBondContact O-CB 3.49Å; W131-C134 PolarHBondContact O-N 3Å; W131-T135 HydrophobicContact CE3-CG2 4.19Å; W131-T135 HydrophobicContact CZ3-CG2 4.19Å; W131-T135 PolarHBondContact O-N 2.63Å; W131-L223 HydrophobicContact CZ3-CD2 4.47Å
132	V	81.6	Confident	68.7	Low	3 Å²	3	85.8 Å²	85.8	2%	0.018	48%	0.48	C	S	.	.	G	3₁₀ helix	trans	-61.2	-48.2	178.4	177.3	0	0	0	0	109.5	W128 P129 A130 C134 T135 S138 L223 L227	W128-V132 HydrophobicContact CB-CB 4.03Å; W128-V132 HydrophobicContact CB-CG1 4.17Å; W128-V132 HydrophobicContact CB-CG2 4.31Å; W128-V132 HydrophobicContact CD2-CG1 4.33Å; W128-V132 HydrophobicContact CE3-CG1 4.13Å; W128-V132 HydrophobicContact CE3-CG2 4.21Å; W128-V132 HydrophobicContact CG-CG1 4.38Å; P129-V132 HydrophobicContact CB-CG2 4.45Å; P129-V132 WeakPolarHBondContact O-CB 3.36Å; P129-V132 WeakPolarHBondContact O-CG2 3.4Å; P129-V132 PolarHBondContact O-N 3.02Å; A130-V132 VanDerWaalsContact C-N 3.27Å; A130-V132 PolarHBondContact O-N 3.47Å; V132-C134 PolarHBondContact O-N 2.94Å; V132-C134 VanDerWaalsContact O-N 3.11Å; V132-T135 WeakPolarHBondContact O-CB 3.34Å; V132-T135 WeakPolarHBondContact O-CG2 3.41Å; V132-T135 PolarHBondContact O-N 3.08Å; V132-T135 VanDerWaalsContact O-N 3.09Å; V132-T135 PolarHBondContact O-OG1 3.48Å; V132-T135 VanDerWaalsContact O-OG1 3.05Å; V132-S138 WeakPolarHBondContact O-CB 3.22Å; V132-S138 PolarHBondContact O-OG 3.21Å; V132-L223 HydrophobicContact CG1-CD1 4.39Å; V132-L227 HydrophobicContact CG1-CD2 3.91Å
133	Y	76.4	Confident	68.9	Low	52 Å²	52	83 Å²	83	20%	0.204	46%	0.461	C	S	.	.	G	3₁₀ helix	trans	-67.3	-9.8	175.5	-57.2	-72.8	0	0	0	114.7	W128 A130 L232	W128-Y133 HydrophobicContact CB-CD2 4.46Å; W128-Y133 HydrophobicContact CB-CE2 3.68Å; W128-Y133 WeakPolarHBondContact O-CE2 3.28Å; A130-Y133 PolarHBondContact O-N 3.47Å; Y133-L232 HydrophobicContact CE1-CD1 3.81Å; Y133-L232 HydrophobicContact CE1-CD2 4.13Å
134	C	74.3	Confident	69.1	Low	69 Å²	69	78.6 Å²	78.6	47%	0.466	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-94.8	-6	176.7	-67.4	0	0	0	0	112.6	A130 W131 V132 R140 R146	A130-C134 PolarHBondContact O-SG 3.49Å; W131-C134 WeakPolarHBondContact O-CB 3.49Å; W131-C134 PolarHBondContact O-N 3Å; V132-C134 PolarHBondContact O-N 2.94Å; V132-C134 VanDerWaalsContact O-N 3.11Å; C134-R140 PolarHBondContact SG-NH1 2.99Å; C134-R146 PolarHBondContact O-NH1 3.4Å; C134-R146 VanDerWaalsContact O-NH1 3.1Å
135	T	76.6	Confident	69.1	Low	28 Å²	28	80.2 Å²	80.2	17%	0.172	46%	0.46	C	S	.	.	S	Bend	trans	-67.8	158.3	177.8	75	0	0	0	0	110.9	W131 V132 Y137 S138 L223	W131-T135 HydrophobicContact CE3-CG2 4.19Å; W131-T135 HydrophobicContact CZ3-CG2 4.19Å; W131-T135 PolarHBondContact O-N 2.63Å; V132-T135 WeakPolarHBondContact O-CB 3.34Å; V132-T135 WeakPolarHBondContact O-CG2 3.41Å; V132-T135 PolarHBondContact O-N 3.08Å; V132-T135 VanDerWaalsContact O-N 3.09Å; V132-T135 PolarHBondContact O-OG1 3.48Å; V132-T135 VanDerWaalsContact O-OG1 3.05Å; T135-Y137 PolarHBondContact O-N 3.12Å; T135-Y137 VanDerWaalsContact O-N 3.16Å; T135-Y137 PolarHBondContact OG1-N 3.41Å; T135-S138 PolarHBondContact O-N 3.39Å; T135-S138 PolarHBondContact OG1-N 3.49Å; T135-S138 PolarHBondContact OG1-OG 2.95Å; T135-S138 VanDerWaalsContact OG1-OG 3.05Å; T135-L223 HydrophobicContact CG2-CD2 4.33Å
136	R	71.4	Confident	68.8	Low	107 Å²	107	83.2 Å²	83.2	40%	0.404	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-13.3	175.2	-158.2	-175	73.2	120.6	7.5	112.5	A237	R136-A237 PolarHBondContact NH2-O 3.03Å; R136-A237 WeakPolarHBondContact O-CB 3.44Å
137	Y	69	Low	68.1	Low	72 Å²	72	83.4 Å²	83.4	28%	0.282	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-5.3	-174.5	-60	-74.5	0	0	0	112.8	T135 Y233 N234 A237	T135-Y137 PolarHBondContact O-N 3.12Å; T135-Y137 VanDerWaalsContact O-N 3.16Å; T135-Y137 PolarHBondContact OG1-N 3.41Å; Y137-Y233 AromaticContact CD1-CE2 3.59Å; Y137-Y233 HydrophobicContact CD1-CE2 3.59Å; Y137-Y233 HydrophobicContact CG-CE2 4.09Å; Y137-Y233 CarbonylContact O-C 3.33Å; Y137-Y233 VanDerWaalsContact O-CA 3.28Å; Y137-Y233 WeakPolarHBondContact O-CA 3.3Å; Y137-N234 PolarHBondContact O-N 2.92Å; Y137-A237 HydrophobicContact CD1-CB 4.37Å
138	S	72.9	Confident	67.3	Low	11 Å²	11	84.9 Å²	84.9	8%	0.077	46%	0.457	C	S	.	.	B	Isolated β-bridge	trans	-100.9	128.9	-177.8	-61	0	0	0	0	112.1	V132 T135 R140 L227 L232	V132-S138 WeakPolarHBondContact O-CB 3.22Å; V132-S138 PolarHBondContact O-OG 3.21Å; T135-S138 PolarHBondContact O-N 3.39Å; T135-S138 PolarHBondContact OG1-N 3.49Å; T135-S138 PolarHBondContact OG1-OG 2.95Å; T135-S138 VanDerWaalsContact OG1-OG 3.05Å; S138-R140 PolarHBondContact O-N 3.27Å; S138-L227 VanDerWaalsContact OG-CD1 3.29Å; S138-L227 WeakPolarHBondContact OG-CD1 3.28Å; S138-L232 CarbonylContact C-O 3.59Å; S138-L232 WeakPolarHBondContact CA-O 3.25Å
139	D	63.7	Low	66.3	Low	61 Å²	61	93.6 Å²	93.6	33%	0.326	49%	0.49	S	S	.	.			trans	-77.8	115.2	167.3	-73.4	-39.8	0	0	0	108.8	L232 N234	D139-L232 PolarHBondContact N-O 2.77Å; D139-N234 VanDerWaalsContact OD1-CA 3.31Å; D139-N234 WeakPolarHBondContact OD1-CA 3.28Å; D139-N234 VanDerWaalsContact OD1-CB 3.25Å; D139-N234 WeakPolarHBondContact OD1-CB 3.37Å; D139-N234 PolarHBondContact OD1-ND2 2.93Å; D139-N234 VanDerWaalsContact OD2-CA 3.28Å; D139-N234 WeakPolarHBondContact OD2-CA 3.31Å; D139-N234 PolarHBondContact OD2-N 3.27Å
140	R	64.7	Low	65.3	Low	88 Å²	88	95.6 Å²	95.6	33%	0.332	50%	0.501	S	S	.	.			trans	-112.7	121.9	175.9	-166.9	174.8	-175.5	153.9	-0.5	107.6	C134 S138 S142 S143	C134-R140 PolarHBondContact SG-NH1 2.99Å; S138-R140 PolarHBondContact O-N 3.27Å; R140-S142 PolarHBondContact O-N 3.25Å; R140-S143 WeakPolarHBondContact CD-OG 3.32Å; R140-S143 PolarHBondContact O-N 3.24Å
141	P	58.4	Low	64.4	Low	143 Å²	143	103.4 Å²	103.4	93%	0.929	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.2	173.8	21.9	-30.7	0	0	0	112.7
142	S	52.1	Low	63.1	Low	96 Å²	96	107.2 Å²	107.2	67%	0.671	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-12.8	177.3	171.3	0	0	0	0	114.7	R140 G144	R140-S142 PolarHBondContact O-N 3.25Å; S142-G144 PolarHBondContact O-N 3.17Å
143	S	52.3	Low	61.7	Low	61 Å²	61	114 Å²	114	43%	0.427	57%	0.565	S	S	.	*	S	Bend	trans	-93.2	87.2	171.3	-67.5	0	0	0	0	109	R140	R140-S143 WeakPolarHBondContact CD-OG 3.32Å; R140-S143 PolarHBondContact O-N 3.24Å
144	G	55.5	Low	60.8	Low	53 Å²	53	116 Å²	116	55%	0.546	59%	0.593	S	S	.	*			trans	-46.9	160.7	165.3	0	0	0	0	0	111.3	S142 R146	S142-G144 PolarHBondContact O-N 3.17Å; G144-R146 PolarHBondContact O-N 3.17Å
145	P	56.7	Low	60	Low	134 Å²	134	122.3 Å²	122.3	87%	0.87	61%	0.612	S	S	*	*			trans	-43.2	108.8	-163.5	-26.4	31	0	0	0	110.5	S147	P145-S147 PolarHBondContact O-N 3.06Å
146	R	58.1	Low	59	Low	186 Å²	186	124.9 Å²	124.9	70%	0.702	64%	0.644	S	S	*	*			trans	-74.3	65.5	176.6	-156.3	175.3	-174.5	-171.9	4.5	107	C134 G144 R148	C134-R146 PolarHBondContact O-NH1 3.4Å; C134-R146 VanDerWaalsContact O-NH1 3.1Å; G144-R146 PolarHBondContact O-N 3.17Å; R146-R148 PolarHBondContact O-N 2.71Å
147	S	54.8	Low	58.4	Low	98 Å²	98	122.9 Å²	122.9	69%	0.685	65%	0.651	S	S	*	*			trans	-53.8	112.6	168.2	179.8	0	0	0	0	104.7	P145 R149	P145-S147 PolarHBondContact O-N 3.06Å; S147-R149 PolarHBondContact O-N 2.93Å
148	R	57.9	Low	58.1	Low	182 Å²	182	129 Å²	129	69%	0.687	68%	0.682	S	S	*	*			trans	-56.9	91.4	167.2	-90.8	-177.2	-81.7	160.8	-4.6	104.8	R146 T150	R146-R148 PolarHBondContact O-N 2.71Å; R148-T150 VanDerWaalsContact C-N 3.29Å; R148-T150 PolarHBondContact O-N 2.81Å
149	R	53.4	Low	57.9	Low	231 Å²	231	136.7 Å²	136.7	87%	0.872	71%	0.714	S	S	*	*			trans	-53.2	108.6	161.3	-87.9	-172.2	171.6	171.5	-1.1	103.6	S147 R151	S147-R149 PolarHBondContact O-N 2.93Å; R149-R151 PolarHBondContact O-N 2.76Å
150	T	60.1	Low	58.4	Low	114 Å²	114	144.9 Å²	144.9	70%	0.699	74%	0.74	S	S	*	*			trans	-51	117.1	168.5	97.2	0	0	0	0	102.8	R148 R152	R148-T150 VanDerWaalsContact C-N 3.29Å; R148-T150 PolarHBondContact O-N 2.81Å; T150-R152 PolarHBondContact O-N 2.95Å
151	R	59	Low	59.2	Low	234 Å²	234	145.8 Å²	145.8	88%	0.883	76%	0.757	S	S	*	*			trans	-61.6	93.4	174.4	-83.4	-95.8	-173.8	173.3	0.1	103.6	R149 N153	R149-R151 PolarHBondContact O-N 2.76Å; R151-N153 PolarHBondContact O-N 3.03Å
152	R	57	Low	60.5	Low	229 Å²	229	150.9 Å²	150.9	86%	0.864	76%	0.758	S	S	*	*			trans	-49.7	114.6	169.7	-69	178.6	172.1	158.8	-3.3	104.3	T150 A154	T150-R152 PolarHBondContact O-N 2.95Å; R152-A154 PolarHBondContact O-N 3.13Å
153	N	51.5	Low	62.1	Low	145 Å²	145	151 Å²	151	78%	0.775	76%	0.755	S	S	*	*			trans	-31.2	109.1	-173.6	-79.6	-9.5	0	0	0	110.4	R151 K155	R151-N153 PolarHBondContact O-N 3.03Å; N153-K155 HydrophobicContact CB-CG 4.49Å; N153-K155 PolarHBondContact O-N 2.66Å
154	A	58.3	Low	64	Low	94 Å²	94	152.5 Å²	152.5	78%	0.777	77%	0.771	S	S	*	*			trans	-66.3	83.9	161.1	0	0	0	0	0	105.8	R152 G156	R152-A154 PolarHBondContact O-N 3.13Å; A154-G156 PolarHBondContact O-N 3.37Å
155	K	56.2	Low	65.9	Low	201 Å²	201	152.6 Å²	152.6	87%	0.874	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	116.3	164	-70.3	176.6	175.1	-180	0	105.6	N153	N153-K155 HydrophobicContact CB-CG 4.49Å; N153-K155 PolarHBondContact O-N 2.66Å
156	G	57	Low	67.8	Low	82 Å²	82	149.9 Å²	149.9	85%	0.845	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	121.5	23.3	165.9	0	0	0	0	0	118	A154	A154-G156 PolarHBondContact O-N 3.37Å
157	A	58.4	Low	69.6	Low	65 Å²	65	144.9 Å²	144.9	54%	0.537	73%	0.731	S	S	.	*			trans	-108.6	119.6	158	0	0	0	0	0	108.1	K159	A157-K159 HydrophobicContact CB-CG 4.24Å; A157-K159 PolarHBondContact O-N 3.03Å
158	E	62.4	Low	71.6	Confident	200 Å²	200	148.5 Å²	148.5	94%	0.935	74%	0.735	S	S	*	*			trans	-48.6	35.7	174.8	-140	86.7	-150.6	0	0	115.6	R160	E158-R160 PolarHBondContact O-N 3.32Å
159	K	69.5	Low	73.5	Confident	174 Å²	174	141.3 Å²	141.3	76%	0.757	71%	0.709	S	S	*	*			trans	-77.6	121.4	-178.2	-63.6	-174.7	-179.4	-171.3	0	107.4	A157	A157-K159 HydrophobicContact CB-CG 4.24Å; A157-K159 PolarHBondContact O-N 3.03Å
160	R	73.9	Confident	75.6	Confident	232 Å²	232	132.5 Å²	132.5	88%	0.875	68%	0.679	S	S	*	*			trans	-37.6	126.6	176.7	-165	176.8	-175.8	104.6	-2	109.7	E158 R162	E158-R160 PolarHBondContact O-N 3.32Å; R160-R162 PolarHBondContact O-N 2.84Å
161	P	81.3	Confident	77.4	Confident	107 Å²	107	130.2 Å²	130.2	70%	0.695	66%	0.662	S	S	*	*			trans	-54.3	133.1	-175.5	21	-32.5	0	0	0	109.9	T163	P161-T163 PolarHBondContact O-N 3.21Å
162	R	84.5	Confident	79.2	Confident	250 Å²	250	123.1 Å²	123.1	94%	0.943	64%	0.636	S	S	*	*			trans	-67.2	115	172.9	-73.4	-176.6	178.3	-95.4	-0.8	107.9	R160	R160-R162 PolarHBondContact O-N 2.84Å
163	T	86.4	Confident	81.1	Confident	98 Å²	98	112.2 Å²	112.2	60%	0.601	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-81.8	132.2	172.2	56.4	0	0	0	0	109.6	P161	P161-T163 PolarHBondContact O-N 3.21Å
164	A	92.5	Very high	83.3	Confident	94 Å²	94	110.7 Å²	110.7	78%	0.777	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-101.2	137.8	170.4	0	0	0	0	0	109.4
165	F	94.6	Very high	85.2	Confident	54 Å²	54	109.4 Å²	109.4	24%	0.237	56%	0.562	C	S	.	*	P	Polyproline II helix	trans	-78.8	148	171.7	-57.4	-49.2	0	0	0	110.3	Q169 L170 L197 Q201 W205	F165-Q169 HydrophobicContact CB-CB 4.23Å; F165-L170 HydrophobicContact CB-CD2 3.93Å; F165-L170 HydrophobicContact CB-CG 4Å; F165-L170 HydrophobicContact CD2-CD2 4.05Å; F165-L170 HydrophobicContact CG-CD2 4.47Å; F165-L197 HydrophobicContact CD1-CD1 3.84Å; F165-L197 HydrophobicContact CD1-CD2 3.88Å; F165-L197 HydrophobicContact CE1-CD1 3.83Å; F165-L197 HydrophobicContact CE1-CD2 3.84Å; F165-L197 HydrophobicContact CE1-CG 4.47Å; F165-Q201 HydrophobicContact CE1-CB 4.21Å; F165-Q201 HydrophobicContact CZ-CB 4.04Å; F165-W205 AromaticContact CD2-CD1 3.85Å; F165-W205 HydrophobicContact CE2-CB 4.27Å; F165-W205 AromaticContact CE2-CD1 3.67Å; F165-W205 HydrophobicContact CE2-CG 4.31Å
166	T	96.7	Very high	87.1	Confident	77 Å²	77	100.1 Å²	100.1	47%	0.472	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-72	162.2	174	68.6	0	0	0	0	110.9	K168 Q169 L170	T166-K168 VanDerWaalsContact C-N 3.34Å; T166-K168 PolarHBondContact O-N 3.06Å; T166-Q169 PolarHBondContact O-N 3.46Å; T166-Q169 VanDerWaalsContact OG1-CG 3.25Å; T166-Q169 WeakPolarHBondContact OG1-CG 3.42Å; T166-Q169 PolarHBondContact OG1-N 3.49Å; T166-Q169 PolarHBondContact OG1-OE1 3.23Å; T166-L170 WeakPolarHBondContact O-CG 3.33Å; T166-L170 PolarHBondContact O-N 3.01Å
167	S	96.9	Very high	89	Confident	81 Å²	81	96.5 Å²	96.5	57%	0.566	48%	0.483	S	S	*	.	H	α-helix	trans	-57.8	-47.9	176.5	-163.5	0	0	0	0	111.3	Q169 L170 D171	S167-Q169 VanDerWaalsContact C-N 3.28Å; S167-Q169 PolarHBondContact O-N 3.03Å; S167-L170 CarbonylContact O-C 3.46Å; S167-L170 WeakPolarHBondContact O-CA 3.48Å; S167-L170 WeakPolarHBondContact O-CB 3.31Å; S167-L170 PolarHBondContact O-N 3.32Å; S167-D171 PolarHBondContact O-N 2.83Å; S167-D171 PolarHBondContact OG-OD2 3.14Å
168	K	96.7	Very high	90.8	Very high	175 Å²	175	100.5 Å²	100.5	76%	0.761	49%	0.491	S	S	*	.	H	α-helix	trans	-54.8	-42.4	177.7	-173.9	-179	178.6	-175.8	0	112.5	T166 D171 R172	T166-K168 VanDerWaalsContact C-N 3.34Å; T166-K168 PolarHBondContact O-N 3.06Å; K168-D171 PolarHBondContact O-N 3.34Å; K168-R172 PolarHBondContact O-N 3.35Å
169	Q	97.3	Very high	92.4	Very high	31 Å²	31	98.5 Å²	98.5	15%	0.145	48%	0.481	C	S	.	.	H	α-helix	trans	-64	-44.5	175.6	-74.1	170.2	-24.3	0	0	111.7	F165 T166 S167 D171 L173 L195 L197	F165-Q169 HydrophobicContact CB-CB 4.23Å; T166-Q169 PolarHBondContact O-N 3.46Å; T166-Q169 VanDerWaalsContact OG1-CG 3.25Å; T166-Q169 WeakPolarHBondContact OG1-CG 3.42Å; T166-Q169 PolarHBondContact OG1-N 3.49Å; T166-Q169 PolarHBondContact OG1-OE1 3.23Å; S167-Q169 VanDerWaalsContact C-N 3.28Å; S167-Q169 PolarHBondContact O-N 3.03Å; Q169-D171 VanDerWaalsContact C-N 3.33Å; Q169-D171 PolarHBondContact O-N 3.1Å; Q169-L173 WeakPolarHBondContact O-CB 3.42Å; Q169-L173 WeakPolarHBondContact O-CD1 3.22Å; Q169-L173 WeakPolarHBondContact O-CG 3.47Å; Q169-L173 PolarHBondContact O-N 3.12Å; Q169-L173 VanDerWaalsContact O-N 3.08Å; Q169-L195 HydrophobicContact CG-CB 4.33Å; Q169-L195 HydrophobicContact CG-CD2 4.29Å; Q169-L195 PolarHBondContact NE2-O 3.04Å; Q169-L197 HydrophobicContact CG-CD1 4.38Å
170	L	97.5	Very high	93.6	Very high	45 Å²	45	94 Å²	94	24%	0.236	47%	0.466	C	S	.	.	H	α-helix	trans	-64	-38.5	178.1	-68.6	173.4	0	0	0	112.3	F165 T166 S167 L173 R174	F165-L170 HydrophobicContact CB-CD2 3.93Å; F165-L170 HydrophobicContact CB-CG 4Å; F165-L170 HydrophobicContact CD2-CD2 4.05Å; F165-L170 HydrophobicContact CG-CD2 4.47Å; T166-L170 WeakPolarHBondContact O-CG 3.33Å; T166-L170 PolarHBondContact O-N 3.01Å; S167-L170 CarbonylContact O-C 3.46Å; S167-L170 WeakPolarHBondContact O-CA 3.48Å; S167-L170 WeakPolarHBondContact O-CB 3.31Å; S167-L170 PolarHBondContact O-N 3.32Å; L170-L173 PolarHBondContact O-N 2.9Å; L170-R174 WeakPolarHBondContact O-CB 3.39Å; L170-R174 WeakPolarHBondContact O-CD 3.34Å; L170-R174 WeakPolarHBondContact O-CG 3.25Å; L170-R174 PolarHBondContact O-N 3.41Å
171	D	97.5	Very high	94.6	Very high	66 Å²	66	88.2 Å²	88.2	35%	0.353	44%	0.444	S	S	.	.	H	α-helix	trans	-66.6	-47.1	-178.8	-63.2	-32.3	0	0	0	111.2	S167 K168 Q169 L173 R174 C175	S167-D171 PolarHBondContact O-N 2.83Å; S167-D171 PolarHBondContact OG-OD2 3.14Å; K168-D171 PolarHBondContact O-N 3.34Å; Q169-D171 VanDerWaalsContact C-N 3.33Å; Q169-D171 PolarHBondContact O-N 3.1Å; D171-L173 PolarHBondContact O-N 3.43Å; D171-R174 WeakPolarHBondContact O-CB 3.47Å; D171-R174 PolarHBondContact O-N 3.29Å; D171-R174 VanDerWaalsContact O-N 3.14Å; D171-R174 IonicContact OD1-CZ 3.77Å; D171-R174 IonicContact OD1-NH1 2.72Å; D171-R174 PolarHBondContact OD1-NH1 3.31Å; D171-C175 PolarHBondContact O-N 3.47Å; D171-C175 PolarHBondContact O-SG 3.23Å; D171-C175 VanDerWaalsContact O-SG 3.32Å
172	R	97.1	Very high	95.4	Very high	86 Å²	86	89.5 Å²	89.5	33%	0.325	44%	0.436	S	S	.	.	H	α-helix	trans	-58.9	-46.6	172.7	-180	56.1	165.2	173.1	-4.9	111.9	K168 R174 C175 E176 L191 E194 L195	K168-R172 PolarHBondContact O-N 3.35Å; R172-R174 VanDerWaalsContact C-N 3.25Å; R172-R174 PolarHBondContact O-N 2.86Å; R172-C175 PolarHBondContact O-N 3.37Å; R172-E176 IonicContact CZ-OE1 3.47Å; R172-E176 IonicContact NE-OE1 3.94Å; R172-E176 IonicContact NH1-OE1 3.51Å; R172-E176 PolarHBondContact NH1-OE1 2.94Å; R172-E176 IonicContact NH2-OE1 2.94Å; R172-E176 PolarHBondContact NH2-OE1 2.99Å; R172-E176 VanDerWaalsContact O-CG 3.32Å; R172-E176 WeakPolarHBondContact O-CG 3.37Å; R172-E176 PolarHBondContact O-N 2.83Å; R172-L191 HydrophobicContact CG-CD2 4.31Å; R172-E194 IonicContact CZ-OE2 3.95Å; R172-E194 VanDerWaalsContact CZ-OE2 3.28Å; R172-E194 IonicContact NE-OE2 3Å; R172-E194 PolarHBondContact NE-OE2 3.22Å; R172-E194 IonicContact NH2-OE1 3.68Å; R172-E194 PolarHBondContact NH2-OE1 3.07Å; R172-E194 IonicContact NH2-OE2 3.29Å; R172-E194 PolarHBondContact NH2-OE2 3.28Å; R172-L195 HydrophobicContact CB-CD1 4.45Å; R172-L195 HydrophobicContact CB-CD2 3.86Å; R172-L195 HydrophobicContact CG-CD1 4.29Å; R172-L195 HydrophobicContact CG-CD2 3.88Å; R172-L195 HydrophobicContact CG-CG 4.37Å
173	L	97.8	Very high	95.8	Very high	0 Å²	0	79.1 Å²	79.1	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-59.4	-35.4	176.8	-74.1	170.1	0	0	0	112.6	Q169 L170 D171 F177 L195 I202 W205 F206	Q169-L173 WeakPolarHBondContact O-CB 3.42Å; Q169-L173 WeakPolarHBondContact O-CD1 3.22Å; Q169-L173 WeakPolarHBondContact O-CG 3.47Å; Q169-L173 PolarHBondContact O-N 3.12Å; Q169-L173 VanDerWaalsContact O-N 3.08Å; L170-L173 PolarHBondContact O-N 2.9Å; D171-L173 PolarHBondContact O-N 3.43Å; L173-F177 VanDerWaalsContact O-CB 3.29Å; L173-F177 WeakPolarHBondContact O-CB 3.29Å; L173-F177 PolarHBondContact O-N 3.44Å; L173-L195 HydrophobicContact CD1-CD1 4.42Å; L173-L195 HydrophobicContact CD2-CD1 3.98Å; L173-L195 HydrophobicContact CG-CD1 3.8Å; L173-I202 HydrophobicContact CD2-CD1 3.79Å; L173-I202 HydrophobicContact CD2-CG2 4.25Å; L173-W205 VanDerWaalsContact C-CH2 3.47Å; L173-W205 HydrophobicContact CB-CD2 4.08Å; L173-W205 HydrophobicContact CB-CE3 4.05Å; L173-W205 HydrophobicContact CB-CH2 3.67Å; L173-W205 HydrophobicContact CB-CZ2 3.66Å; L173-W205 HydrophobicContact CB-CZ3 3.86Å; L173-W205 HydrophobicContact CD1-CD2 3.91Å; L173-W205 HydrophobicContact CD1-CE3 4.46Å; L173-W205 HydrophobicContact CD1-CG 3.94Å; L173-W205 HydrophobicContact CD2-CD2 4.39Å; L173-W205 HydrophobicContact CD2-CE3 4.15Å; L173-W205 HydrophobicContact CG-CD2 4.37Å; L173-W205 HydrophobicContact CG-CE3 4.47Å; L173-W205 WeakPolarHBondContact O-CH2 3.42Å; L173-W205 WeakPolarHBondContact O-CZ3 3.36Å; L173-F206 HydrophobicContact CD2-CE2 4.04Å
174	R	97.4	Very high	96.3	Very high	113 Å²	113	78.3 Å²	78.3	43%	0.426	39%	0.394	S	S	.	.	H	α-helix	trans	-67.8	-46.7	176	-73.3	160.2	-176.1	171.2	-7.8	111.4	L170 D171 R172 E176 F177 Q178 W205	L170-R174 WeakPolarHBondContact O-CB 3.39Å; L170-R174 WeakPolarHBondContact O-CD 3.34Å; L170-R174 WeakPolarHBondContact O-CG 3.25Å; L170-R174 PolarHBondContact O-N 3.41Å; D171-R174 WeakPolarHBondContact O-CB 3.47Å; D171-R174 PolarHBondContact O-N 3.29Å; D171-R174 VanDerWaalsContact O-N 3.14Å; D171-R174 IonicContact OD1-CZ 3.77Å; D171-R174 IonicContact OD1-NH1 2.72Å; D171-R174 PolarHBondContact OD1-NH1 3.31Å; R172-R174 VanDerWaalsContact C-N 3.25Å; R172-R174 PolarHBondContact O-N 2.86Å; R174-E176 PolarHBondContact O-N 3.39Å; R174-F177 PolarHBondContact O-N 3.34Å; R174-Q178 WeakPolarHBondContact O-CG 3.19Å; R174-Q178 PolarHBondContact O-N 2.98Å; R174-W205 HydrophobicContact CG-CZ2 4.41Å
175	C	97.1	Very high	96.6	Very high	66 Å²	66	78.3 Å²	78.3	45%	0.446	38%	0.378	S	S	.	.	H	α-helix	trans	-57.9	-48.6	177.1	-63.9	0	0	0	0	111.2	D171 R172 F177 Q178 E179	D171-C175 PolarHBondContact O-N 3.47Å; D171-C175 PolarHBondContact O-SG 3.23Å; D171-C175 VanDerWaalsContact O-SG 3.32Å; R172-C175 PolarHBondContact O-N 3.37Å; C175-F177 VanDerWaalsContact C-N 3.29Å; C175-F177 PolarHBondContact O-N 3.48Å; C175-Q178 WeakPolarHBondContact O-CB 3.46Å; C175-Q178 PolarHBondContact O-N 2.82Å; C175-Q178 VanDerWaalsContact O-N 3.12Å; C175-E179 PolarHBondContact O-N 2.88Å; C175-E179 VanDerWaalsContact O-N 3.1Å
176	E	96.9	Very high	96.7	Very high	6 Å²	6	82.6 Å²	82.6	3%	0.028	40%	0.396	C	S	.	.	H	α-helix	trans	-60.8	-38.7	177.2	-67.4	-64.1	139.6	0	0	112.8	R172 R174 Q178 E179 N180 R187 L191 F206	R172-E176 IonicContact CZ-OE1 3.47Å; R172-E176 IonicContact NE-OE1 3.94Å; R172-E176 IonicContact NH1-OE1 3.51Å; R172-E176 PolarHBondContact NH1-OE1 2.94Å; R172-E176 IonicContact NH2-OE1 2.94Å; R172-E176 PolarHBondContact NH2-OE1 2.99Å; R172-E176 VanDerWaalsContact O-CG 3.32Å; R172-E176 WeakPolarHBondContact O-CG 3.37Å; R172-E176 PolarHBondContact O-N 2.83Å; R174-E176 PolarHBondContact O-N 3.39Å; E176-Q178 VanDerWaalsContact C-N 3.29Å; E176-Q178 PolarHBondContact O-N 3.43Å; E176-E179 PolarHBondContact O-N 3.45Å; E176-N180 PolarHBondContact O-N 3.28Å; E176-N180 VanDerWaalsContact O-O 3.14Å; E176-R187 IonicContact OE1-CZ 3.81Å; E176-R187 IonicContact OE1-NE 2.72Å; E176-R187 IonicContact OE1-NH2 3.11Å; E176-R187 PolarHBondContact OE1-NH2 2.85Å; E176-R187 IonicContact OE2-CZ 2.63Å; E176-R187 VanDerWaalsContact OE2-CZ 3.29Å; E176-R187 IonicContact OE2-NE 2.65Å; E176-R187 PolarHBondContact OE2-NE 2.72Å; E176-R187 IonicContact OE2-NH2 3.04Å; E176-R187 PolarHBondContact OE2-NH2 3.02Å; E176-L191 HydrophobicContact CB-CD1 4.06Å; E176-L191 HydrophobicContact CG-CD1 3.72Å; E176-L191 HydrophobicContact CG-CD2 3.55Å; E176-L191 HydrophobicContact CG-CG 4.25Å; E176-F206 HydrophobicContact CB-CZ 4.14Å
177	F	97.2	Very high	96.7	Very high	6 Å²	6	81.7 Å²	81.7	3%	0.026	38%	0.384	C	S	.	.	H	α-helix	trans	-68.3	-30.4	178.1	-172.6	-89.7	0	0	0	112.9	L173 R174 C175 N180 R181 W205 F206 K209 R210 I213	L173-F177 VanDerWaalsContact O-CB 3.29Å; L173-F177 WeakPolarHBondContact O-CB 3.29Å; L173-F177 PolarHBondContact O-N 3.44Å; R174-F177 PolarHBondContact O-N 3.34Å; C175-F177 VanDerWaalsContact C-N 3.29Å; C175-F177 PolarHBondContact O-N 3.48Å; F177-N180 CarbonylContact O-C 3.52Å; F177-R181 HydrophobicContact CE1-CG 4.28Å; F177-R181 HydrophobicContact CE2-CB 4.28Å; F177-R181 HydrophobicContact CZ-CB 4.18Å; F177-R181 HydrophobicContact CZ-CG 4.2Å; F177-W205 HydrophobicContact CB-CH2 4Å; F177-W205 HydrophobicContact CB-CZ3 3.93Å; F177-W205 HydrophobicContact CD2-CZ3 4.09Å; F177-W205 HydrophobicContact CG-CH2 4.41Å; F177-W205 HydrophobicContact CG-CZ3 4.26Å; F177-F206 HydrophobicContact CB-CE1 4.26Å; F177-F206 AromaticContact CD2-CD1 3.68Å; F177-F206 HydrophobicContact CD2-CD1 3.68Å; F177-F206 AromaticContact CD2-CE1 3.75Å; F177-F206 HydrophobicContact CD2-CE1 3.75Å; F177-F206 HydrophobicContact CE2-CD1 4.24Å; F177-F206 HydrophobicContact CG-CE1 4.5Å; F177-K209 HydrophobicContact CD1-CD 4.46Å; F177-K209 HydrophobicContact CD1-CG 3.82Å; F177-K209 HydrophobicContact CD2-CB 4.19Å; F177-K209 HydrophobicContact CD2-CG 3.63Å; F177-K209 HydrophobicContact CE1-CD 4.42Å; F177-K209 HydrophobicContact CE1-CG 3.71Å; F177-K209 HydrophobicContact CE2-CB 3.97Å; F177-K209 HydrophobicContact CE2-CG 3.5Å; F177-K209 HydrophobicContact CG-CG 3.8Å; F177-K209 HydrophobicContact CZ-CB 4.36Å; F177-K209 HydrophobicContact CZ-CG 3.55Å; F177-R210 HydrophobicContact CE2-CG 3.83Å; F177-R210 HydrophobicContact CZ-CG 4.05Å; F177-I213 HydrophobicContact CE1-CD1 3.37Å; F177-I213 HydrophobicContact CZ-CD1 3.62Å
178	Q	96	Very high	96.7	Very high	150 Å²	150	79.7 Å²	79.7	70%	0.701	36%	0.364	S	S	*	.	H	α-helix	trans	-70.4	-39.9	174.9	-73.2	168.9	-24.1	0	0	110.9	R174 C175 E176	R174-Q178 WeakPolarHBondContact O-CG 3.19Å; R174-Q178 PolarHBondContact O-N 2.98Å; C175-Q178 WeakPolarHBondContact O-CB 3.46Å; C175-Q178 PolarHBondContact O-N 2.82Å; C175-Q178 VanDerWaalsContact O-N 3.12Å; E176-Q178 VanDerWaalsContact C-N 3.29Å; E176-Q178 PolarHBondContact O-N 3.43Å
179	E	95.2	Very high	96.8	Very high	158 Å²	158	75.7 Å²	75.7	74%	0.738	35%	0.348	S	S	*	.	H	α-helix	trans	-69.8	-49	175.6	-173.9	177.6	174.9	0	0	111.9	C175 E176	C175-E179 PolarHBondContact O-N 2.88Å; C175-E179 VanDerWaalsContact O-N 3.1Å; E176-E179 PolarHBondContact O-N 3.45Å
180	N	94.7	Very high	96.8	Very high	80 Å²	80	77.3 Å²	77.3	43%	0.428	36%	0.356	S	S	.	.			trans	-142.1	120	178.3	-166.3	-11.3	0	0	0	112.6	E176 F177 Y182 F206	E176-N180 PolarHBondContact O-N 3.28Å; E176-N180 VanDerWaalsContact O-O 3.14Å; F177-N180 CarbonylContact O-C 3.52Å; N180-Y182 PolarHBondContact ND2-O 2.98Å; N180-Y182 PolarHBondContact O-N 2.89Å; N180-Y182 PolarHBondContact OD1-N 2.96Å; N180-Y182 PolarHBondContact OD1-O 3.43Å; N180-F206 WeakPolarHBondContact O-CE1 3.42Å
181	R	95.1	Very high	96.8	Very high	110 Å²	110	75.2 Å²	75.2	42%	0.415	35%	0.345	S	S	.	.	S	Bend	trans	-74	-16	-178.7	-55.9	178.4	81.6	101.2	-11.5	112.9	F177 R210	F177-R181 HydrophobicContact CE1-CG 4.28Å; F177-R181 HydrophobicContact CE2-CB 4.28Å; F177-R181 HydrophobicContact CZ-CB 4.18Å; F177-R181 HydrophobicContact CZ-CG 4.2Å; R181-R210 WeakPolarHBondContact O-CD 3.45Å; R181-R210 PolarHBondContact O-NH1 2.79Å
182	Y	97.4	Very high	96.8	Very high	134 Å²	134	72.5 Å²	72.5	53%	0.525	33%	0.332	S	S	.	.	S	Bend	trans	-125.9	125.5	179.7	-65.3	-86.5	0	0	0	110.4	N180 I259	N180-Y182 PolarHBondContact ND2-O 2.98Å; N180-Y182 PolarHBondContact O-N 2.89Å; N180-Y182 PolarHBondContact OD1-N 2.96Å; N180-Y182 PolarHBondContact OD1-O 3.43Å; Y182-I259 HydrophobicContact CE2-CD1 4.44Å
183	L	94.8	Very high	96.8	Very high	31 Å²	31	73.7 Å²	73.7	16%	0.162	35%	0.352	C	S	.	.			trans	-94.8	127.8	-172.7	-161.9	65.3	0	0	0	110.8	R187 R188 L191 I202 F206	L183-R187 HydrophobicContact CD1-CB 3.63Å; L183-R187 HydrophobicContact CD1-CG 3.38Å; L183-R187 HydrophobicContact CG-CB 4.28Å; L183-R187 HydrophobicContact CG-CG 4.49Å; L183-R188 HydrophobicContact CD2-CB 3.56Å; L183-R188 HydrophobicContact CD2-CG 3.78Å; L183-R188 HydrophobicContact CG-CB 3.95Å; L183-L191 HydrophobicContact CD1-CD1 3.85Å; L183-L191 HydrophobicContact CD2-CD1 4.21Å; L183-I202 HydrophobicContact CD2-CG2 3.44Å; L183-I202 VanDerWaalsContact CD2-CG2 3.44Å; L183-F206 HydrophobicContact CB-CD1 4.36Å; L183-F206 HydrophobicContact CB-CE1 4.36Å; L183-F206 HydrophobicContact CD1-CE1 4.49Å; L183-F206 HydrophobicContact CD1-CE2 4.49Å; L183-F206 HydrophobicContact CD1-CZ 4.11Å; L183-F206 HydrophobicContact CD2-CD2 4.11Å; L183-F206 HydrophobicContact CD2-CE2 3.92Å; L183-F206 HydrophobicContact CD2-CZ 4.31Å
184	T	96.8	Very high	96.8	Very high	82 Å²	82	78.5 Å²	78.5	50%	0.503	37%	0.374	S	S	.	.			trans	-70.3	165.2	169.5	61.5	0	0	0	0	110.8	R187 R188	T184-R187 WeakPolarHBondContact OG1-CB 3.14Å; T184-R187 PolarHBondContact OG1-N 3.32Å; T184-R188 WeakPolarHBondContact O-CB 3.36Å; T184-R188 PolarHBondContact O-N 2.82Å; T184-R188 VanDerWaalsContact O-N 3.1Å
185	E	97.3	Very high	96.7	Very high	94 Å²	94	74.2 Å²	74.2	44%	0.439	36%	0.36	S	S	.	.	H	α-helix	trans	-58.7	-51.4	176.1	-167.2	64.3	-150.5	0	0	111.4	R187 R188 Q189	E185-R187 PolarHBondContact O-N 3.49Å; E185-R188 VanDerWaalsContact CD-NH1 3.27Å; E185-R188 VanDerWaalsContact O-CB 3.32Å; E185-R188 WeakPolarHBondContact O-CB 3.46Å; E185-R188 PolarHBondContact O-N 2.69Å; E185-R188 VanDerWaalsContact O-N 3.13Å; E185-R188 IonicContact OE1-CZ 3.28Å; E185-R188 IonicContact OE1-NH1 2.79Å; E185-R188 PolarHBondContact OE1-NH1 3.09Å; E185-R188 VanDerWaalsContact OE1-NH1 3.11Å; E185-R188 IonicContact OE2-CZ 3.74Å; E185-R188 IonicContact OE2-NH1 3.77Å; E185-R188 PolarHBondContact OE2-NH1 3.26Å; E185-R188 IonicContact OE2-NH2 2.74Å; E185-R188 PolarHBondContact OE2-NH2 3.25Å; E185-Q189 PolarHBondContact O-N 3.17Å; E185-Q189 VanDerWaalsContact O-N 3.11Å
186	K	97.1	Very high	96.7	Very high	144 Å²	144	74.3 Å²	74.3	63%	0.626	37%	0.372	S	S	*	.	H	α-helix	trans	-56.8	-49.4	179.7	-174.5	-176.9	178.1	-173.2	0	112.4	R188 Q189 E190	K186-R188 PolarHBondContact O-N 3.48Å; K186-Q189 PolarHBondContact O-N 3.06Å; K186-E190 WeakPolarHBondContact CE-OE1 3.29Å; K186-E190 WeakPolarHBondContact O-CG 3.35Å; K186-E190 PolarHBondContact O-N 2.85Å
187	R	97.1	Very high	96.6	Very high	57 Å²	57	75 Å²	75	22%	0.215	38%	0.376	C	S	.	.	H	α-helix	trans	-65.3	-31.3	-179.3	-168.2	69.7	-169.3	140.9	-2.6	111.9	E176 L183 T184 E185 E190 L191 E194	E176-R187 IonicContact OE1-CZ 3.81Å; E176-R187 IonicContact OE1-NE 2.72Å; E176-R187 IonicContact OE1-NH2 3.11Å; E176-R187 PolarHBondContact OE1-NH2 2.85Å; E176-R187 IonicContact OE2-CZ 2.63Å; E176-R187 VanDerWaalsContact OE2-CZ 3.29Å; E176-R187 IonicContact OE2-NE 2.65Å; E176-R187 PolarHBondContact OE2-NE 2.72Å; E176-R187 IonicContact OE2-NH2 3.04Å; E176-R187 PolarHBondContact OE2-NH2 3.02Å; L183-R187 HydrophobicContact CD1-CB 3.63Å; L183-R187 HydrophobicContact CD1-CG 3.38Å; L183-R187 HydrophobicContact CG-CB 4.28Å; L183-R187 HydrophobicContact CG-CG 4.49Å; T184-R187 WeakPolarHBondContact OG1-CB 3.14Å; T184-R187 PolarHBondContact OG1-N 3.32Å; E185-R187 PolarHBondContact O-N 3.49Å; R187-E190 WeakPolarHBondContact CD-OE2 3.21Å; R187-E190 IonicContact CZ-OE2 3.28Å; R187-E190 IonicContact NE-OE2 2.92Å; R187-E190 IonicContact NH1-OE2 2.78Å; R187-E190 PolarHBondContact NH1-OE2 3.46Å; R187-L191 HydrophobicContact CG-CD1 4.45Å; R187-L191 WeakPolarHBondContact O-CG 3.39Å; R187-L191 PolarHBondContact O-N 3.02Å; R187-E194 IonicContact NH1-OE1 2.98Å
188	R	97.9	Very high	96.6	Very high	40 Å²	40	80 Å²	80	15%	0.151	40%	0.402	C	S	.	.	H	α-helix	trans	-64.9	-43.5	174.5	-169.4	-167.7	-43.3	145.2	14.5	112.6	L183 T184 E185 K186 L191 A192 E199 I202	L183-R188 HydrophobicContact CD2-CB 3.56Å; L183-R188 HydrophobicContact CD2-CG 3.78Å; L183-R188 HydrophobicContact CG-CB 3.95Å; T184-R188 WeakPolarHBondContact O-CB 3.36Å; T184-R188 PolarHBondContact O-N 2.82Å; T184-R188 VanDerWaalsContact O-N 3.1Å; E185-R188 VanDerWaalsContact CD-NH1 3.27Å; E185-R188 VanDerWaalsContact O-CB 3.32Å; E185-R188 WeakPolarHBondContact O-CB 3.46Å; E185-R188 PolarHBondContact O-N 2.69Å; E185-R188 VanDerWaalsContact O-N 3.13Å; E185-R188 IonicContact OE1-CZ 3.28Å; E185-R188 IonicContact OE1-NH1 2.79Å; E185-R188 PolarHBondContact OE1-NH1 3.09Å; E185-R188 VanDerWaalsContact OE1-NH1 3.11Å; E185-R188 IonicContact OE2-CZ 3.74Å; E185-R188 IonicContact OE2-NH1 3.77Å; E185-R188 PolarHBondContact OE2-NH1 3.26Å; E185-R188 IonicContact OE2-NH2 2.74Å; E185-R188 PolarHBondContact OE2-NH2 3.25Å; K186-R188 PolarHBondContact O-N 3.48Å; R188-L191 PolarHBondContact O-N 2.92Å; R188-A192 VanDerWaalsContact O-CB 3.29Å; R188-A192 WeakPolarHBondContact O-CB 3.38Å; R188-A192 PolarHBondContact O-N 3.32Å; R188-E199 HydrophobicContact CG-CB 4.09Å; R188-E199 HydrophobicContact CG-CG 4.28Å; R188-I202 HydrophobicContact CG-CB 4.27Å; R188-I202 HydrophobicContact CG-CG2 4.26Å
189	Q	97.8	Very high	96.7	Very high	90 Å²	90	76 Å²	76	42%	0.421	38%	0.384	S	S	.	.	H	α-helix	trans	-63	-46.2	176.6	-68.7	173.3	-12.8	0	0	110.8	E185 K186 L191 A192 C193 E199	E185-Q189 PolarHBondContact O-N 3.17Å; E185-Q189 VanDerWaalsContact O-N 3.11Å; K186-Q189 PolarHBondContact O-N 3.06Å; Q189-L191 PolarHBondContact O-N 3.46Å; Q189-A192 WeakPolarHBondContact O-CB 3.41Å; Q189-A192 PolarHBondContact O-N 3.39Å; Q189-C193 PolarHBondContact O-N 3.27Å; Q189-C193 PolarHBondContact O-SG 2.92Å; Q189-C193 VanDerWaalsContact O-SG 3.38Å; Q189-E199 WeakPolarHBondContact CG-OE2 3.43Å
190	E	97.6	Very high	96.7	Very high	66 Å²	66	72 Å²	72	31%	0.308	37%	0.373	S	S	.	.	H	α-helix	trans	-56.9	-49.2	176.5	-69.6	169.3	-174.7	0	0	111.8	K186 R187 A192 C193 E194	K186-E190 WeakPolarHBondContact CE-OE1 3.29Å; K186-E190 WeakPolarHBondContact O-CG 3.35Å; K186-E190 PolarHBondContact O-N 2.85Å; R187-E190 WeakPolarHBondContact CD-OE2 3.21Å; R187-E190 IonicContact CZ-OE2 3.28Å; R187-E190 IonicContact NE-OE2 2.92Å; R187-E190 IonicContact NH1-OE2 2.78Å; R187-E190 PolarHBondContact NH1-OE2 3.46Å; E190-A192 PolarHBondContact O-N 3.25Å; E190-C193 PolarHBondContact O-N 3.06Å; E190-E194 WeakPolarHBondContact O-CB 3.47Å; E190-E194 WeakPolarHBondContact O-CG 3.44Å; E190-E194 PolarHBondContact O-N 3.26Å
191	L	97.5	Very high	96.8	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-66.4	-34.8	178.3	-68.6	177.6	0	0	0	113.6	R172 E176 L183 R187 R188 Q189 L195 F206	R172-L191 HydrophobicContact CG-CD2 4.31Å; E176-L191 HydrophobicContact CB-CD1 4.06Å; E176-L191 HydrophobicContact CG-CD1 3.72Å; E176-L191 HydrophobicContact CG-CD2 3.55Å; E176-L191 HydrophobicContact CG-CG 4.25Å; L183-L191 HydrophobicContact CD1-CD1 3.85Å; L183-L191 HydrophobicContact CD2-CD1 4.21Å; R187-L191 HydrophobicContact CG-CD1 4.45Å; R187-L191 WeakPolarHBondContact O-CG 3.39Å; R187-L191 PolarHBondContact O-N 3.02Å; R188-L191 PolarHBondContact O-N 2.92Å; Q189-L191 PolarHBondContact O-N 3.46Å; L191-L195 VanDerWaalsContact O-CB 3.28Å; L191-L195 WeakPolarHBondContact O-CB 3.26Å; L191-L195 WeakPolarHBondContact O-CG 3.49Å; L191-L195 PolarHBondContact O-N 2.82Å; L191-F206 HydrophobicContact CD1-CE2 4.42Å
192	A	97.6	Very high	96.9	Very high	10 Å²	10	65 Å²	65	8%	0.083	34%	0.342	C	S	.	.	H	α-helix	trans	-61.3	-46.7	175.1	0	0	0	0	0	110.7	R188 Q189 E190 G196 L197 E199 I202	R188-A192 VanDerWaalsContact O-CB 3.29Å; R188-A192 WeakPolarHBondContact O-CB 3.38Å; R188-A192 PolarHBondContact O-N 3.32Å; Q189-A192 WeakPolarHBondContact O-CB 3.41Å; Q189-A192 PolarHBondContact O-N 3.39Å; E190-A192 PolarHBondContact O-N 3.25Å; A192-G196 PolarHBondContact O-N 3.33Å; A192-L197 CarbonylContact C-O 3.6Å; A192-L197 WeakPolarHBondContact CA-O 3.12Å; A192-L197 VanDerWaalsContact CB-O 3.23Å; A192-L197 WeakPolarHBondContact CB-O 3.36Å; A192-L197 PolarHBondContact O-N 3.38Å; A192-E199 HydrophobicContact CB-CG 3.81Å; A192-I202 HydrophobicContact CB-CG1 4.49Å
193	C	97.3	Very high	96.9	Very high	111 Å²	111	63.6 Å²	63.6	75%	0.75	34%	0.339	S	S	*	.	H	α-helix	trans	-64.5	-48.3	175.7	-66.3	0	0	0	0	112.4	Q189 E190 L195 G196	Q189-C193 PolarHBondContact O-N 3.27Å; Q189-C193 PolarHBondContact O-SG 2.92Å; Q189-C193 VanDerWaalsContact O-SG 3.38Å; E190-C193 PolarHBondContact O-N 3.06Å; C193-L195 VanDerWaalsContact C-N 3.3Å; C193-L195 PolarHBondContact O-N 3.5Å; C193-G196 PolarHBondContact O-N 3.3Å
194	E	96.9	Very high	96.9	Very high	100 Å²	100	66 Å²	66	47%	0.467	35%	0.351	S	S	.	.	H	α-helix	trans	-60.2	-37.2	-179.4	-75.2	177.8	-159.3	0	0	112.8	R172 R187 E190	R172-E194 IonicContact CZ-OE2 3.95Å; R172-E194 VanDerWaalsContact CZ-OE2 3.28Å; R172-E194 IonicContact NE-OE2 3Å; R172-E194 PolarHBondContact NE-OE2 3.22Å; R172-E194 IonicContact NH2-OE1 3.68Å; R172-E194 PolarHBondContact NH2-OE1 3.07Å; R172-E194 IonicContact NH2-OE2 3.29Å; R172-E194 PolarHBondContact NH2-OE2 3.28Å; R187-E194 IonicContact NH1-OE1 2.98Å; E190-E194 WeakPolarHBondContact O-CB 3.47Å; E190-E194 WeakPolarHBondContact O-CG 3.44Å; E190-E194 PolarHBondContact O-N 3.26Å
195	L	96.4	Very high	97	Very high	24 Å²	24	63.6 Å²	63.6	13%	0.126	33%	0.333	C	S	.	.	H	α-helix	trans	-98.5	-7.7	-173.2	-62.8	-177.7	0	0	0	114.5	Q169 R172 L173 L191 C193 L197 I202	Q169-L195 HydrophobicContact CG-CB 4.33Å; Q169-L195 HydrophobicContact CG-CD2 4.29Å; Q169-L195 PolarHBondContact NE2-O 3.04Å; R172-L195 HydrophobicContact CB-CD1 4.45Å; R172-L195 HydrophobicContact CB-CD2 3.86Å; R172-L195 HydrophobicContact CG-CD1 4.29Å; R172-L195 HydrophobicContact CG-CD2 3.88Å; R172-L195 HydrophobicContact CG-CG 4.37Å; L173-L195 HydrophobicContact CD1-CD1 4.42Å; L173-L195 HydrophobicContact CD2-CD1 3.98Å; L173-L195 HydrophobicContact CG-CD1 3.8Å; L191-L195 VanDerWaalsContact O-CB 3.28Å; L191-L195 WeakPolarHBondContact O-CB 3.26Å; L191-L195 WeakPolarHBondContact O-CG 3.49Å; L191-L195 PolarHBondContact O-N 2.82Å; C193-L195 VanDerWaalsContact C-N 3.3Å; C193-L195 PolarHBondContact O-N 3.5Å; L195-L197 VanDerWaalsContact C-N 3.32Å; L195-L197 HydrophobicContact CB-CB 4.42Å; L195-L197 HydrophobicContact CB-CD1 3.98Å; L195-L197 HydrophobicContact CB-CG 3.97Å; L195-L197 HydrophobicContact CD1-CD1 4.27Å; L195-I202 HydrophobicContact CD1-CD1 4.18Å
196	G	96	Very high	97	Very high	67 Å²	67	59.2 Å²	59.2	69%	0.691	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	39.7	-172.4	0	0	0	0	0	112.3	A192 C193	A192-G196 PolarHBondContact O-N 3.33Å; C193-G196 PolarHBondContact O-N 3.3Å
197	L	95.5	Very high	97	Very high	21 Å²	21	56.6 Å²	56.6	11%	0.11	30%	0.303	C	S	.	.			trans	-119.6	156.7	-178.2	-66.3	179.8	0	0	0	110.4	F165 Q169 A192 L195 I202	F165-L197 HydrophobicContact CD1-CD1 3.84Å; F165-L197 HydrophobicContact CD1-CD2 3.88Å; F165-L197 HydrophobicContact CE1-CD1 3.83Å; F165-L197 HydrophobicContact CE1-CD2 3.84Å; F165-L197 HydrophobicContact CE1-CG 4.47Å; Q169-L197 HydrophobicContact CG-CD1 4.38Å; A192-L197 CarbonylContact C-O 3.6Å; A192-L197 WeakPolarHBondContact CA-O 3.12Å; A192-L197 VanDerWaalsContact CB-O 3.23Å; A192-L197 WeakPolarHBondContact CB-O 3.36Å; A192-L197 PolarHBondContact O-N 3.38Å; L195-L197 VanDerWaalsContact C-N 3.32Å; L195-L197 HydrophobicContact CB-CB 4.42Å; L195-L197 HydrophobicContact CB-CD1 3.98Å; L195-L197 HydrophobicContact CB-CG 3.97Å; L195-L197 HydrophobicContact CD1-CD1 4.27Å; L197-I202 HydrophobicContact CB-CD1 4Å; L197-I202 HydrophobicContact CB-CG1 4.46Å; L197-I202 HydrophobicContact CD1-CD1 3.83Å
198	N	96.3	Very high	97	Very high	110 Å²	110	58.7 Å²	58.7	59%	0.588	32%	0.318	S	S	*	.			trans	-75.1	144.7	172.6	-63.6	-82.8	0	0	0	110.6	S200 Q201 I202	N198-S200 PolarHBondContact O-N 3.25Å; N198-S200 VanDerWaalsContact O-N 3.14Å; N198-Q201 HydrophobicContact CB-CG 4.16Å; N198-Q201 PolarHBondContact ND2-OE1 3.32Å; N198-Q201 WeakPolarHBondContact O-CA 2.95Å; N198-Q201 VanDerWaalsContact O-CB 3.3Å; N198-Q201 WeakPolarHBondContact O-CB 3.43Å; N198-Q201 PolarHBondContact O-N 3.02Å; N198-I202 PolarHBondContact O-N 3.44Å
199	E	97.5	Very high	97	Very high	67 Å²	67	59.5 Å²	59.5	31%	0.313	32%	0.322	S	S	.	.	H	α-helix	trans	-52.9	-38.4	175.7	-69.5	-170.9	-110.9	0	0	113.3	R188 Q189 A192 Q201 I202 K203	R188-E199 HydrophobicContact CG-CB 4.09Å; R188-E199 HydrophobicContact CG-CG 4.28Å; Q189-E199 WeakPolarHBondContact CG-OE2 3.43Å; A192-E199 HydrophobicContact CB-CG 3.81Å; E199-Q201 VanDerWaalsContact C-N 3.31Å; E199-Q201 PolarHBondContact O-N 2.99Å; E199-I202 PolarHBondContact O-N 2.95Å; E199-K203 WeakPolarHBondContact O-CB 3Å; E199-K203 PolarHBondContact O-N 3.48Å
200	S	96.4	Very high	97	Very high	73 Å²	73	58.2 Å²	58.2	51%	0.51	31%	0.314	S	S	.	.	H	α-helix	trans	-60.9	-38.1	175	-178.1	0	0	0	0	112.3	N198 K203 I204	N198-S200 PolarHBondContact O-N 3.25Å; N198-S200 VanDerWaalsContact O-N 3.14Å; S200-K203 PolarHBondContact O-N 3.35Å; S200-I204 WeakPolarHBondContact O-CB 3.25Å; S200-I204 WeakPolarHBondContact O-CD1 3.13Å; S200-I204 VanDerWaalsContact O-CG1 3.22Å; S200-I204 WeakPolarHBondContact O-CG1 3.44Å; S200-I204 PolarHBondContact O-N 3.27Å
201	Q	96.3	Very high	96.9	Very high	42 Å²	42	57.4 Å²	57.4	20%	0.196	32%	0.319	C	S	.	.	H	α-helix	trans	-66.6	-41.9	176.9	-68.3	173.7	-60.7	0	0	111.2	F165 N198 E199 I204 W205	F165-Q201 HydrophobicContact CE1-CB 4.21Å; F165-Q201 HydrophobicContact CZ-CB 4.04Å; N198-Q201 HydrophobicContact CB-CG 4.16Å; N198-Q201 PolarHBondContact ND2-OE1 3.32Å; N198-Q201 WeakPolarHBondContact O-CA 2.95Å; N198-Q201 VanDerWaalsContact O-CB 3.3Å; N198-Q201 WeakPolarHBondContact O-CB 3.43Å; N198-Q201 PolarHBondContact O-N 3.02Å; E199-Q201 VanDerWaalsContact C-N 3.31Å; E199-Q201 PolarHBondContact O-N 2.99Å; Q201-I204 PolarHBondContact O-N 3.13Å; Q201-W205 WeakPolarHBondContact O-CB 3.32Å; Q201-W205 PolarHBondContact O-N 3.1Å
202	I	96.9	Very high	96.7	Very high	1 Å²	1	62.9 Å²	62.9	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-61.8	-49.3	174.4	-53.6	-66.1	0	0	0	109.9	L173 L183 R188 A192 L195 L197 N198 E199 I204 W205 F206	L173-I202 HydrophobicContact CD2-CD1 3.79Å; L173-I202 HydrophobicContact CD2-CG2 4.25Å; L183-I202 HydrophobicContact CD2-CG2 3.44Å; L183-I202 VanDerWaalsContact CD2-CG2 3.44Å; R188-I202 HydrophobicContact CG-CB 4.27Å; R188-I202 HydrophobicContact CG-CG2 4.26Å; A192-I202 HydrophobicContact CB-CG1 4.49Å; L195-I202 HydrophobicContact CD1-CD1 4.18Å; L197-I202 HydrophobicContact CB-CD1 4Å; L197-I202 HydrophobicContact CB-CG1 4.46Å; L197-I202 HydrophobicContact CD1-CD1 3.83Å; N198-I202 PolarHBondContact O-N 3.44Å; E199-I202 PolarHBondContact O-N 2.95Å; I202-I204 PolarHBondContact O-N 3.26Å; I202-W205 PolarHBondContact O-N 2.94Å; I202-W205 VanDerWaalsContact O-N 3.12Å; I202-F206 HydrophobicContact CG2-CD2 3.87Å; I202-F206 HydrophobicContact CG2-CE2 3.91Å; I202-F206 WeakPolarHBondContact O-CD2 3.42Å; I202-F206 PolarHBondContact O-N 3.14Å
203	K	97	Very high	96.4	Very high	106 Å²	106	64.1 Å²	64.1	46%	0.461	35%	0.347	S	S	.	.	H	α-helix	trans	-55.3	-49.4	177.5	-177.8	178.6	-179.1	175.9	0	111.9	E199 S200 W205 F206 Q207	E199-K203 WeakPolarHBondContact O-CB 3Å; E199-K203 PolarHBondContact O-N 3.48Å; S200-K203 PolarHBondContact O-N 3.35Å; K203-W205 VanDerWaalsContact C-N 3.34Å; K203-W205 PolarHBondContact O-N 2.84Å; K203-F206 PolarHBondContact O-N 3.17Å; K203-Q207 VanDerWaalsContact O-CG 3.31Å; K203-Q207 WeakPolarHBondContact O-CG 3.47Å; K203-Q207 PolarHBondContact O-N 2.87Å
204	I	96.7	Very high	96.2	Very high	80 Å²	80	64.6 Å²	64.6	41%	0.41	34%	0.337	S	S	.	.	H	α-helix	trans	-63.5	-39.9	178	-70	166.1	0	0	0	110.9	S200 Q201 I202 Q207 N208	S200-I204 WeakPolarHBondContact O-CB 3.25Å; S200-I204 WeakPolarHBondContact O-CD1 3.13Å; S200-I204 VanDerWaalsContact O-CG1 3.22Å; S200-I204 WeakPolarHBondContact O-CG1 3.44Å; S200-I204 PolarHBondContact O-N 3.27Å; Q201-I204 PolarHBondContact O-N 3.13Å; I202-I204 PolarHBondContact O-N 3.26Å; I204-Q207 PolarHBondContact O-N 2.68Å; I204-N208 VanDerWaalsContact CG2-ND2 3.34Å; I204-N208 WeakPolarHBondContact CG2-ND2 3.38Å; I204-N208 WeakPolarHBondContact O-CB 3.39Å; I204-N208 VanDerWaalsContact O-CG 3.24Å; I204-N208 PolarHBondContact O-N 3.12Å; I204-N208 PolarHBondContact O-ND2 2.9Å; I204-N208 VanDerWaalsContact O-ND2 3.17Å
205	W	97.5	Very high	95.7	Very high	32 Å²	32	67 Å²	67	12%	0.121	35%	0.345	C	S	.	.	H	α-helix	trans	-62.3	-47.9	177.4	-175.2	97.3	0	0	0	111.6	F165 L173 R174 F177 Q201 I202 K203 Q207 N208 K209	F165-W205 AromaticContact CD2-CD1 3.85Å; F165-W205 HydrophobicContact CE2-CB 4.27Å; F165-W205 AromaticContact CE2-CD1 3.67Å; F165-W205 HydrophobicContact CE2-CG 4.31Å; L173-W205 VanDerWaalsContact C-CH2 3.47Å; L173-W205 HydrophobicContact CB-CD2 4.08Å; L173-W205 HydrophobicContact CB-CE3 4.05Å; L173-W205 HydrophobicContact CB-CH2 3.67Å; L173-W205 HydrophobicContact CB-CZ2 3.66Å; L173-W205 HydrophobicContact CB-CZ3 3.86Å; L173-W205 HydrophobicContact CD1-CD2 3.91Å; L173-W205 HydrophobicContact CD1-CE3 4.46Å; L173-W205 HydrophobicContact CD1-CG 3.94Å; L173-W205 HydrophobicContact CD2-CD2 4.39Å; L173-W205 HydrophobicContact CD2-CE3 4.15Å; L173-W205 HydrophobicContact CG-CD2 4.37Å; L173-W205 HydrophobicContact CG-CE3 4.47Å; L173-W205 WeakPolarHBondContact O-CH2 3.42Å; L173-W205 WeakPolarHBondContact O-CZ3 3.36Å; R174-W205 HydrophobicContact CG-CZ2 4.41Å; F177-W205 HydrophobicContact CB-CH2 4Å; F177-W205 HydrophobicContact CB-CZ3 3.93Å; F177-W205 HydrophobicContact CD2-CZ3 4.09Å; F177-W205 HydrophobicContact CG-CH2 4.41Å; F177-W205 HydrophobicContact CG-CZ3 4.26Å; Q201-W205 WeakPolarHBondContact O-CB 3.32Å; Q201-W205 PolarHBondContact O-N 3.1Å; I202-W205 PolarHBondContact O-N 2.94Å; I202-W205 VanDerWaalsContact O-N 3.12Å; K203-W205 VanDerWaalsContact C-N 3.34Å; K203-W205 PolarHBondContact O-N 2.84Å; W205-Q207 PolarHBondContact O-N 3.24Å; W205-N208 PolarHBondContact O-N 2.64Å; W205-K209 HydrophobicContact CE3-CB 4.37Å; W205-K209 HydrophobicContact CH2-CB 4.36Å; W205-K209 HydrophobicContact CH2-CD 4.45Å; W205-K209 HydrophobicContact CH2-CG 4.13Å; W205-K209 HydrophobicContact CZ3-CB 4.19Å; W205-K209 HydrophobicContact CZ3-CG 4.28Å; W205-K209 WeakPolarHBondContact O-CB 3.47Å; W205-K209 PolarHBondContact O-N 3.11Å
206	F	98.1	Very high	95.2	Very high	3 Å²	3	70.6 Å²	70.6	1%	0.013	36%	0.361	C	S	.	.	H	α-helix	trans	-61.8	-42.1	177.2	-91.4	-100	0	0	0	111.9	L173 E176 F177 N180 L183 L191 I202 K203 K209 R210	L173-F206 HydrophobicContact CD2-CE2 4.04Å; E176-F206 HydrophobicContact CB-CZ 4.14Å; F177-F206 HydrophobicContact CB-CE1 4.26Å; F177-F206 AromaticContact CD2-CD1 3.68Å; F177-F206 HydrophobicContact CD2-CD1 3.68Å; F177-F206 AromaticContact CD2-CE1 3.75Å; F177-F206 HydrophobicContact CD2-CE1 3.75Å; F177-F206 HydrophobicContact CE2-CD1 4.24Å; F177-F206 HydrophobicContact CG-CE1 4.5Å; N180-F206 WeakPolarHBondContact O-CE1 3.42Å; L183-F206 HydrophobicContact CB-CD1 4.36Å; L183-F206 HydrophobicContact CB-CE1 4.36Å; L183-F206 HydrophobicContact CD1-CE1 4.49Å; L183-F206 HydrophobicContact CD1-CE2 4.49Å; L183-F206 HydrophobicContact CD1-CZ 4.11Å; L183-F206 HydrophobicContact CD2-CD2 4.11Å; L183-F206 HydrophobicContact CD2-CE2 3.92Å; L183-F206 HydrophobicContact CD2-CZ 4.31Å; L191-F206 HydrophobicContact CD1-CE2 4.42Å; I202-F206 HydrophobicContact CG2-CD2 3.87Å; I202-F206 HydrophobicContact CG2-CE2 3.91Å; I202-F206 WeakPolarHBondContact O-CD2 3.42Å; I202-F206 PolarHBondContact O-N 3.14Å; K203-F206 PolarHBondContact O-N 3.17Å; F206-K209 PolarHBondContact O-N 3Å; F206-R210 WeakPolarHBondContact O-CG 3.46Å; F206-R210 PolarHBondContact O-N 3.07Å
207	Q	97.2	Very high	94.5	Very high	89 Å²	89	72.7 Å²	72.7	42%	0.416	36%	0.361	S	S	.	.	H	α-helix	trans	-60.5	-47.7	174	-73.9	177.7	7.6	0	0	111.9	K203 I204 W205 K209 R210 A211	K203-Q207 VanDerWaalsContact O-CG 3.31Å; K203-Q207 WeakPolarHBondContact O-CG 3.47Å; K203-Q207 PolarHBondContact O-N 2.87Å; I204-Q207 PolarHBondContact O-N 2.68Å; W205-Q207 PolarHBondContact O-N 3.24Å; Q207-K209 VanDerWaalsContact C-N 3.34Å; Q207-K209 PolarHBondContact O-N 3.3Å; Q207-R210 PolarHBondContact O-N 3.27Å; Q207-A211 VanDerWaalsContact O-CB 3.29Å; Q207-A211 WeakPolarHBondContact O-CB 3.39Å; Q207-A211 PolarHBondContact O-N 3.47Å
208	N	97.3	Very high	93.5	Very high	100 Å²	100	80.6 Å²	80.6	54%	0.535	39%	0.389	S	S	.	.	H	α-helix	trans	-63.5	-39	178	-75.7	-32	0	0	0	112	I204 W205 A211 K212	I204-N208 VanDerWaalsContact CG2-ND2 3.34Å; I204-N208 WeakPolarHBondContact CG2-ND2 3.38Å; I204-N208 WeakPolarHBondContact O-CB 3.39Å; I204-N208 VanDerWaalsContact O-CG 3.24Å; I204-N208 PolarHBondContact O-N 3.12Å; I204-N208 PolarHBondContact O-ND2 2.9Å; I204-N208 VanDerWaalsContact O-ND2 3.17Å; W205-N208 PolarHBondContact O-N 2.64Å; N208-A211 PolarHBondContact O-N 3.04Å; N208-K212 WeakPolarHBondContact O-CB 3.4Å; N208-K212 PolarHBondContact O-N 2.8Å
209	K	97	Very high	91.7	Very high	57 Å²	57	77.5 Å²	77.5	25%	0.248	38%	0.376	C	S	.	.	H	α-helix	trans	-64	-48.3	176.4	-177.6	63.7	171.9	174.8	0	110.8	F177 W205 F206 Q207 A211 K212 I213	F177-K209 HydrophobicContact CD1-CD 4.46Å; F177-K209 HydrophobicContact CD1-CG 3.82Å; F177-K209 HydrophobicContact CD2-CB 4.19Å; F177-K209 HydrophobicContact CD2-CG 3.63Å; F177-K209 HydrophobicContact CE1-CD 4.42Å; F177-K209 HydrophobicContact CE1-CG 3.71Å; F177-K209 HydrophobicContact CE2-CB 3.97Å; F177-K209 HydrophobicContact CE2-CG 3.5Å; F177-K209 HydrophobicContact CG-CG 3.8Å; F177-K209 HydrophobicContact CZ-CB 4.36Å; F177-K209 HydrophobicContact CZ-CG 3.55Å; W205-K209 HydrophobicContact CE3-CB 4.37Å; W205-K209 HydrophobicContact CH2-CB 4.36Å; W205-K209 HydrophobicContact CH2-CD 4.45Å; W205-K209 HydrophobicContact CH2-CG 4.13Å; W205-K209 HydrophobicContact CZ3-CB 4.19Å; W205-K209 HydrophobicContact CZ3-CG 4.28Å; W205-K209 WeakPolarHBondContact O-CB 3.47Å; W205-K209 PolarHBondContact O-N 3.11Å; F206-K209 PolarHBondContact O-N 3Å; Q207-K209 VanDerWaalsContact C-N 3.34Å; Q207-K209 PolarHBondContact O-N 3.3Å; K209-A211 PolarHBondContact O-N 3.05Å; K209-K212 PolarHBondContact O-N 3.49Å; K209-I213 HydrophobicContact CD-CD1 4.46Å; K209-I213 HydrophobicContact CG-CD1 4.44Å; K209-I213 WeakPolarHBondContact O-CG1 3.02Å; K209-I213 PolarHBondContact O-N 3.09Å
210	R	97.3	Very high	90.1	Very high	64 Å²	64	79.7 Å²	79.7	24%	0.242	39%	0.39	C	S	.	.	H	α-helix	trans	-60.9	-41.9	173.4	-70.9	-166.1	-63.1	-87	1.2	112.3	F177 R181 F206 Q207 K212 I213 K214	F177-R210 HydrophobicContact CE2-CG 3.83Å; F177-R210 HydrophobicContact CZ-CG 4.05Å; R181-R210 WeakPolarHBondContact O-CD 3.45Å; R181-R210 PolarHBondContact O-NH1 2.79Å; F206-R210 WeakPolarHBondContact O-CG 3.46Å; F206-R210 PolarHBondContact O-N 3.07Å; Q207-R210 PolarHBondContact O-N 3.27Å; R210-K212 PolarHBondContact O-N 3.35Å; R210-I213 PolarHBondContact O-N 3.38Å; R210-K214 WeakPolarHBondContact O-CB 3.45Å; R210-K214 PolarHBondContact O-N 3.18Å
211	A	95.3	Very high	88.9	Confident	49 Å²	49	80 Å²	80	41%	0.405	39%	0.386	S	S	.	.	H	α-helix	trans	-63.1	-40.4	177.1	0	0	0	0	0	112.1	Q207 N208 K209 K215	Q207-A211 VanDerWaalsContact O-CB 3.29Å; Q207-A211 WeakPolarHBondContact O-CB 3.39Å; Q207-A211 PolarHBondContact O-N 3.47Å; N208-A211 PolarHBondContact O-N 3.04Å; K209-A211 PolarHBondContact O-N 3.05Å; A211-K215 VanDerWaalsContact O-CB 3.26Å; A211-K215 WeakPolarHBondContact O-CB 3.37Å; A211-K215 PolarHBondContact O-N 3.3Å
212	K	93.5	Very high	88.2	Confident	115 Å²	115	82.1 Å²	82.1	50%	0.5	40%	0.402	S	S	.	.	H	α-helix	trans	-61.2	-47.5	174.8	-172.5	-174.1	174.4	-169	0	110.7	N208 K209 R210 K215 Q216	N208-K212 WeakPolarHBondContact O-CB 3.4Å; N208-K212 PolarHBondContact O-N 2.8Å; K209-K212 PolarHBondContact O-N 3.49Å; R210-K212 PolarHBondContact O-N 3.35Å; K212-K215 WeakPolarHBondContact O-CB 3.22Å; K212-K215 PolarHBondContact O-N 3.36Å; K212-Q216 WeakPolarHBondContact O-CG 3.42Å; K212-Q216 PolarHBondContact O-N 2.87Å; K212-Q216 PolarHBondContact O-OE1 2.91Å
213	I	92.1	Very high	87.5	Confident	35 Å²	35	84.2 Å²	84.2	18%	0.179	41%	0.413	C	S	.	.	H	α-helix	trans	-65.6	-49.4	180	-63.2	169.9	0	0	0	110.8	F177 K209 R210 K215 Q216 T217	F177-I213 HydrophobicContact CE1-CD1 3.37Å; F177-I213 HydrophobicContact CZ-CD1 3.62Å; K209-I213 HydrophobicContact CD-CD1 4.46Å; K209-I213 HydrophobicContact CG-CD1 4.44Å; K209-I213 WeakPolarHBondContact O-CG1 3.02Å; K209-I213 PolarHBondContact O-N 3.09Å; R210-I213 PolarHBondContact O-N 3.38Å; I213-K215 PolarHBondContact O-N 3.11Å; I213-K215 VanDerWaalsContact O-N 3.17Å; I213-Q216 CarbonylContact O-C 3.56Å; I213-Q216 WeakPolarHBondContact O-CA 3.49Å; I213-Q216 WeakPolarHBondContact O-CB 3.37Å; I213-Q216 PolarHBondContact O-N 3.05Å; I213-T217 PolarHBondContact O-N 3.05Å; I213-T217 PolarHBondContact O-OG1 3.45Å
214	K	92.1	Very high	86.6	Confident	122 Å²	122	79.3 Å²	79.3	53%	0.53	39%	0.392	S	S	.	.	H	α-helix	trans	-54.1	-39.6	175.2	-175.7	174.2	69.5	175.6	0	111.6	R210 R218	R210-K214 WeakPolarHBondContact O-CB 3.45Å; R210-K214 PolarHBondContact O-N 3.18Å; K214-R218 WeakPolarHBondContact O-CB 3.41Å; K214-R218 WeakPolarHBondContact O-CG 3.43Å; K214-R218 PolarHBondContact O-N 3.36Å
215	K	87.1	Confident	86	Confident	149 Å²	149	79.7 Å²	79.7	65%	0.648	39%	0.394	S	S	*	.	H	α-helix	trans	-65.9	-44	175.5	-175.6	174.2	-178.8	172.7	0	111.6	A211 K212 I213 R218 C219	A211-K215 VanDerWaalsContact O-CB 3.26Å; A211-K215 WeakPolarHBondContact O-CB 3.37Å; A211-K215 PolarHBondContact O-N 3.3Å; K212-K215 WeakPolarHBondContact O-CB 3.22Å; K212-K215 PolarHBondContact O-N 3.36Å; I213-K215 PolarHBondContact O-N 3.11Å; I213-K215 VanDerWaalsContact O-N 3.17Å; K215-R218 PolarHBondContact O-N 3.21Å; K215-C219 HydrophobicContact CG-CB 4.49Å; K215-C219 WeakPolarHBondContact O-CA 3.43Å; K215-C219 WeakPolarHBondContact O-CB 3.33Å; K215-C219 PolarHBondContact O-N 3.16Å; K215-C219 PolarHBondContact O-SG 3.38Å
216	Q	85.8	Confident	85.3	Confident	100 Å²	100	82.3 Å²	82.3	47%	0.467	41%	0.407	S	S	.	.	H	α-helix	trans	-62.5	-43.2	176.7	-71.9	169.3	-62.8	0	0	111.5	K212 I213	K212-Q216 WeakPolarHBondContact O-CG 3.42Å; K212-Q216 PolarHBondContact O-N 2.87Å; K212-Q216 PolarHBondContact O-OE1 2.91Å; I213-Q216 CarbonylContact O-C 3.56Å; I213-Q216 WeakPolarHBondContact O-CA 3.49Å; I213-Q216 WeakPolarHBondContact O-CB 3.37Å; I213-Q216 PolarHBondContact O-N 3.05Å
217	T	82.4	Confident	84.6	Confident	111 Å²	111	82.1 Å²	82.1	68%	0.681	41%	0.407	S	S	*	.	H	α-helix	trans	-67.5	-37.6	178.7	-46.5	0	0	0	0	112.8	I213	I213-T217 PolarHBondContact O-N 3.05Å; I213-T217 PolarHBondContact O-OG1 3.45Å
218	R	72.7	Confident	83.9	Confident	187 Å²	187	82.2 Å²	82.2	71%	0.706	41%	0.408	S	S	*	.	H	α-helix	trans	-92.3	-5.3	-180	-63.5	-173.3	-173.1	-171	-0.3	114.4	K214 K215 N220	K214-R218 WeakPolarHBondContact O-CB 3.41Å; K214-R218 WeakPolarHBondContact O-CG 3.43Å; K214-R218 PolarHBondContact O-N 3.36Å; K215-R218 PolarHBondContact O-N 3.21Å; R218-N220 PolarHBondContact O-OD1 3.42Å; R218-N220 VanDerWaalsContact O-OD1 3.12Å
219	C	60	Low	83.3	Confident	46 Å²	46	81.7 Å²	81.7	31%	0.311	42%	0.418	S	S	.	.			trans	-105	59.6	-178.3	88.9	0	0	0	0	113	K215 N221	K215-C219 HydrophobicContact CG-CB 4.49Å; K215-C219 WeakPolarHBondContact O-CA 3.43Å; K215-C219 WeakPolarHBondContact O-CB 3.33Å; K215-C219 PolarHBondContact O-N 3.16Å; K215-C219 PolarHBondContact O-SG 3.38Å; C219-N221 VanDerWaalsContact C-N 3.27Å; C219-N221 PolarHBondContact O-N 3.42Å; C219-N221 VanDerWaalsContact O-N 3.11Å
220	N	63.1	Low	82.7	Confident	113 Å²	113	84 Å²	84	60%	0.604	43%	0.429	S	S	*	.	S	Bend		-55.2	108.7	124.8	45.1	-16	0	0	0	105.6	R218 T222 I225	R218-N220 PolarHBondContact O-OD1 3.42Å; R218-N220 VanDerWaalsContact O-OD1 3.12Å; N220-T222 PolarHBondContact O-N 3.38Å; N220-I225 HydrophobicContact CB-CD1 4.23Å
221	N	71.5	Confident	81.9	Confident	79 Å²	79	84.1 Å²	84.1	42%	0.422	45%	0.45	S	S	.	.			trans	-65.5	75.7	-176.1	-70	-77.1	0	0	0	108.7	C219 L223 A224 I225	C219-N221 VanDerWaalsContact C-N 3.27Å; C219-N221 PolarHBondContact O-N 3.42Å; C219-N221 VanDerWaalsContact O-N 3.11Å; N221-L223 PolarHBondContact O-N 3.09Å; N221-L223 VanDerWaalsContact O-N 3.09Å; N221-A224 HydrophobicContact CB-CB 3.43Å; N221-A224 VanDerWaalsContact CB-CB 3.43Å; N221-A224 CarbonylContact O-C 3.57Å; N221-A224 WeakPolarHBondContact O-CA 3.2Å; N221-A224 WeakPolarHBondContact O-CB 3.36Å; N221-A224 PolarHBondContact O-N 3.05Å; N221-I225 WeakPolarHBondContact O-CG1 3.35Å; N221-I225 PolarHBondContact O-N 2.85Å
222	T	81.8	Confident	81.3	Confident	86 Å²	86	83.4 Å²	83.4	53%	0.528	44%	0.44	S	S	.	.	H	α-helix	trans	-53.8	-40.7	-169.9	-171.6	0	0	0	0	110.9	N220 I225 Q226	N220-T222 PolarHBondContact O-N 3.38Å; T222-I225 PolarHBondContact O-N 2.88Å; T222-Q226 WeakPolarHBondContact O-CB 3.43Å; T222-Q226 WeakPolarHBondContact O-CG 3.33Å; T222-Q226 PolarHBondContact O-N 2.68Å
223	L	81.1	Confident	80.8	Confident	45 Å²	45	79 Å²	79	24%	0.236	42%	0.42	C	S	.	.	H	α-helix	trans	-66.2	-42.4	175	-178.1	62.1	0	0	0	112.4	W131 V132 T135 N221 I225 Q226 L227	W131-L223 HydrophobicContact CZ3-CD2 4.47Å; V132-L223 HydrophobicContact CG1-CD1 4.39Å; T135-L223 HydrophobicContact CG2-CD2 4.33Å; N221-L223 PolarHBondContact O-N 3.09Å; N221-L223 VanDerWaalsContact O-N 3.09Å; L223-I225 VanDerWaalsContact C-N 3.33Å; L223-Q226 PolarHBondContact O-N 2.86Å; L223-L227 HydrophobicContact CD1-CD1 4.25Å; L223-L227 HydrophobicContact CD1-CG 4.24Å; L223-L227 HydrophobicContact CG-CD1 3.99Å; L223-L227 HydrophobicContact CG-CG 4.41Å; L223-L227 VanDerWaalsContact O-CB 3.3Å; L223-L227 WeakPolarHBondContact O-CB 3.35Å; L223-L227 WeakPolarHBondContact O-CG 3.17Å; L223-L227 PolarHBondContact O-N 3.35Å
224	A	78.8	Confident	80.2	Confident	4 Å²	4	79.4 Å²	79.4	3%	0.033	42%	0.422	C	S	.	.	H	α-helix	trans	-63.5	-41.5	174.9	0	0	0	0	0	111.4	N221 L227 M228 Y233	N221-A224 HydrophobicContact CB-CB 3.43Å; N221-A224 VanDerWaalsContact CB-CB 3.43Å; N221-A224 CarbonylContact O-C 3.57Å; N221-A224 WeakPolarHBondContact O-CA 3.2Å; N221-A224 WeakPolarHBondContact O-CB 3.36Å; N221-A224 PolarHBondContact O-N 3.05Å; A224-L227 PolarHBondContact O-N 2.81Å; A224-M228 HydrophobicContact CB-CE 4.46Å; A224-M228 WeakPolarHBondContact O-CB 3.3Å; A224-M228 VanDerWaalsContact O-CG 3.23Å; A224-M228 WeakPolarHBondContact O-CG 3.23Å; A224-M228 PolarHBondContact O-N 2.8Å; A224-Y233 HydrophobicContact CB-CD2 3.95Å; A224-Y233 HydrophobicContact CB-CE2 3.37Å
225	I	83.3	Confident	79.3	Confident	88 Å²	88	79.9 Å²	79.9	45%	0.451	43%	0.426	S	S	.	.	H	α-helix	trans	-62.6	-46.6	177.6	-64.6	167.9	0	0	0	110.1	N220 N221 T222 L223 M228 A229	N220-I225 HydrophobicContact CB-CD1 4.23Å; N221-I225 WeakPolarHBondContact O-CG1 3.35Å; N221-I225 PolarHBondContact O-N 2.85Å; T222-I225 PolarHBondContact O-N 2.88Å; L223-I225 VanDerWaalsContact C-N 3.33Å; I225-M228 HydrophobicContact CB-CE 4.45Å; I225-M228 HydrophobicContact CG1-CE 4.04Å; I225-M228 PolarHBondContact O-N 2.96Å; I225-A229 PolarHBondContact O-N 3.47Å
226	Q	84	Confident	78.7	Confident	86 Å²	86	76 Å²	76	40%	0.402	42%	0.423	S	S	.	.	H	α-helix	trans	-62.4	-43.6	175.5	-73.5	169.1	-12.4	0	0	112.1	W128 T222 L223 M228 A229 Q230	W128-Q226 HydrophobicContact CH2-CB 4.48Å; T222-Q226 WeakPolarHBondContact O-CB 3.43Å; T222-Q226 WeakPolarHBondContact O-CG 3.33Å; T222-Q226 PolarHBondContact O-N 2.68Å; L223-Q226 PolarHBondContact O-N 2.86Å; Q226-M228 VanDerWaalsContact C-N 3.34Å; Q226-M228 PolarHBondContact O-N 3.45Å; Q226-A229 PolarHBondContact O-N 2.79Å; Q226-Q230 WeakPolarHBondContact O-CB 3.17Å; Q226-Q230 VanDerWaalsContact O-CG 3.23Å; Q226-Q230 WeakPolarHBondContact O-CG 3.29Å; Q226-Q230 PolarHBondContact O-N 3.36Å
227	L	83	Confident	77.7	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-65.1	-36.9	175.4	-72.2	171.3	0	0	0	111.9	V132 S138 L223 A224 Q230 G231 L232 Y233	V132-L227 HydrophobicContact CG1-CD2 3.91Å; S138-L227 VanDerWaalsContact OG-CD1 3.29Å; S138-L227 WeakPolarHBondContact OG-CD1 3.28Å; L223-L227 HydrophobicContact CD1-CD1 4.25Å; L223-L227 HydrophobicContact CD1-CG 4.24Å; L223-L227 HydrophobicContact CG-CD1 3.99Å; L223-L227 HydrophobicContact CG-CG 4.41Å; L223-L227 VanDerWaalsContact O-CB 3.3Å; L223-L227 WeakPolarHBondContact O-CB 3.35Å; L223-L227 WeakPolarHBondContact O-CG 3.17Å; L223-L227 PolarHBondContact O-N 3.35Å; A224-L227 PolarHBondContact O-N 2.81Å; L227-Q230 PolarHBondContact O-N 3.23Å; L227-G231 PolarHBondContact O-N 3.48Å; L227-L232 HydrophobicContact CB-CB 4.46Å; L227-L232 HydrophobicContact CD2-CB 3.69Å; L227-L232 HydrophobicContact CD2-CD1 4.17Å; L227-L232 PolarHBondContact O-N 3.42Å; L227-Y233 HydrophobicContact CB-CD2 4.16Å; L227-Y233 PolarHBondContact O-N 3.2Å
228	M	82.3	Confident	76.7	Confident	91 Å²	91	68.9 Å²	68.9	45%	0.448	39%	0.388	S	S	.	.	H	α-helix	trans	-64.3	-45.9	175.6	-78.6	-174.8	-68	0	0	110.3	A224 I225 Q226 Q230 G231 Y233	A224-M228 HydrophobicContact CB-CE 4.46Å; A224-M228 WeakPolarHBondContact O-CB 3.3Å; A224-M228 VanDerWaalsContact O-CG 3.23Å; A224-M228 WeakPolarHBondContact O-CG 3.23Å; A224-M228 PolarHBondContact O-N 2.8Å; I225-M228 HydrophobicContact CB-CE 4.45Å; I225-M228 HydrophobicContact CG1-CE 4.04Å; I225-M228 PolarHBondContact O-N 2.96Å; Q226-M228 VanDerWaalsContact C-N 3.34Å; Q226-M228 PolarHBondContact O-N 3.45Å; M228-Q230 PolarHBondContact O-N 3.33Å; M228-G231 PolarHBondContact O-N 3.31Å; M228-G231 VanDerWaalsContact O-N 3.17Å; M228-Y233 HydrophobicContact CB-CG 4.47Å; M228-Y233 VanDerWaalsContact CG-CB 3.43Å; M228-Y233 HydrophobicContact CG-CD1 3.47Å; M228-Y233 VanDerWaalsContact CG-CD1 3.47Å; M228-Y233 HydrophobicContact CG-CD2 3.93Å; M228-Y233 HydrophobicContact CG-CE1 4.15Å; M228-Y233 HydrophobicContact CG-CG 3.32Å; M228-Y233 HydrophobicContact SD-CD1 3.99Å; M228-Y233 HydrophobicContact SD-CE1 4.11Å; M228-Y233 HydrophobicContact SD-CG 4.33Å
229	A	84.5	Confident	76.1	Confident	88 Å²	88	63.7 Å²	63.7	73%	0.727	38%	0.381	S	S	*	.	H	α-helix	trans	-62.3	-29.9	176.9	0	0	0	0	0	113.2	I225 Q226	I225-A229 PolarHBondContact O-N 3.47Å; Q226-A229 PolarHBondContact O-N 2.79Å
230	Q	84	Confident	76.1	Confident	106 Å²	106	63.7 Å²	63.7	50%	0.495	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	4.5	179.5	-66	-80.1	-28.3	0	0	113.4	W128 Q226 L227 M228 L232	W128-Q230 HydrophobicContact CZ2-CG 3.99Å; Q226-Q230 WeakPolarHBondContact O-CB 3.17Å; Q226-Q230 VanDerWaalsContact O-CG 3.23Å; Q226-Q230 WeakPolarHBondContact O-CG 3.29Å; Q226-Q230 PolarHBondContact O-N 3.36Å; L227-Q230 PolarHBondContact O-N 3.23Å; M228-Q230 PolarHBondContact O-N 3.33Å; Q230-L232 HydrophobicContact CB-CD1 4.22Å; Q230-L232 HydrophobicContact CB-CG 4.27Å; Q230-L232 PolarHBondContact O-N 2.8Å
231	G	82.2	Confident	75.7	Confident	66 Å²	66	65.8 Å²	65.8	68%	0.68	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	18.2	-177.8	0	0	0	0	0	114.5	L227 M228	L227-G231 PolarHBondContact O-N 3.48Å; M228-G231 PolarHBondContact O-N 3.31Å; M228-G231 VanDerWaalsContact O-N 3.17Å
232	L	83	Confident	74.8	Confident	35 Å²	35	65.2 Å²	65.2	18%	0.183	39%	0.39	C	S	.	.			trans	-102.4	7.4	-178.2	-67.4	176	0	0	0	112.4	Y133 S138 D139 L227 Q230	Y133-L232 HydrophobicContact CE1-CD1 3.81Å; Y133-L232 HydrophobicContact CE1-CD2 4.13Å; S138-L232 CarbonylContact C-O 3.59Å; S138-L232 WeakPolarHBondContact CA-O 3.25Å; D139-L232 PolarHBondContact N-O 2.77Å; L227-L232 HydrophobicContact CB-CB 4.46Å; L227-L232 HydrophobicContact CD2-CB 3.69Å; L227-L232 HydrophobicContact CD2-CD1 4.17Å; L227-L232 PolarHBondContact O-N 3.42Å; Q230-L232 HydrophobicContact CB-CD1 4.22Å; Q230-L232 HydrophobicContact CB-CG 4.27Å; Q230-L232 PolarHBondContact O-N 2.8Å
233	Y	81.7	Confident	73.4	Confident	21 Å²	21	66.8 Å²	66.8	8%	0.082	40%	0.399	C	S	.	.	B	Isolated β-bridge	trans	-92.1	120.8	-171.3	-174.9	-100.2	0	0	0	114.6	Y137 A224 L227 M228 H235	Y137-Y233 AromaticContact CD1-CE2 3.59Å; Y137-Y233 HydrophobicContact CD1-CE2 3.59Å; Y137-Y233 HydrophobicContact CG-CE2 4.09Å; Y137-Y233 CarbonylContact O-C 3.33Å; Y137-Y233 VanDerWaalsContact O-CA 3.28Å; Y137-Y233 WeakPolarHBondContact O-CA 3.3Å; A224-Y233 HydrophobicContact CB-CD2 3.95Å; A224-Y233 HydrophobicContact CB-CE2 3.37Å; L227-Y233 HydrophobicContact CB-CD2 4.16Å; L227-Y233 PolarHBondContact O-N 3.2Å; M228-Y233 HydrophobicContact CB-CG 4.47Å; M228-Y233 VanDerWaalsContact CG-CB 3.43Å; M228-Y233 HydrophobicContact CG-CD1 3.47Å; M228-Y233 VanDerWaalsContact CG-CD1 3.47Å; M228-Y233 HydrophobicContact CG-CD2 3.93Å; M228-Y233 HydrophobicContact CG-CE1 4.15Å; M228-Y233 HydrophobicContact CG-CG 3.32Å; M228-Y233 HydrophobicContact SD-CD1 3.99Å; M228-Y233 HydrophobicContact SD-CE1 4.11Å; M228-Y233 HydrophobicContact SD-CG 4.33Å; Y233-H235 AromaticContact CD1-ND1 3.94Å; Y233-H235 PolarHBondContact O-CD2 2.98Å; Y233-H235 VanDerWaalsContact O-CD2 3.26Å; Y233-H235 PolarHBondContact O-N 3.25Å
234	N	79.8	Confident	72	Confident	44 Å²	44	69 Å²	69	24%	0.235	42%	0.418	C	S	.	.			trans	-71.4	99	177	-171.3	-85.3	0	0	0	112.1	Y137 D139 A236 A237	Y137-N234 PolarHBondContact O-N 2.92Å; D139-N234 VanDerWaalsContact OD1-CA 3.31Å; D139-N234 WeakPolarHBondContact OD1-CA 3.28Å; D139-N234 VanDerWaalsContact OD1-CB 3.25Å; D139-N234 WeakPolarHBondContact OD1-CB 3.37Å; D139-N234 PolarHBondContact OD1-ND2 2.93Å; D139-N234 VanDerWaalsContact OD2-CA 3.28Å; D139-N234 WeakPolarHBondContact OD2-CA 3.31Å; D139-N234 PolarHBondContact OD2-N 3.27Å; N234-A236 PolarHBondContact O-N 3.28Å; N234-A236 WeakPolarHBondContact OD1-CB 3.39Å; N234-A236 PolarHBondContact OD1-N 3.48Å; N234-A237 HydrophobicContact CB-CB 4.46Å; N234-A237 WeakPolarHBondContact O-CB 3.23Å; N234-A237 PolarHBondContact O-N 3.41Å; N234-A237 PolarHBondContact OD1-N 2.68Å
235	H	72.4	Confident	70.5	Confident	132 Å²	132	72.2 Å²	72.2	61%	0.611	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-21.2	176.7	-63.8	-77.5	0	0	0	113.9	Y233 A237 S238 S239	Y233-H235 AromaticContact CD1-ND1 3.94Å; Y233-H235 PolarHBondContact O-CD2 2.98Å; Y233-H235 VanDerWaalsContact O-CD2 3.26Å; Y233-H235 PolarHBondContact O-N 3.25Å; H235-A237 VanDerWaalsContact C-N 3.27Å; H235-A237 PolarHBondContact O-N 3.05Å; H235-S238 PolarHBondContact O-OG 3.5Å; H235-S239 PolarHBondContact O-N 2.93Å
236	A	74.5	Confident	68.4	Low	69 Å²	69	73.4 Å²	73.4	57%	0.57	45%	0.451	S	S	*	.	H	α-helix	trans	-69.9	-26.1	176.2	0	0	0	0	0	112.5	N234 S238	N234-A236 PolarHBondContact O-N 3.28Å; N234-A236 WeakPolarHBondContact OD1-CB 3.39Å; N234-A236 PolarHBondContact OD1-N 3.48Å; A236-S238 VanDerWaalsContact C-N 3.35Å; A236-S238 PolarHBondContact O-N 3.31Å
237	A	65.5	Low	66.5	Low	6 Å²	6	72.6 Å²	72.6	5%	0.05	46%	0.459	C	S	.	.	H	α-helix	trans	-69.8	-28.1	-179.4	0	0	0	0	0	113.5	R136 Y137 N234 H235	R136-A237 PolarHBondContact NH2-O 3.03Å; R136-A237 WeakPolarHBondContact O-CB 3.44Å; Y137-A237 HydrophobicContact CD1-CB 4.37Å; N234-A237 HydrophobicContact CB-CB 4.46Å; N234-A237 WeakPolarHBondContact O-CB 3.23Å; N234-A237 PolarHBondContact O-N 3.41Å; N234-A237 PolarHBondContact OD1-N 2.68Å; H235-A237 VanDerWaalsContact C-N 3.27Å; H235-A237 PolarHBondContact O-N 3.05Å
238	S	62.6	Low	64.6	Low	54 Å²	54	80 Å²	80	38%	0.378	50%	0.499	S	S	.	.	H	α-helix	trans	-84.7	-40.9	176.2	46.7	0	0	0	0	112.4	H235 A236 A240 R241 A242	H235-S238 PolarHBondContact O-OG 3.5Å; A236-S238 VanDerWaalsContact C-N 3.35Å; A236-S238 PolarHBondContact O-N 3.31Å; S238-A240 VanDerWaalsContact C-N 3.34Å; S238-A240 PolarHBondContact O-N 3.07Å; S238-R241 PolarHBondContact O-N 3.26Å; S238-A242 PolarHBondContact O-N 3.37Å
239	S	59.7	Low	62.9	Low	78 Å²	78	81.8 Å²	81.8	55%	0.545	51%	0.506	S	S	.	.	H	α-helix	trans	-60.5	-38	-176.8	-179.4	0	0	0	0	113.6	H235 R241 A242 T243	H235-S239 PolarHBondContact O-N 2.93Å; S239-R241 PolarHBondContact O-N 3.21Å; S239-A242 PolarHBondContact O-N 2.85Å; S239-T243 PolarHBondContact O-OG1 3.19Å
240	A	59.3	Low	61.2	Low	47 Å²	47	85.5 Å²	85.5	39%	0.388	51%	0.514	S	S	.	.	H	α-helix	trans	-67.4	-7.8	177.8	0	0	0	0	0	114.8	S238	S238-A240 VanDerWaalsContact C-N 3.34Å; S238-A240 PolarHBondContact O-N 3.07Å
241	R	54.4	Low	59.8	Low	157 Å²	157	86.4 Å²	86.4	59%	0.592	52%	0.522	S	S	*	.	H	α-helix	trans	-106.9	-24.6	177.6	-171.6	168.6	171.9	156.8	-1.8	112	S238 S239 T243 S244 L245	S238-R241 PolarHBondContact O-N 3.26Å; S239-R241 PolarHBondContact O-N 3.21Å; R241-T243 VanDerWaalsContact C-N 3.31Å; R241-T243 PolarHBondContact O-N 3.35Å; R241-S244 PolarHBondContact O-N 3.31Å; R241-S244 PolarHBondContact O-OG 3.03Å; R241-L245 HydrophobicContact CG-CD1 3.67Å; R241-L245 WeakPolarHBondContact O-CD1 3.45Å
242	A	53.6	Low	58.1	Low	67 Å²	67	86.8 Å²	86.8	55%	0.554	53%	0.526	S	S	*	.	H	α-helix	trans	-65.6	-34.3	175.1	0	0	0	0	0	112.1	S238 S239 S244 L245	S238-A242 PolarHBondContact O-N 3.37Å; S239-A242 PolarHBondContact O-N 2.85Å; A242-S244 PolarHBondContact O-N 3.26Å; A242-L245 PolarHBondContact O-N 2.81Å
243	T	52.7	Low	55.9	Low	118 Å²	118	93.9 Å²	93.9	72%	0.724	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-6.6	177.9	22.5	0	0	0	0	114.9	S239 R241	S239-T243 PolarHBondContact O-OG1 3.19Å; R241-T243 VanDerWaalsContact C-N 3.31Å; R241-T243 PolarHBondContact O-N 3.35Å
244	S	51.3	Low	54.6	Low	91 Å²	91	101.3 Å²	101.3	64%	0.636	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.3	2.2	176.4	70.1	0	0	0	0	114.4	R241 A242	R241-S244 PolarHBondContact O-N 3.31Å; R241-S244 PolarHBondContact O-OG 3.03Å; A242-S244 PolarHBondContact O-N 3.26Å
245	L	46.9	Very low	52.9	Low	73 Å²	73	103.9 Å²	103.9	38%	0.382	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.4	-1.6	-176.2	-85.3	162.8	0	0	0	113.7	R241 A242 A247	R241-L245 HydrophobicContact CG-CD1 3.67Å; R241-L245 WeakPolarHBondContact O-CD1 3.45Å; A242-L245 PolarHBondContact O-N 2.81Å; L245-A247 PolarHBondContact O-N 2.89Å
246	S	39.1	Very low	51.3	Low	113 Å²	113	101.4 Å²	101.4	79%	0.79	63%	0.627	S	S	*	*	S	Bend	trans	-78.6	27.4	179.4	67.8	0	0	0	0	114.3
247	A	44.5	Very low	49.8	Very low	68 Å²	68	105.3 Å²	105.3	56%	0.562	64%	0.638	S	S	*	*	S	Bend	trans	-146.9	108.9	176	0	0	0	0	0	110.1	L245	L245-A247 PolarHBondContact O-N 2.89Å
248	N	41.8	Very low	48.5	Very low	156 Å²	156	114.3 Å²	114.3	83%	0.834	68%	0.679	S	S	*	*			trans	82.7	74.2	171.6	-38.1	-70	0	0	0	116.5
249	E	48.3	Very low	47.9	Very low	129 Å²	129	117.8 Å²	117.8	60%	0.603	69%	0.692	S	S	*	*			trans	-133.6	72.2	156.5	-69.2	-171.3	147.4	0	0	108.4
250	D	47.3	Very low	46.8	Very low	166 Å²	166	122.1 Å²	122.1	89%	0.888	70%	0.703	S	S	*	*			trans	-97.2	73.6	160.1	-141.9	-55.9	0	0	0	105.5
251	D	55.1	Low	46.1	Very low	125 Å²	125	124.8 Å²	124.8	67%	0.668	73%	0.726	S	S	*	*			trans	-114.4	95.4	174.6	-82.4	-51.8	0	0	0	106.4	E253	D251-E253 PolarHBondContact O-N 3.17Å
252	G	46.3	Very low	45.4	Very low	74 Å²	74	124.7 Å²	124.7	76%	0.763	74%	0.737	S	S	*	*			trans	-45.1	122.1	179.3	0	0	0	0	0	113.2	M254	G252-M254 PolarHBondContact O-N 3.3Å
253	E	37.8	Very low	44.6	Very low	183 Å²	183	131.1 Å²	131.1	86%	0.855	78%	0.776	S	S	*	*			trans	-44.7	110	152.5	-179	175.5	159.1	0	0	110.1	D251	D251-E253 PolarHBondContact O-N 3.17Å
254	M	53	Low	44.2	Very low	177 Å²	177	131.8 Å²	131.8	87%	0.872	78%	0.778	S	S	*	*			trans	-171.2	135.8	148.9	-113.8	-179.2	-79.2	0	0	115.4	G252	G252-M254 PolarHBondContact O-N 3.3Å
255	S	46	Very low	43.9	Very low	98 Å²	98	133.9 Å²	133.9	69%	0.685	79%	0.786	S	S	*	*			trans	53.8	106	157.7	55.8	0	0	0	0	119.6	L257	S255-L257 PolarHBondContact O-N 3.33Å
256	G	37.1	Very low	43.7	Very low	81 Å²	81	137.3 Å²	137.3	84%	0.835	81%	0.808	S	S	*	*			trans	-58.4	117	149.3	0	0	0	0	0	109.8
257	L	44.1	Very low	44	Very low	151 Å²	151	138.8 Å²	138.8	79%	0.791	81%	0.809	S	S	*	*			trans	-112.1	113	153.3	-71.7	174.9	0	0	0	105.9	S255 I259	S255-L257 PolarHBondContact O-N 3.33Å; L257-I259 PolarHBondContact O-N 2.8Å
258	E	38.7	Very low	43.9	Very low	195 Å²	195	143.2 Å²	143.2	91%	0.911	83%	0.825	S	S	*	*			trans	-50.1	125.4	163.6	-74.1	175.1	130.8	0	0	108.2
259	I	48.4	Very low	44.1	Very low	127 Å²	127	142.3 Å²	142.3	65%	0.651	82%	0.824	S	S	*	*			trans	-100.2	99.8	165.9	-63.5	172.9	0	0	0	104.4	Y182 L257 A261	Y182-I259 HydrophobicContact CE2-CD1 4.44Å; L257-I259 PolarHBondContact O-N 2.8Å; I259-A261 PolarHBondContact O-N 3.15Å
260	E	37.5	Very low	43.8	Very low	168 Å²	168	143.3 Å²	143.3	79%	0.785	84%	0.84	S	S	*	*			trans	-49.1	131.7	158.2	-74.9	-164.5	126.1	0	0	109.1	D262	E260-D262 PolarHBondContact O-N 2.87Å
261	A	44.4	Very low	43.5	Very low	104 Å²	104	141.5 Å²	141.5	86%	0.86	84%	0.836	S	S	*	*			trans	-89.2	89.7	171	0	0	0	0	0	107.8	I259	I259-A261 PolarHBondContact O-N 3.15Å
262	D	39.7	Very low	42.5	Very low	155 Å²	155	142.9 Å²	142.9	83%	0.829	85%	0.85	S	S	*	*			trans	-90.9	104.7	156.5	-102.4	-34.4	0	0	0	108.3	E260	E260-D262 PolarHBondContact O-N 2.87Å
263	C	37.5	Very low	42.2	Very low	202 Å²	202	149.2 Å²	149.2	100%	1.365	86%	0.858	S	S	*	*			trans	156.1	0	144.2	-150.3	0	0	0	0	110.2

Retrieved 263 of 263 residues in 369.8 ms (Link to these results)

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