A0A077Z3D0_TRITR Loading...

Tetraspannin domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z3D0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 562 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	37.2	Very low	41.7	Very low	257 Å²	257	151.5 Å²	151.5	100%	1.266	79%	0.792	S	S	*	*				0	123.5	0	-63.4	172.1	177.8	0	0	107.4
2	G	40.8	Very low	42	Very low	64 Å²	64	154.3 Å²	154.3	66%	0.66	80%	0.798	S	S	*	*			cis	-169.7	142.5	-3.4	0	0	0	0	0	108.1
3	R	37.6	Very low	42.5	Very low	248 Å²	248	158.7 Å²	158.7	94%	0.936	81%	0.807	S	S	*	*			trans	32.2	121	143.6	-48.3	-178.8	-144.1	-151.6	4.7	118.5
4	G	35.3	Very low	42.9	Very low	69 Å²	69	155.6 Å²	155.6	71%	0.711	81%	0.807	S	S	*	*				103.5	141.2	73.1	0	0	0	0	0	108.1
5	K	43	Very low	43.8	Very low	173 Å²	173	153.1 Å²	153.1	75%	0.752	80%	0.804	S	S	*	*				164.5	152	66.4	-114.8	172.9	162.1	-161.4	0	113.5
6	W	43.7	Very low	44.4	Very low	197 Å²	197	155.4 Å²	155.4	75%	0.746	81%	0.81	S	S	*	*			trans	62.5	130.8	152.2	-46.8	122.7	0	0	0	121.8
7	V	38.5	Very low	44.7	Very low	111 Å²	111	157.5 Å²	157.5	67%	0.673	81%	0.811	S	S	*	*			cis	69.8	101.1	41.9	-176.5	0	0	0	0	112.6
8	E	41.4	Very low	44.7	Very low	150 Å²	150	157.8 Å²	157.8	70%	0.701	81%	0.81	S	S	*	*				73.5	146.1	98.5	-123.1	-167.4	165.1	0	0	112.9
9	K	38.9	Very low	45	Very low	172 Å²	172	154.8 Å²	154.8	75%	0.748	80%	0.802	S	S	*	*			cis	-165.9	153.6	3.8	-151.4	172.7	-160.3	154.8	0	106.4
10	S	53.1	Low	45.1	Very low	106 Å²	106	156.5 Å²	156.5	74%	0.741	81%	0.806	S	S	*	*			trans	-79.6	171.2	165.9	-54.8	0	0	0	0	112.1
11	P	49.1	Very low	45.8	Very low	119 Å²	119	158.1 Å²	158.1	77%	0.773	81%	0.81	S	S	*	*				-142.9	142.8	123	29.2	-10.7	0	0	0	112.1
12	E	45.6	Very low	46.1	Very low	186 Å²	186	155.9 Å²	155.9	87%	0.869	79%	0.787	S	S	*	*				105.1	131.1	61.4	-163.9	178.6	-141.6	0	0	111.1
13	K	49.1	Very low	46.9	Very low	211 Å²	211	158.9 Å²	158.9	92%	0.917	79%	0.793	S	S	*	*			trans	-165.8	150	157.8	-109.6	172.8	-170.5	-175.2	0	114.1
14	S	47.9	Very low	47.2	Very low	116 Å²	116	153.4 Å²	153.4	81%	0.811	78%	0.782	S	S	*	*			trans	-83.6	165.2	-165.5	179.5	0	0	0	0	116.6
15	P	55.8	Low	48.2	Very low	117 Å²	117	159.3 Å²	159.3	76%	0.76	79%	0.79	S	S	*	*			trans	-123.4	165.9	-178.4	41.2	-27.5	0	0	0	117.4
16	Q	52.9	Low	48.1	Very low	190 Å²	190	158.5 Å²	158.5	89%	0.888	79%	0.794	S	S	*	*			trans	-168.8	120.6	157.9	-106.7	175.3	-5.3	0	0	111.9
17	K	50.5	Low	48.5	Very low	191 Å²	191	156.5 Å²	156.5	83%	0.83	80%	0.803	S	S	*	*				56.5	143.5	108.1	-89.7	-172.6	176	-178.2	0	117.7
18	M	43.8	Very low	48.7	Very low	163 Å²	163	159.7 Å²	159.7	80%	0.803	81%	0.811	S	S	*	*			cis	-170.6	-162.1	27.7	-133.9	-168.1	169	0	0	112
19	P	50.8	Low	48.7	Very low	101 Å²	101	157.6 Å²	157.6	66%	0.656	81%	0.813	S	S	*	*			trans	-131.7	-177.6	-134.8	42	-18.2	0	0	0	121.1
20	Q	47.5	Very low	48.9	Very low	188 Å²	188	155.5 Å²	155.5	88%	0.879	82%	0.815	S	S	*	*			trans	34.9	139	150.4	-89.8	173	-31.8	0	0	127.2
21	H	58.9	Low	48.4	Very low	191 Å²	191	154.4 Å²	154.4	88%	0.884	81%	0.812	S	S	*	*			trans	-162.8	156.1	144	-133.3	-70.1	0	0	0	115.3
22	R	44.9	Very low	48.1	Very low	211 Å²	211	157.3 Å²	157.3	80%	0.796	82%	0.82	S	S	*	*			trans	-122.5	158.4	-173.1	-178.2	-165.2	-150.4	168.8	7.9	111.5
23	V	56.7	Low	47.9	Very low	127 Å²	127	152.1 Å²	152.1	77%	0.77	82%	0.817	S	S	*	*			trans	-173.3	143.3	145.4	168.2	0	0	0	0	112.7
24	D	45.1	Very low	47.5	Very low	133 Å²	133	151.2 Å²	151.2	71%	0.711	82%	0.816	S	S	*	*			trans	-99.8	169.4	175.2	-68.3	-57	0	0	0	114
25	H	54.5	Low	47.5	Very low	192 Å²	192	150.6 Å²	150.6	89%	0.889	81%	0.812	S	S	*	*			trans	-173.3	136.4	145.3	-96	-59.6	0	0	0	115.3
26	D	42	Very low	46.9	Very low	156 Å²	156	150.9 Å²	150.9	83%	0.834	81%	0.812	S	S	*	*			trans	-78	162.6	171	-72.7	-49.8	0	0	0	114.9
27	V	52	Low	46.6	Very low	155 Å²	155	151.5 Å²	151.5	94%	0.939	81%	0.812	S	S	*	*			trans	-163.7	146.8	142.2	167.8	0	0	0	0	112.9
28	Q	42	Very low	46.3	Very low	178 Å²	178	147.2 Å²	147.2	83%	0.832	81%	0.812	S	S	*	*			trans	-86.7	172.5	-171.7	-98.4	172.3	-23	0	0	119.7
29	S	42.6	Very low	46.6	Very low	107 Å²	107	144.6 Å²	144.6	75%	0.748	81%	0.805	S	S	*	*			trans	84.1	143.8	151.3	78.5	0	0	0	0	117.9
30	T	41.3	Very low	46.3	Very low	128 Å²	128	147.6 Å²	147.6	79%	0.785	81%	0.81	S	S	*	*			cis	-170.4	156.7	36.1	-18.7	0	0	0	0	111.9
31	A	42.9	Very low	46.3	Very low	82 Å²	82	147 Å²	147	68%	0.678	81%	0.81	S	S	*	*			trans	65.7	115.6	139.9	0	0	0	0	0	124.7
32	L	43.1	Very low	45.6	Very low	180 Å²	180	144.3 Å²	144.3	94%	0.942	80%	0.802	S	S	*	*				34.6	123	129.5	-82.5	127	0	0	0	121.7
33	G	42.1	Very low	45.9	Very low	78 Å²	78	139 Å²	139	80%	0.804	79%	0.793	S	S	*	*			trans	-169.2	112	157.3	0	0	0	0	0	112.1
34	Q	40.8	Very low	45.3	Very low	191 Å²	191	139 Å²	139	89%	0.893	79%	0.793	S	S	*	*			trans	-62.6	149.4	179.8	-65	158.1	-52.9	0	0	113.2
35	S	47.6	Very low	45.5	Very low	104 Å²	104	137.6 Å²	137.6	73%	0.727	79%	0.79	S	S	*	*				171.2	115.6	115.6	69.1	0	0	0	0	111.9
36	T	43.2	Very low	45.2	Very low	123 Å²	123	134.1 Å²	134.1	76%	0.755	78%	0.782	S	S	*	*			trans	28.6	109.4	134.1	49.6	0	0	0	0	119
37	F	47	Very low	45.6	Very low	203 Å²	203	136.9 Å²	136.9	89%	0.89	79%	0.787	S	S	*	*				-159.6	101.5	125.6	-115.3	-81.4	0	0	0	108.8
38	A	43.2	Very low	45.3	Very low	100 Å²	100	132.6 Å²	132.6	83%	0.826	77%	0.768	S	S	*	*			trans	-95.2	112.4	167.4	0	0	0	0	0	108
39	T	50.6	Low	46.2	Very low	108 Å²	108	131.7 Å²	131.7	66%	0.663	77%	0.768	S	S	*	*			trans	-152.9	91.5	157.4	-1.1	0	0	0	0	105.1
40	Q	43.8	Very low	47.3	Very low	165 Å²	165	131.2 Å²	131.2	77%	0.771	76%	0.763	S	S	*	*				60.3	83.6	98.6	-157.5	179.4	8.5	0	0	111.3
41	M	48.6	Very low	48.6	Very low	175 Å²	175	129.3 Å²	129.3	86%	0.862	75%	0.747	S	S	*	*			trans	-124.8	91.5	145.8	-87.9	-157.4	176	0	0	107.7	T43	M41-T43 VanDerWaalsContact C-N 3.29Å; M41-T43 PolarHBondContact O-N 3.04Å
42	D	44.4	Very low	50.2	Low	134 Å²	134	129.3 Å²	129.3	72%	0.717	74%	0.74	S	S	*	*			trans	-59	97.1	151.4	-77.1	-49.1	0	0	0	107.7
43	T	50.4	Low	51.9	Low	101 Å²	101	124.7 Å²	124.7	62%	0.62	73%	0.729	S	S	*	*			trans	-115	90.8	152.6	40.7	0	0	0	0	107.3	M41 T45	M41-T43 VanDerWaalsContact C-N 3.29Å; M41-T43 PolarHBondContact O-N 3.04Å; T43-T45 PolarHBondContact O-N 2.8Å
44	T	44.1	Very low	53.5	Low	125 Å²	125	125.5 Å²	125.5	77%	0.767	72%	0.718	S	S	*	*			trans	-50.1	79.6	145.1	37.1	0	0	0	0	108.9	T46	T44-T46 PolarHBondContact O-N 2.92Å
45	T	50.3	Low	55.3	Low	104 Å²	104	118.9 Å²	118.9	64%	0.638	69%	0.691	S	S	*	*			trans	-75.2	81.7	159.8	42.9	0	0	0	0	106.8	T43 F47	T43-T45 PolarHBondContact O-N 2.8Å; T45-F47 PolarHBondContact O-N 2.95Å
46	T	46.4	Very low	56.6	Low	119 Å²	119	120.6 Å²	120.6	73%	0.73	68%	0.681	S	S	*	*			trans	-45.3	106.1	152.8	29.8	0	0	0	0	107.6	T44 A48	T44-T46 PolarHBondContact O-N 2.92Å; T46-A48 PolarHBondContact O-N 2.74Å
47	F	50.5	Low	58.2	Low	215 Å²	215	121 Å²	121	94%	0.943	67%	0.673	S	S	*	*			trans	-61.3	74.6	166.3	-90.5	-94.4	0	0	0	108.3	T45	T45-F47 PolarHBondContact O-N 2.95Å
48	A	46.1	Very low	59.7	Low	64 Å²	64	116.8 Å²	116.8	53%	0.529	66%	0.659	S	S	.	*			trans	-153.3	53.4	-174.2	0	0	0	0	0	110.1	T46	T46-A48 PolarHBondContact O-N 2.74Å
49	N	60.9	Low	61.4	Low	159 Å²	159	116.9 Å²	116.9	85%	0.85	64%	0.642	S	S	*	*			trans	-141.3	100.7	141.6	-84	-42.5	0	0	0	106.8	L51	N49-L51 PolarHBondContact O-N 3.16Å; N49-L51 VanDerWaalsContact O-N 3.16Å
50	P	65.8	Low	62.7	Low	97 Å²	97	119.5 Å²	119.5	63%	0.63	64%	0.641	S	S	*	*			trans	-51.3	128.4	168.3	22	-30.6	0	0	0	107.4
51	L	68.7	Low	64.4	Low	88 Å²	88	114.6 Å²	114.6	46%	0.461	62%	0.619	S	S	.	*			trans	-39.6	131.9	168.8	-91	125.6	0	0	0	107.7	N49 A53 T55 R56	N49-L51 PolarHBondContact O-N 3.16Å; N49-L51 VanDerWaalsContact O-N 3.16Å; L51-A53 PolarHBondContact O-N 2.78Å; L51-T55 HydrophobicContact CD2-CG2 4.14Å; L51-R56 HydrophobicContact CB-CG 4.02Å
52	P	77.5	Confident	65.7	Low	82 Å²	82	109.4 Å²	109.4	53%	0.532	60%	0.6	S	S	.	*			trans	-49.6	134.8	-176.5	6.9	-14.2	0	0	0	107.8	T54 T55	P52-T54 CarbonylContact O-C 3.49Å; P52-T54 PolarHBondContact O-N 2.95Å; P52-T55 WeakPolarHBondContact CG-OG1 3.42Å; P52-T55 PolarHBondContact O-N 3.02Å; P52-T55 PolarHBondContact O-OG1 3.5Å
53	A	77	Confident	67.4	Low	84 Å²	84	107.5 Å²	107.5	69%	0.694	59%	0.589	S	S	*	*	H	α-helix	trans	-49.5	-28.6	-172.2	0	0	0	0	0	111.9	L51 F57	L51-A53 PolarHBondContact O-N 2.78Å; A53-F57 WeakPolarHBondContact O-CB 3.45Å; A53-F57 PolarHBondContact O-N 2.91Å
54	T	77.4	Confident	68.7	Low	94 Å²	94	105.9 Å²	105.9	58%	0.577	58%	0.579	S	S	*	*	H	α-helix	trans	-59.7	-40.7	173.1	57.1	0	0	0	0	114.6	P52 F57 L58	P52-T54 CarbonylContact O-C 3.49Å; P52-T54 PolarHBondContact O-N 2.95Å; T54-F57 PolarHBondContact O-N 2.7Å; T54-L58 WeakPolarHBondContact O-CB 3.38Å; T54-L58 WeakPolarHBondContact O-CG 3.25Å; T54-L58 PolarHBondContact O-N 3.28Å
55	T	77.4	Confident	70.3	Confident	52 Å²	52	105 Å²	105	32%	0.319	57%	0.569	S	S	.	*	H	α-helix	trans	-73.9	-40.6	-178.8	-18.4	0	0	0	0	111.6	L51 P52 F57 L58 Q59	L51-T55 HydrophobicContact CD2-CG2 4.14Å; P52-T55 WeakPolarHBondContact CG-OG1 3.42Å; P52-T55 PolarHBondContact O-N 3.02Å; P52-T55 PolarHBondContact O-OG1 3.5Å; T55-F57 VanDerWaalsContact C-N 3.3Å; T55-L58 PolarHBondContact O-N 3.02Å; T55-Q59 WeakPolarHBondContact O-CG 3.45Å; T55-Q59 PolarHBondContact O-N 3.2Å
56	R	76	Confident	71.6	Confident	141 Å²	141	102.6 Å²	102.6	53%	0.532	55%	0.552	S	S	.	*	H	α-helix	trans	-63.4	-40.2	173	-71.1	-174.2	177	179.9	0.5	111	L51 Q59 Y60	L51-R56 HydrophobicContact CB-CG 4.02Å; R56-Q59 PolarHBondContact O-N 3.47Å; R56-Y60 WeakPolarHBondContact O-CB 3.49Å; R56-Y60 PolarHBondContact O-N 3.12Å
57	F	76.7	Confident	73.2	Confident	132 Å²	132	101.1 Å²	101.1	58%	0.579	54%	0.539	S	S	*	.	H	α-helix	trans	-63	-44.2	175.8	-174.4	-108.1	0	0	0	112.2	A53 T54 T55 Y60 I61	A53-F57 WeakPolarHBondContact O-CB 3.45Å; A53-F57 PolarHBondContact O-N 2.91Å; T54-F57 PolarHBondContact O-N 2.7Å; T55-F57 VanDerWaalsContact C-N 3.3Å; F57-Y60 PolarHBondContact O-N 2.89Å; F57-I61 HydrophobicContact CD1-CD1 3.62Å; F57-I61 HydrophobicContact CD2-CD1 4.47Å; F57-I61 HydrophobicContact CE1-CD1 3.18Å; F57-I61 HydrophobicContact CE1-CG1 4.34Å; F57-I61 HydrophobicContact CE2-CD1 4.11Å; F57-I61 HydrophobicContact CG-CD1 4.26Å; F57-I61 HydrophobicContact CZ-CD1 3.47Å; F57-I61 VanDerWaalsContact CZ-CD1 3.47Å; F57-I61 HydrophobicContact CZ-CG1 4.36Å; F57-I61 WeakPolarHBondContact O-CG1 3.24Å; F57-I61 PolarHBondContact O-N 3.43Å
58	L	76.9	Confident	74.3	Confident	113 Å²	113	93 Å²	93	59%	0.592	51%	0.511	S	S	*	.	H	α-helix	trans	-65.3	-41.1	176.6	-75.4	170.1	0	0	0	112.9	T54 T55 I61 S62	T54-L58 WeakPolarHBondContact O-CB 3.38Å; T54-L58 WeakPolarHBondContact O-CG 3.25Å; T54-L58 PolarHBondContact O-N 3.28Å; T55-L58 PolarHBondContact O-N 3.02Å; L58-I61 PolarHBondContact O-N 3.2Å; L58-S62 WeakPolarHBondContact O-CB 3.31Å; L58-S62 PolarHBondContact O-N 3.48Å
59	Q	79.1	Confident	75.8	Confident	103 Å²	103	94.1 Å²	94.1	48%	0.481	51%	0.512	S	S	.	.	H	α-helix	trans	-63.1	-43.9	174.4	-76.7	-179.7	-32.4	0	0	111.5	T55 R56 S62 I63	T55-Q59 WeakPolarHBondContact O-CG 3.45Å; T55-Q59 PolarHBondContact O-N 3.2Å; R56-Q59 PolarHBondContact O-N 3.47Å; Q59-S62 PolarHBondContact O-N 3.44Å; Q59-I63 WeakPolarHBondContact O-CG1 3.34Å; Q59-I63 PolarHBondContact O-N 3.08Å
60	Y	79.6	Confident	76.5	Confident	162 Å²	162	87.9 Å²	87.9	64%	0.635	48%	0.48	S	S	*	.	H	α-helix	trans	-61.5	-46.4	176.7	-173.7	-98.8	0	0	0	111.6	R56 F57 S62 I63 V64	R56-Y60 WeakPolarHBondContact O-CB 3.49Å; R56-Y60 PolarHBondContact O-N 3.12Å; F57-Y60 PolarHBondContact O-N 2.89Å; Y60-S62 VanDerWaalsContact C-N 3.34Å; Y60-S62 PolarHBondContact O-N 2.98Å; Y60-I63 PolarHBondContact O-N 2.92Å; Y60-V64 HydrophobicContact CD1-CG2 4.05Å; Y60-V64 HydrophobicContact CE1-CG2 3.72Å; Y60-V64 HydrophobicContact CE2-CG2 4.29Å; Y60-V64 HydrophobicContact CG-CG2 4.47Å; Y60-V64 WeakPolarHBondContact O-CB 3.49Å; Y60-V64 VanDerWaalsContact O-CG2 3.23Å; Y60-V64 WeakPolarHBondContact O-CG2 3.5Å; Y60-V64 PolarHBondContact O-N 2.94Å
61	I	78.1	Confident	76.9	Confident	62 Å²	62	89.2 Å²	89.2	32%	0.318	48%	0.478	S	S	.	.	H	α-helix	trans	-60.4	-43.4	175.7	-73.5	174.5	0	0	0	111.4	F57 L58 V64 L65	F57-I61 HydrophobicContact CD1-CD1 3.62Å; F57-I61 HydrophobicContact CD2-CD1 4.47Å; F57-I61 HydrophobicContact CE1-CD1 3.18Å; F57-I61 HydrophobicContact CE1-CG1 4.34Å; F57-I61 HydrophobicContact CE2-CD1 4.11Å; F57-I61 HydrophobicContact CG-CD1 4.26Å; F57-I61 HydrophobicContact CZ-CD1 3.47Å; F57-I61 VanDerWaalsContact CZ-CD1 3.47Å; F57-I61 HydrophobicContact CZ-CG1 4.36Å; F57-I61 WeakPolarHBondContact O-CG1 3.24Å; F57-I61 PolarHBondContact O-N 3.43Å; L58-I61 PolarHBondContact O-N 3.2Å; I61-V64 PolarHBondContact O-N 3.36Å; I61-L65 HydrophobicContact CG2-CD1 3.64Å; I61-L65 HydrophobicContact CG2-CG 4.26Å; I61-L65 WeakPolarHBondContact O-CB 3.35Å; I61-L65 WeakPolarHBondContact O-CG 3.41Å; I61-L65 PolarHBondContact O-N 3.34Å
62	S	77.2	Confident	77.1	Confident	66 Å²	66	90.7 Å²	90.7	46%	0.462	49%	0.486	S	S	.	.	H	α-helix	trans	-63.9	-43.2	180	-177.7	0	0	0	0	112	L58 Q59 Y60 L66	L58-S62 WeakPolarHBondContact O-CB 3.31Å; L58-S62 PolarHBondContact O-N 3.48Å; Q59-S62 PolarHBondContact O-N 3.44Å; Y60-S62 VanDerWaalsContact C-N 3.34Å; Y60-S62 PolarHBondContact O-N 2.98Å; S62-L66 VanDerWaalsContact O-CB 3.27Å; S62-L66 WeakPolarHBondContact O-CB 3.39Å; S62-L66 PolarHBondContact O-N 3.16Å
63	I	79.3	Confident	76.9	Confident	94 Å²	94	88.7 Å²	88.7	48%	0.482	48%	0.476	S	S	.	.	H	α-helix	trans	-64.9	-45.3	176.3	-67.5	167.9	0	0	0	110.5	Q59 Y60 L66 L67	Q59-I63 WeakPolarHBondContact O-CG1 3.34Å; Q59-I63 PolarHBondContact O-N 3.08Å; Y60-I63 PolarHBondContact O-N 2.92Å; I63-L66 PolarHBondContact O-N 3.38Å; I63-L67 HydrophobicContact CG2-CD1 3.93Å; I63-L67 HydrophobicContact CG2-CG 4.38Å; I63-L67 WeakPolarHBondContact O-CB 3.34Å; I63-L67 WeakPolarHBondContact O-CG 3.3Å; I63-L67 PolarHBondContact O-N 2.99Å
64	V	77.9	Confident	76.7	Confident	68 Å²	68	90 Å²	90	41%	0.412	47%	0.469	S	S	.	.	H	α-helix	trans	-62.8	-43.8	178.7	171.2	0	0	0	0	111.4	Y60 I61 L66 A68	Y60-V64 HydrophobicContact CD1-CG2 4.05Å; Y60-V64 HydrophobicContact CE1-CG2 3.72Å; Y60-V64 HydrophobicContact CE2-CG2 4.29Å; Y60-V64 HydrophobicContact CG-CG2 4.47Å; Y60-V64 WeakPolarHBondContact O-CB 3.49Å; Y60-V64 VanDerWaalsContact O-CG2 3.23Å; Y60-V64 WeakPolarHBondContact O-CG2 3.5Å; Y60-V64 PolarHBondContact O-N 2.94Å; I61-V64 PolarHBondContact O-N 3.36Å; V64-L66 VanDerWaalsContact C-N 3.35Å; V64-L66 PolarHBondContact O-N 2.97Å; V64-A68 VanDerWaalsContact O-CB 3.3Å; V64-A68 WeakPolarHBondContact O-CB 3.33Å; V64-A68 PolarHBondContact O-N 2.94Å
65	L	77.8	Confident	76.6	Confident	107 Å²	107	90 Å²	90	56%	0.56	47%	0.465	S	S	*	.	H	α-helix	trans	-62.7	-41.5	176	-80.5	168.4	0	0	0	111.8	I61 A68 V69	I61-L65 HydrophobicContact CG2-CD1 3.64Å; I61-L65 HydrophobicContact CG2-CG 4.26Å; I61-L65 WeakPolarHBondContact O-CB 3.35Å; I61-L65 WeakPolarHBondContact O-CG 3.41Å; I61-L65 PolarHBondContact O-N 3.34Å; L65-A68 PolarHBondContact O-N 3.29Å; L65-V69 VanDerWaalsContact O-CG2 3.31Å; L65-V69 WeakPolarHBondContact O-CG2 3.19Å; L65-V69 PolarHBondContact O-N 3.46Å
66	L	77.2	Confident	76.3	Confident	53 Å²	53	90 Å²	90	28%	0.277	47%	0.466	S	S	.	.	H	α-helix	trans	-73.8	-36.5	-176.9	-158.9	136.8	0	0	0	111.9	S62 I63 V64 V69 C70 C130 I134	S62-L66 VanDerWaalsContact O-CB 3.27Å; S62-L66 WeakPolarHBondContact O-CB 3.39Å; S62-L66 PolarHBondContact O-N 3.16Å; I63-L66 PolarHBondContact O-N 3.38Å; V64-L66 VanDerWaalsContact C-N 3.35Å; V64-L66 PolarHBondContact O-N 2.97Å; L66-V69 PolarHBondContact O-N 3.37Å; L66-C70 WeakPolarHBondContact O-CB 3.42Å; L66-C70 PolarHBondContact O-N 2.94Å; L66-C70 PolarHBondContact O-SG 2.95Å; L66-C130 HydrophobicContact CD2-CB 4.31Å; L66-I134 HydrophobicContact CD2-CD1 3.13Å; L66-I134 HydrophobicContact CD2-CG1 3.51Å
67	L	79.1	Confident	76	Confident	88 Å²	88	85.6 Å²	85.6	46%	0.461	46%	0.458	S	S	.	.	H	α-helix	trans	-63	-42	168	-73	173.9	0	0	0	111.4	I63 C70 H71	I63-L67 HydrophobicContact CG2-CD1 3.93Å; I63-L67 HydrophobicContact CG2-CG 4.38Å; I63-L67 WeakPolarHBondContact O-CB 3.34Å; I63-L67 WeakPolarHBondContact O-CG 3.3Å; I63-L67 PolarHBondContact O-N 2.99Å; L67-C70 PolarHBondContact O-N 3.47Å; L67-H71 WeakPolarHBondContact O-CB 3.36Å; L67-H71 PolarHBondContact O-CD2 3.08Å; L67-H71 VanDerWaalsContact O-CD2 3.22Å; L67-H71 PolarHBondContact O-N 3Å
68	A	75.2	Confident	75.7	Confident	43 Å²	43	85.6 Å²	85.6	36%	0.355	46%	0.461	S	S	.	.	H	α-helix	trans	-62.3	-43	176	0	0	0	0	0	111.9	V64 L65 H71 L72	V64-A68 VanDerWaalsContact O-CB 3.3Å; V64-A68 WeakPolarHBondContact O-CB 3.33Å; V64-A68 PolarHBondContact O-N 2.94Å; L65-A68 PolarHBondContact O-N 3.29Å; A68-H71 PolarHBondContact O-N 3.34Å; A68-L72 WeakPolarHBondContact O-CB 3.36Å; A68-L72 VanDerWaalsContact O-CG 3.28Å; A68-L72 WeakPolarHBondContact O-CG 3.37Å; A68-L72 PolarHBondContact O-N 3.47Å
69	V	77	Confident	75.4	Confident	88 Å²	88	84.9 Å²	84.9	53%	0.533	46%	0.455	S	S	.	.	H	α-helix	trans	-64	-42.8	175.1	171.3	0	0	0	0	111.3	L65 L66 L72 A73	L65-V69 VanDerWaalsContact O-CG2 3.31Å; L65-V69 WeakPolarHBondContact O-CG2 3.19Å; L65-V69 PolarHBondContact O-N 3.46Å; L66-V69 PolarHBondContact O-N 3.37Å; V69-L72 PolarHBondContact O-N 3.25Å; V69-A73 WeakPolarHBondContact O-CB 3.3Å; V69-A73 PolarHBondContact O-N 2.78Å
70	C	75.7	Confident	74.7	Confident	28 Å²	28	86 Å²	86	19%	0.189	46%	0.455	C	S	.	.	H	α-helix	trans	-63.2	-42.9	176	-69.2	0	0	0	0	111.8	L66 L67 A73 M74	L66-C70 WeakPolarHBondContact O-CB 3.42Å; L66-C70 PolarHBondContact O-N 2.94Å; L66-C70 PolarHBondContact O-SG 2.95Å; L67-C70 PolarHBondContact O-N 3.47Å; C70-A73 PolarHBondContact O-N 2.84Å; C70-M74 WeakPolarHBondContact O-CB 3.33Å; C70-M74 VanDerWaalsContact O-CG 3.29Å; C70-M74 WeakPolarHBondContact O-CG 3.36Å; C70-M74 PolarHBondContact O-N 3.28Å
71	H	73.8	Confident	74.2	Confident	125 Å²	125	80.3 Å²	80.3	58%	0.579	44%	0.442	S	S	*	.	H	α-helix	trans	-63.6	-43	175.3	-85.5	-66.5	0	0	0	112	L67 A68 A73 M74 I75	L67-H71 WeakPolarHBondContact O-CB 3.36Å; L67-H71 PolarHBondContact O-CD2 3.08Å; L67-H71 VanDerWaalsContact O-CD2 3.22Å; L67-H71 PolarHBondContact O-N 3Å; A68-H71 PolarHBondContact O-N 3.34Å; H71-A73 VanDerWaalsContact C-N 3.35Å; H71-A73 PolarHBondContact O-N 3.02Å; H71-M74 PolarHBondContact O-N 2.96Å; H71-I75 WeakPolarHBondContact O-CB 3.49Å; H71-I75 WeakPolarHBondContact O-CD1 3.27Å; H71-I75 WeakPolarHBondContact O-CG1 3.23Å; H71-I75 PolarHBondContact O-N 3.47Å
72	L	72.8	Confident	73.9	Confident	120 Å²	120	80.8 Å²	80.8	63%	0.628	44%	0.441	S	S	*	.	H	α-helix	trans	-64	-39.1	176.2	-73.2	170.2	0	0	0	112.1	A68 V69 S76	A68-L72 WeakPolarHBondContact O-CB 3.36Å; A68-L72 VanDerWaalsContact O-CG 3.28Å; A68-L72 WeakPolarHBondContact O-CG 3.37Å; A68-L72 PolarHBondContact O-N 3.47Å; V69-L72 PolarHBondContact O-N 3.25Å; L72-S76 WeakPolarHBondContact O-CB 3.3Å; L72-S76 PolarHBondContact O-N 3.42Å; L72-S76 PolarHBondContact O-OG 3.18Å
73	A	73.9	Confident	73.5	Confident	40 Å²	40	79.9 Å²	79.9	33%	0.331	43%	0.431	S	S	.	.	H	α-helix	trans	-68.1	-38.9	175.4	0	0	0	0	0	112.6	V69 C70 H71 S76 S77	V69-A73 WeakPolarHBondContact O-CB 3.3Å; V69-A73 PolarHBondContact O-N 2.78Å; C70-A73 PolarHBondContact O-N 2.84Å; H71-A73 VanDerWaalsContact C-N 3.35Å; H71-A73 PolarHBondContact O-N 3.02Å; A73-S76 WeakPolarHBondContact CA-OG 3.41Å; A73-S76 PolarHBondContact O-OG 3.3Å; A73-S77 VanDerWaalsContact O-CB 3.3Å; A73-S77 WeakPolarHBondContact O-CB 3.37Å; A73-S77 PolarHBondContact O-N 3.48Å
74	M	73.3	Confident	73	Confident	112 Å²	112	76.9 Å²	76.9	55%	0.552	42%	0.418	S	S	*	.	H	α-helix	trans	-67.6	-45	175.1	-75.1	-71.4	-74.3	0	0	111.5	C70 H71 S76 S77 M78	C70-M74 WeakPolarHBondContact O-CB 3.33Å; C70-M74 VanDerWaalsContact O-CG 3.29Å; C70-M74 WeakPolarHBondContact O-CG 3.36Å; C70-M74 PolarHBondContact O-N 3.28Å; H71-M74 PolarHBondContact O-N 2.96Å; M74-S76 VanDerWaalsContact C-N 3.35Å; M74-S76 PolarHBondContact O-N 2.96Å; M74-S77 PolarHBondContact O-N 3.48Å; M74-M78 WeakPolarHBondContact O-CB 3.37Å; M74-M78 WeakPolarHBondContact O-CG 3.47Å; M74-M78 PolarHBondContact O-N 3.38Å
75	I	73.6	Confident	72.8	Confident	94 Å²	94	78.5 Å²	78.5	48%	0.482	43%	0.425	S	S	.	.	H	α-helix	trans	-61.3	-45.9	175.9	-69	165.5	0	0	0	109.7	H71 M78 Q79	H71-I75 WeakPolarHBondContact O-CB 3.49Å; H71-I75 WeakPolarHBondContact O-CD1 3.27Å; H71-I75 WeakPolarHBondContact O-CG1 3.23Å; H71-I75 PolarHBondContact O-N 3.47Å; I75-M78 PolarHBondContact O-N 2.7Å; I75-Q79 HydrophobicContact CG2-CG 4.28Å; I75-Q79 WeakPolarHBondContact O-CB 3.43Å; I75-Q79 WeakPolarHBondContact O-CG 3.39Å; I75-Q79 PolarHBondContact O-N 2.96Å
76	S	72.1	Confident	72.4	Confident	50 Å²	50	74.2 Å²	74.2	35%	0.35	40%	0.403	S	S	.	.	H	α-helix	trans	-62.1	-48.5	177.6	70.7	0	0	0	0	111	L72 A73 M74 M78 Q79 Y80	L72-S76 WeakPolarHBondContact O-CB 3.3Å; L72-S76 PolarHBondContact O-N 3.42Å; L72-S76 PolarHBondContact O-OG 3.18Å; A73-S76 WeakPolarHBondContact CA-OG 3.41Å; A73-S76 PolarHBondContact O-OG 3.3Å; M74-S76 VanDerWaalsContact C-N 3.35Å; M74-S76 PolarHBondContact O-N 2.96Å; S76-M78 VanDerWaalsContact C-N 3.32Å; S76-M78 PolarHBondContact O-N 3.01Å; S76-Q79 PolarHBondContact O-N 2.89Å; S76-Y80 WeakPolarHBondContact O-CB 3.32Å; S76-Y80 WeakPolarHBondContact O-CD2 3.36Å; S76-Y80 PolarHBondContact O-N 3.29Å
77	S	70.4	Confident	71.7	Confident	50 Å²	50	75 Å²	75	35%	0.35	41%	0.407	S	S	.	.	H	α-helix	trans	-58.3	-40.9	177.7	-173.2	0	0	0	0	112.8	A73 M74 Y80 A81	A73-S77 VanDerWaalsContact O-CB 3.3Å; A73-S77 WeakPolarHBondContact O-CB 3.37Å; A73-S77 PolarHBondContact O-N 3.48Å; M74-S77 PolarHBondContact O-N 3.48Å; S77-Y80 PolarHBondContact O-N 3.5Å; S77-A81 WeakPolarHBondContact O-CB 3.14Å; S77-A81 PolarHBondContact O-N 2.94Å
78	M	69.5	Low	71.3	Confident	132 Å²	132	76.2 Å²	76.2	65%	0.65	41%	0.411	S	S	*	.	H	α-helix	trans	-67.3	-43.3	176.9	-74.6	-178.4	68.2	0	0	112.2	M74 I75 S76 Y80 A81 K82	M74-M78 WeakPolarHBondContact O-CB 3.37Å; M74-M78 WeakPolarHBondContact O-CG 3.47Å; M74-M78 PolarHBondContact O-N 3.38Å; I75-M78 PolarHBondContact O-N 2.7Å; S76-M78 VanDerWaalsContact C-N 3.32Å; S76-M78 PolarHBondContact O-N 3.01Å; M78-Y80 VanDerWaalsContact C-N 3.33Å; M78-A81 PolarHBondContact O-N 3.43Å; M78-K82 PolarHBondContact O-N 3.45Å; M78-K82 VanDerWaalsContact O-N 3.08Å
79	Q	71.3	Confident	71.1	Confident	98 Å²	98	80.1 Å²	80.1	46%	0.458	42%	0.422	S	S	.	.	H	α-helix	trans	-64	-40.2	176.3	-66.7	-66.7	-20.6	0	0	111	I75 S76 K82 L83	I75-Q79 HydrophobicContact CG2-CG 4.28Å; I75-Q79 WeakPolarHBondContact O-CB 3.43Å; I75-Q79 WeakPolarHBondContact O-CG 3.39Å; I75-Q79 PolarHBondContact O-N 2.96Å; S76-Q79 PolarHBondContact O-N 2.89Å; Q79-K82 PolarHBondContact O-N 3.45Å; Q79-L83 WeakPolarHBondContact O-CB 3.26Å; Q79-L83 PolarHBondContact O-N 3.39Å
80	Y	62.9	Low	70.6	Confident	126 Å²	126	79 Å²	79	49%	0.494	42%	0.415	S	S	.	.	H	α-helix	trans	-69.6	-39.8	177.4	-80.7	-66.1	0	0	0	113.1	S76 S77 M78 K82 L83 S84	S76-Y80 WeakPolarHBondContact O-CB 3.32Å; S76-Y80 WeakPolarHBondContact O-CD2 3.36Å; S76-Y80 PolarHBondContact O-N 3.29Å; S77-Y80 PolarHBondContact O-N 3.5Å; M78-Y80 VanDerWaalsContact C-N 3.33Å; Y80-K82 VanDerWaalsContact C-N 3.3Å; Y80-K82 PolarHBondContact O-N 3.37Å; Y80-L83 HydrophobicContact CD1-CD2 4.41Å; Y80-L83 PolarHBondContact O-N 2.98Å; Y80-S84 WeakPolarHBondContact O-CB 3.29Å; Y80-S84 PolarHBondContact O-N 2.93Å
81	A	70	Confident	69.9	Low	43 Å²	43	78.6 Å²	78.6	36%	0.355	41%	0.411	S	S	.	.	H	α-helix	trans	-62.1	-40.3	174.3	0	0	0	0	0	111.5	S77 M78 S84 N85	S77-A81 WeakPolarHBondContact O-CB 3.14Å; S77-A81 PolarHBondContact O-N 2.94Å; M78-A81 PolarHBondContact O-N 3.43Å; A81-S84 PolarHBondContact O-N 2.91Å; A81-N85 PolarHBondContact O-N 2.92Å; A81-N85 VanDerWaalsContact O-N 3.1Å
82	K	72.2	Confident	69.6	Low	71 Å²	71	78.4 Å²	78.4	31%	0.309	41%	0.411	S	S	.	.	H	α-helix	trans	-65.2	-46.1	175.4	-160.8	176	-173.6	-172.7	0	111.3	M78 Q79 Y80 S84 N85 T86 A315 Q319	M78-K82 PolarHBondContact O-N 3.45Å; M78-K82 VanDerWaalsContact O-N 3.08Å; Q79-K82 PolarHBondContact O-N 3.45Å; Y80-K82 VanDerWaalsContact C-N 3.3Å; Y80-K82 PolarHBondContact O-N 3.37Å; K82-S84 VanDerWaalsContact C-N 3.32Å; K82-S84 PolarHBondContact O-N 2.85Å; K82-N85 PolarHBondContact O-N 3.36Å; K82-T86 PolarHBondContact O-N 2.86Å; K82-T86 PolarHBondContact O-OG1 3.22Å; K82-T86 VanDerWaalsContact O-OG1 3.1Å; K82-A315 HydrophobicContact CD-CB 4.27Å; K82-A315 WeakPolarHBondContact CE-O 3.36Å; K82-A315 PolarHBondContact NZ-O 2.9Å; K82-Q319 VanDerWaalsContact NZ-OE1 3.16Å
83	L	68.2	Low	69.3	Low	48 Å²	48	79.5 Å²	79.5	25%	0.251	41%	0.41	S	S	.	.	H	α-helix	trans	-60.2	-40.4	175.9	-177.4	65.9	0	0	0	112	Q79 Y80 T86 L87 E311	Q79-L83 WeakPolarHBondContact O-CB 3.26Å; Q79-L83 PolarHBondContact O-N 3.39Å; Y80-L83 HydrophobicContact CD1-CD2 4.41Å; Y80-L83 PolarHBondContact O-N 2.98Å; L83-T86 PolarHBondContact O-N 3.31Å; L83-L87 HydrophobicContact CD1-CD1 4.46Å; L83-L87 HydrophobicContact CG-CD1 4.04Å; L83-L87 WeakPolarHBondContact O-CB 3.37Å; L83-L87 PolarHBondContact O-N 3.02Å; L83-E311 HydrophobicContact CD1-CB 4.45Å
84	S	69.6	Low	68.6	Low	30 Å²	30	79.8 Å²	79.8	21%	0.21	41%	0.408	C	S	.	.	H	α-helix	trans	-61.9	-45.4	176.2	179.4	0	0	0	0	112.3	Y80 A81 K82 T86 L87 Q88 L116	Y80-S84 WeakPolarHBondContact O-CB 3.29Å; Y80-S84 PolarHBondContact O-N 2.93Å; A81-S84 PolarHBondContact O-N 2.91Å; K82-S84 VanDerWaalsContact C-N 3.32Å; K82-S84 PolarHBondContact O-N 2.85Å; S84-T86 VanDerWaalsContact C-N 3.32Å; S84-T86 PolarHBondContact O-N 2.9Å; S84-L87 PolarHBondContact O-N 2.96Å; S84-Q88 WeakPolarHBondContact O-CB 3.31Å; S84-Q88 PolarHBondContact O-N 3.46Å; S84-L116 WeakPolarHBondContact OG-CD2 3.17Å
85	N	72.7	Confident	67.9	Low	102 Å²	102	77.4 Å²	77.4	55%	0.545	40%	0.4	S	S	.	.	H	α-helix	trans	-64.2	-39.1	177.4	-79.9	-10.1	0	0	0	111.3	A81 K82 Q88 Q89	A81-N85 PolarHBondContact O-N 2.92Å; A81-N85 VanDerWaalsContact O-N 3.1Å; K82-N85 PolarHBondContact O-N 3.36Å; N85-Q88 PolarHBondContact O-N 3.42Å; N85-Q89 WeakPolarHBondContact O-CG 3.32Å; N85-Q89 PolarHBondContact O-N 3Å
86	T	69	Low	67	Low	17 Å²	17	80.2 Å²	80.2	10%	0.104	41%	0.411	C	S	.	.	H	α-helix	trans	-65.4	-46	173.9	-50.3	0	0	0	0	111.4	K82 L83 S84 Q88 Q89 V90 E311	K82-T86 PolarHBondContact O-N 2.86Å; K82-T86 PolarHBondContact O-OG1 3.22Å; K82-T86 VanDerWaalsContact O-OG1 3.1Å; L83-T86 PolarHBondContact O-N 3.31Å; S84-T86 VanDerWaalsContact C-N 3.32Å; S84-T86 PolarHBondContact O-N 2.9Å; T86-Q88 VanDerWaalsContact C-N 3.26Å; T86-Q88 PolarHBondContact O-N 3.3Å; T86-Q89 PolarHBondContact O-N 2.96Å; T86-V90 HydrophobicContact CG2-CG2 4.27Å; T86-V90 WeakPolarHBondContact O-CB 3.42Å; T86-V90 VanDerWaalsContact O-CG2 3.29Å; T86-V90 WeakPolarHBondContact O-CG2 3.46Å; T86-V90 PolarHBondContact O-N 3.36Å; T86-E311 WeakPolarHBondContact CG2-OE2 3.3Å
87	L	63.8	Low	66.2	Low	70 Å²	70	86.3 Å²	86.3	37%	0.366	43%	0.431	S	S	.	.	H	α-helix	trans	-59	-38	174.6	-98	157.5	0	0	0	111.6	L83 S84 T91	L83-L87 HydrophobicContact CD1-CD1 4.46Å; L83-L87 HydrophobicContact CG-CD1 4.04Å; L83-L87 WeakPolarHBondContact O-CB 3.37Å; L83-L87 PolarHBondContact O-N 3.02Å; S84-L87 PolarHBondContact O-N 2.96Å; L87-T91 WeakPolarHBondContact O-CA 3.19Å; L87-T91 WeakPolarHBondContact O-CB 3.38Å; L87-T91 PolarHBondContact O-N 3.36Å; L87-T91 PolarHBondContact O-OG1 2.96Å
88	Q	69.7	Low	65.5	Low	114 Å²	114	86.7 Å²	86.7	53%	0.533	43%	0.429	S	S	.	.	H	α-helix	trans	-69.5	-42.6	177	-170.3	174	-15	0	0	111.3	S84 N85 T86 T91 E92	S84-Q88 WeakPolarHBondContact O-CB 3.31Å; S84-Q88 PolarHBondContact O-N 3.46Å; N85-Q88 PolarHBondContact O-N 3.42Å; T86-Q88 VanDerWaalsContact C-N 3.26Å; T86-Q88 PolarHBondContact O-N 3.3Å; Q88-T91 PolarHBondContact O-N 3.02Å; Q88-E92 VanDerWaalsContact O-CB 3.25Å; Q88-E92 WeakPolarHBondContact O-CB 3.45Å; Q88-E92 PolarHBondContact O-N 3.41Å
89	Q	72.3	Confident	64.5	Low	125 Å²	125	88.1 Å²	88.1	58%	0.584	43%	0.434	S	S	*	.	H	α-helix	trans	-65.8	-42.3	174.6	-77.2	-174.5	-10	0	0	112.8	N85 T86 E92 K93	N85-Q89 WeakPolarHBondContact O-CG 3.32Å; N85-Q89 PolarHBondContact O-N 3Å; T86-Q89 PolarHBondContact O-N 2.96Å; Q89-E92 PolarHBondContact O-N 3.03Å; Q89-K93 WeakPolarHBondContact O-CB 3.33Å; Q89-K93 WeakPolarHBondContact O-CG 3.43Å; Q89-K93 PolarHBondContact O-N 3.3Å
90	V	65.3	Low	63.8	Low	65 Å²	65	91.1 Å²	91.1	39%	0.394	45%	0.448	S	S	.	.	H	α-helix	trans	-62.8	-48.3	173.6	171.9	0	0	0	0	108.5	T86 E92 K93 T94	T86-V90 HydrophobicContact CG2-CG2 4.27Å; T86-V90 WeakPolarHBondContact O-CB 3.42Å; T86-V90 VanDerWaalsContact O-CG2 3.29Å; T86-V90 WeakPolarHBondContact O-CG2 3.46Å; T86-V90 PolarHBondContact O-N 3.36Å; V90-E92 PolarHBondContact O-N 3.17Å; V90-K93 PolarHBondContact O-N 2.99Å; V90-T94 WeakPolarHBondContact O-CA 3.49Å; V90-T94 WeakPolarHBondContact O-CB 3.23Å; V90-T94 PolarHBondContact O-N 2.89Å; V90-T94 PolarHBondContact O-OG1 3.35Å
91	T	61.5	Low	63.4	Low	18 Å²	18	90.4 Å²	90.4	11%	0.11	45%	0.449	C	S	.	.	H	α-helix	trans	-58.2	-46.6	176.6	-62.8	0	0	0	0	111.2	L87 Q88 T94 T95 V109	L87-T91 WeakPolarHBondContact O-CA 3.19Å; L87-T91 WeakPolarHBondContact O-CB 3.38Å; L87-T91 PolarHBondContact O-N 3.36Å; L87-T91 PolarHBondContact O-OG1 2.96Å; Q88-T91 PolarHBondContact O-N 3.02Å; T91-T94 CarbonylContact O-C 3.58Å; T91-T94 PolarHBondContact O-N 3Å; T91-T95 HydrophobicContact CG2-CG2 3.93Å; T91-T95 WeakPolarHBondContact O-CA 3.49Å; T91-T95 VanDerWaalsContact O-CB 3.31Å; T91-T95 WeakPolarHBondContact O-CB 3.36Å; T91-T95 VanDerWaalsContact O-CG2 3.28Å; T91-T95 WeakPolarHBondContact O-CG2 3.42Å; T91-T95 PolarHBondContact O-N 3.37Å; T91-T95 PolarHBondContact O-OG1 3.31Å; T91-V109 HydrophobicContact CG2-CG1 3.58Å
92	E	67.7	Low	62.8	Low	121 Å²	121	92.6 Å²	92.6	57%	0.565	46%	0.455	S	S	*	.	H	α-helix	trans	-64.4	-46.1	-176.6	-167.3	168.8	-165.5	0	0	111.2	Q88 Q89 V90 T95 Q96	Q88-E92 VanDerWaalsContact O-CB 3.25Å; Q88-E92 WeakPolarHBondContact O-CB 3.45Å; Q88-E92 PolarHBondContact O-N 3.41Å; Q89-E92 PolarHBondContact O-N 3.03Å; V90-E92 PolarHBondContact O-N 3.17Å; E92-T95 VanDerWaalsContact CA-OG1 3.3Å; E92-T95 WeakPolarHBondContact CA-OG1 3.48Å; E92-T95 PolarHBondContact O-N 3.18Å; E92-T95 PolarHBondContact O-OG1 2.9Å; E92-Q96 PolarHBondContact O-N 3.35Å
93	K	65.8	Low	62	Low	143 Å²	143	97 Å²	97	62%	0.622	47%	0.469	S	S	*	.	H	α-helix	trans	-63.2	-46.9	172.1	-73.6	-172.2	175.3	-171.8	0	111.5	Q89 V90 T95 Q96 F97	Q89-K93 WeakPolarHBondContact O-CB 3.33Å; Q89-K93 WeakPolarHBondContact O-CG 3.43Å; Q89-K93 PolarHBondContact O-N 3.3Å; V90-K93 PolarHBondContact O-N 2.99Å; K93-T95 VanDerWaalsContact C-N 3.31Å; K93-T95 PolarHBondContact O-N 2.93Å; K93-Q96 WeakPolarHBondContact O-CB 3.48Å; K93-Q96 PolarHBondContact O-N 3.43Å; K93-F97 WeakPolarHBondContact O-CD2 3.28Å; K93-F97 PolarHBondContact O-N 3.36Å
94	T	58.8	Low	61.4	Low	47 Å²	47	98.7 Å²	98.7	29%	0.288	48%	0.482	S	S	.	.	H	α-helix	trans	-64.8	-32.8	178.4	-64.6	0	0	0	0	111.3	V90 T91 F97 I98 L105	V90-T94 WeakPolarHBondContact O-CA 3.49Å; V90-T94 WeakPolarHBondContact O-CB 3.23Å; V90-T94 PolarHBondContact O-N 2.89Å; V90-T94 PolarHBondContact O-OG1 3.35Å; T91-T94 CarbonylContact O-C 3.58Å; T91-T94 PolarHBondContact O-N 3Å; T94-F97 CarbonylContact O-C 3.51Å; T94-F97 PolarHBondContact O-N 2.88Å; T94-I98 HydrophobicContact CG2-CD1 3.24Å; T94-I98 HydrophobicContact CG2-CG1 3.9Å; T94-I98 WeakPolarHBondContact O-CA 3.3Å; T94-I98 WeakPolarHBondContact O-CB 3.42Å; T94-I98 WeakPolarHBondContact O-CG1 3.31Å; T94-I98 PolarHBondContact O-N 3.49Å; T94-L105 HydrophobicContact CG2-CD2 4.2Å
95	T	58.6	Low	60.8	Low	61 Å²	61	99.6 Å²	99.6	37%	0.374	48%	0.484	S	S	.	.	H	α-helix	trans	-75.6	-30.1	174.6	48.2	0	0	0	0	112.2	T91 E92 K93 F97 I98 H99	T91-T95 HydrophobicContact CG2-CG2 3.93Å; T91-T95 WeakPolarHBondContact O-CA 3.49Å; T91-T95 VanDerWaalsContact O-CB 3.31Å; T91-T95 WeakPolarHBondContact O-CB 3.36Å; T91-T95 VanDerWaalsContact O-CG2 3.28Å; T91-T95 WeakPolarHBondContact O-CG2 3.42Å; T91-T95 PolarHBondContact O-N 3.37Å; T91-T95 PolarHBondContact O-OG1 3.31Å; E92-T95 VanDerWaalsContact CA-OG1 3.3Å; E92-T95 WeakPolarHBondContact CA-OG1 3.48Å; E92-T95 PolarHBondContact O-N 3.18Å; E92-T95 PolarHBondContact O-OG1 2.9Å; K93-T95 VanDerWaalsContact C-N 3.31Å; K93-T95 PolarHBondContact O-N 2.93Å; T95-F97 VanDerWaalsContact C-N 3.33Å; T95-I98 CarbonylContact O-C 3.52Å; T95-H99 WeakPolarHBondContact O-CB 3.48Å; T95-H99 PolarHBondContact O-N 2.9Å
96	Q	56.6	Low	60.1	Low	153 Å²	153	96.7 Å²	96.7	72%	0.715	48%	0.475	S	S	*	.	H	α-helix	trans	-64	-38.8	166.5	-89.5	-177.2	-28.8	0	0	111.4	E92 K93	E92-Q96 PolarHBondContact O-N 3.35Å; K93-Q96 WeakPolarHBondContact O-CB 3.48Å; K93-Q96 PolarHBondContact O-N 3.43Å
97	F	54.4	Low	59.6	Low	178 Å²	178	101 Å²	101	78%	0.781	50%	0.497	S	S	*	.	H	α-helix	trans	-80.7	-25.4	175.9	-80.1	-74.5	0	0	0	114.3	K93 T94 T95	K93-F97 WeakPolarHBondContact O-CD2 3.28Å; K93-F97 PolarHBondContact O-N 3.36Å; T94-F97 CarbonylContact O-C 3.51Å; T94-F97 PolarHBondContact O-N 2.88Å; T95-F97 VanDerWaalsContact C-N 3.33Å
98	I	54.9	Low	59.2	Low	58 Å²	58	99.1 Å²	99.1	30%	0.297	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	27.8	-177	-56.3	-178.8	0	0	0	109.8	T94 T95 E100 N102 L105	T94-I98 HydrophobicContact CG2-CD1 3.24Å; T94-I98 HydrophobicContact CG2-CG1 3.9Å; T94-I98 WeakPolarHBondContact O-CA 3.3Å; T94-I98 WeakPolarHBondContact O-CB 3.42Å; T94-I98 WeakPolarHBondContact O-CG1 3.31Å; T94-I98 PolarHBondContact O-N 3.49Å; T95-I98 CarbonylContact O-C 3.52Å; I98-E100 PolarHBondContact O-N 3.3Å; I98-E100 VanDerWaalsContact O-N 3.15Å; I98-N102 HydrophobicContact CG2-CB 4.09Å; I98-L105 HydrophobicContact CD1-CD2 3.49Å; I98-L105 VanDerWaalsContact CD1-CD2 3.49Å
99	H	49.2	Very low	58.9	Low	162 Å²	162	95 Å²	95	75%	0.75	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-3.2	173.4	-132.3	-44.5	0	0	0	113.2	T95	T95-H99 WeakPolarHBondContact O-CB 3.48Å; T95-H99 PolarHBondContact O-N 2.9Å
100	E	55.7	Low	58.3	Low	161 Å²	161	93.2 Å²	93.2	75%	0.752	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.5	-30	-177.7	-145.3	95.4	-147.6	0	0	115.2	I98	I98-E100 PolarHBondContact O-N 3.3Å; I98-E100 VanDerWaalsContact O-N 3.15Å
101	E	55.6	Low	57.8	Low	112 Å²	112	95.3 Å²	95.3	52%	0.523	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.2	-16.8	-154.6	-122.9	-163.6	145.3	0	0	121.5	K426	E101-K426 IonicContact OE1-NZ 2.79Å; E101-K426 PolarHBondContact OE1-NZ 2.96Å
102	N	57.7	Low	57.7	Low	89 Å²	89	98 Å²	98	48%	0.476	49%	0.487	S	S	.	.			trans	-146.9	89.1	-179.7	-106.7	-10.1	0	0	0	114.2	I98 T104 L105 A106	I98-N102 HydrophobicContact CG2-CB 4.09Å; N102-T104 PolarHBondContact O-N 3.39Å; N102-L105 HydrophobicContact CB-CB 4.32Å; N102-L105 PolarHBondContact O-N 2.85Å; N102-A106 PolarHBondContact O-N 3.43Å
103	R	54.9	Low	57.3	Low	163 Å²	163	97.3 Å²	97.3	62%	0.615	48%	0.482	S	S	*	.	H	α-helix	trans	-57	-30.8	169.7	-94.8	-170.7	-179.3	137.3	8.3	113.1	L105 A106 D107	R103-L105 VanDerWaalsContact C-N 3.3Å; R103-L105 PolarHBondContact O-N 2.86Å; R103-A106 PolarHBondContact O-N 3.44Å; R103-D107 WeakPolarHBondContact O-CB 3.35Å; R103-D107 VanDerWaalsContact O-CG 3.26Å; R103-D107 PolarHBondContact O-N 3.33Å
104	T	56.4	Low	56.9	Low	84 Å²	84	95.4 Å²	95.4	52%	0.515	48%	0.482	S	S	.	.	H	α-helix	trans	-61.3	-40.2	178.1	48.1	0	0	0	0	111.6	N102 D107 T108	N102-T104 PolarHBondContact O-N 3.39Å; T104-D107 PolarHBondContact O-N 3.2Å; T104-T108 WeakPolarHBondContact O-CB 3.3Å; T104-T108 PolarHBondContact O-N 2.81Å; T104-T108 PolarHBondContact O-OG1 3.39Å
105	L	56.3	Low	57.1	Low	48 Å²	48	95.7 Å²	95.7	25%	0.251	49%	0.485	S	S	.	.	H	α-helix	trans	-71	-39.1	178.5	-166.6	73.3	0	0	0	111.6	T94 I98 N102 R103 T108 V109 L181	T94-L105 HydrophobicContact CG2-CD2 4.2Å; I98-L105 HydrophobicContact CD1-CD2 3.49Å; I98-L105 VanDerWaalsContact CD1-CD2 3.49Å; N102-L105 HydrophobicContact CB-CB 4.32Å; N102-L105 PolarHBondContact O-N 2.85Å; R103-L105 VanDerWaalsContact C-N 3.3Å; R103-L105 PolarHBondContact O-N 2.86Å; L105-T108 PolarHBondContact O-N 2.97Å; L105-V109 HydrophobicContact CG-CG2 4.44Å; L105-V109 WeakPolarHBondContact O-CB 3.43Å; L105-V109 WeakPolarHBondContact O-CG2 3.45Å; L105-V109 PolarHBondContact O-N 2.98Å; L105-L181 HydrophobicContact CD1-CD1 4.12Å
106	A	58.2	Low	57.2	Low	42 Å²	42	95 Å²	95	35%	0.347	48%	0.478	S	S	.	.	H	α-helix	trans	-62.1	-44.3	175	0	0	0	0	0	111.6	N102 R103 V109 D110	N102-A106 PolarHBondContact O-N 3.43Å; R103-A106 PolarHBondContact O-N 3.44Å; A106-V109 PolarHBondContact O-N 2.85Å; A106-D110 PolarHBondContact O-N 3.48Å
107	D	57.2	Low	57.5	Low	108 Å²	108	91.8 Å²	91.8	58%	0.578	47%	0.471	S	S	*	.	H	α-helix	trans	-64.7	-41	176.5	-67.2	-21.3	0	0	0	111.4	R103 T104 V109 D110 L111	R103-D107 WeakPolarHBondContact O-CB 3.35Å; R103-D107 VanDerWaalsContact O-CG 3.26Å; R103-D107 PolarHBondContact O-N 3.33Å; T104-D107 PolarHBondContact O-N 3.2Å; D107-V109 VanDerWaalsContact C-N 3.35Å; D107-D110 PolarHBondContact O-N 3.48Å; D107-L111 WeakPolarHBondContact O-CB 3.18Å; D107-L111 PolarHBondContact O-N 3.4Å
108	T	57.1	Low	58.1	Low	29 Å²	29	88.7 Å²	88.7	18%	0.178	46%	0.462	C	S	.	.	H	α-helix	trans	-64.6	-39.2	174.7	-53.3	0	0	0	0	111.5	T104 L105 L111 I112 E177	T104-T108 WeakPolarHBondContact O-CB 3.3Å; T104-T108 PolarHBondContact O-N 2.81Å; T104-T108 PolarHBondContact O-OG1 3.39Å; L105-T108 PolarHBondContact O-N 2.97Å; T108-L111 WeakPolarHBondContact O-CB 3.34Å; T108-L111 PolarHBondContact O-N 3.27Å; T108-I112 HydrophobicContact CG2-CD1 4.47Å; T108-I112 WeakPolarHBondContact O-CG1 3.46Å; T108-I112 PolarHBondContact O-N 2.92Å; T108-I112 VanDerWaalsContact O-N 3.13Å; T108-E177 HydrophobicContact CG2-CB 4.4Å; T108-E177 HydrophobicContact CG2-CG 3.98Å
109	V	62	Low	58.6	Low	28 Å²	28	89.2 Å²	89.2	17%	0.17	47%	0.465	C	S	.	.	H	α-helix	trans	-69	-39.5	178.2	169.4	0	0	0	0	111.7	T91 L105 A106 D107 L111 I112 K113	T91-V109 HydrophobicContact CG2-CG1 3.58Å; L105-V109 HydrophobicContact CG-CG2 4.44Å; L105-V109 WeakPolarHBondContact O-CB 3.43Å; L105-V109 WeakPolarHBondContact O-CG2 3.45Å; L105-V109 PolarHBondContact O-N 2.98Å; A106-V109 PolarHBondContact O-N 2.85Å; D107-V109 VanDerWaalsContact C-N 3.35Å; V109-L111 VanDerWaalsContact C-N 3.3Å; V109-L111 PolarHBondContact O-N 2.96Å; V109-I112 WeakPolarHBondContact O-CB 3.39Å; V109-I112 PolarHBondContact O-N 3.34Å; V109-I112 VanDerWaalsContact O-N 3.13Å; V109-K113 PolarHBondContact O-N 3Å
110	D	59.7	Low	59.5	Low	87 Å²	87	85.2 Å²	85.2	47%	0.465	45%	0.448	S	S	.	.	H	α-helix	trans	-69.1	-29.4	174.9	-78.4	-16	0	0	0	112.3	A106 D107 I112 K113	A106-D110 PolarHBondContact O-N 3.48Å; D107-D110 PolarHBondContact O-N 3.48Å; D110-I112 VanDerWaalsContact C-N 3.3Å; D110-I112 PolarHBondContact O-N 3.38Å; D110-K113 PolarHBondContact O-N 3.48Å; D110-K113 IonicContact OD1-NZ 2.82Å; D110-K113 PolarHBondContact OD1-NZ 2.89Å
111	L	56.3	Low	60.3	Low	109 Å²	109	80.2 Å²	80.2	57%	0.571	43%	0.431	S	S	*	.	H	α-helix	trans	-66.5	-30.8	170.1	-156.5	75.9	0	0	0	112.3	D107 T108 V109 T114 P115	D107-L111 WeakPolarHBondContact O-CB 3.18Å; D107-L111 PolarHBondContact O-N 3.4Å; T108-L111 WeakPolarHBondContact O-CB 3.34Å; T108-L111 PolarHBondContact O-N 3.27Å; V109-L111 VanDerWaalsContact C-N 3.3Å; V109-L111 PolarHBondContact O-N 2.96Å; L111-T114 PolarHBondContact O-OG1 2.89Å; L111-P115 WeakPolarHBondContact O-CD 3.42Å
112	I	57.5	Low	60.9	Low	75 Å²	75	77.6 Å²	77.6	39%	0.385	42%	0.421	S	S	.	.	H	α-helix	trans	-74.1	-30.4	175.4	-67.5	164.6	0	0	0	111.7	T108 V109 D110 P115	T108-I112 HydrophobicContact CG2-CD1 4.47Å; T108-I112 WeakPolarHBondContact O-CG1 3.46Å; T108-I112 PolarHBondContact O-N 2.92Å; T108-I112 VanDerWaalsContact O-N 3.13Å; V109-I112 WeakPolarHBondContact O-CB 3.39Å; V109-I112 PolarHBondContact O-N 3.34Å; V109-I112 VanDerWaalsContact O-N 3.13Å; D110-I112 VanDerWaalsContact C-N 3.3Å; D110-I112 PolarHBondContact O-N 3.38Å; I112-P115 WeakPolarHBondContact O-CD 3.27Å
113	K	60.4	Low	61.7	Low	106 Å²	106	75.1 Å²	75.1	46%	0.461	42%	0.416	S	S	.	.	H	α-helix	trans	-72.3	-32.8	-177.2	-72.8	176.4	-169.4	156.6	0	114.3	V109 D110 P117	V109-K113 PolarHBondContact O-N 3Å; D110-K113 PolarHBondContact O-N 3.48Å; D110-K113 IonicContact OD1-NZ 2.82Å; D110-K113 PolarHBondContact OD1-NZ 2.89Å; K113-P117 WeakPolarHBondContact O-CD 3.38Å
114	T	57.8	Low	62.5	Low	104 Å²	104	75.6 Å²	75.6	64%	0.638	42%	0.419	S	S	*	.	S	Bend	trans	-68.7	-37.8	-170	34.3	0	0	0	0	116.2	L111 L116	L111-T114 PolarHBondContact O-OG1 2.89Å; T114-L116 VanDerWaalsContact C-N 3.33Å; T114-L116 PolarHBondContact O-N 3.49Å
115	P	62	Low	63.3	Low	53 Å²	53	75.9 Å²	75.9	34%	0.344	42%	0.416	S	S	.	.	S	Bend	trans	-76.3	-17.9	178.8	26.6	-33.1	0	0	0	113.9	L111 I112 L118 L119	L111-P115 WeakPolarHBondContact O-CD 3.42Å; I112-P115 WeakPolarHBondContact O-CD 3.27Å; P115-L118 WeakPolarHBondContact O-CB 3.45Å; P115-L118 PolarHBondContact O-N 3.25Å; P115-L119 WeakPolarHBondContact O-CG 3.39Å; P115-L119 PolarHBondContact O-N 3.08Å
116	L	60.5	Low	64.2	Low	45 Å²	45	77 Å²	77	24%	0.236	42%	0.422	C	S	.	.	H	α-helix	trans	-66.2	-47.5	-167.1	-172.5	76.7	0	0	0	114.8	S84 T114 L118 L119 I120	S84-L116 WeakPolarHBondContact OG-CD2 3.17Å; T114-L116 VanDerWaalsContact C-N 3.33Å; T114-L116 PolarHBondContact O-N 3.49Å; L116-L118 PolarHBondContact O-N 3.49Å; L116-L119 PolarHBondContact O-N 2.95Å; L116-I120 HydrophobicContact CG-CD1 4.37Å; L116-I120 WeakPolarHBondContact O-CG1 3.17Å; L116-I120 PolarHBondContact O-N 3.37Å
117	P	63.8	Low	65	Low	86 Å²	86	76.5 Å²	76.5	56%	0.558	42%	0.416	S	S	*	.	H	α-helix	trans	-63.9	-31.5	176.5	-19.5	32.9	0	0	0	111.9	K113 I120 S121	K113-P117 WeakPolarHBondContact O-CD 3.38Å; P117-I120 PolarHBondContact O-N 2.91Å; P117-S121 WeakPolarHBondContact O-CB 3.46Å; P117-S121 PolarHBondContact O-N 3.2Å; P117-S121 PolarHBondContact O-OG 3.32Å
118	L	66.4	Low	65.8	Low	113 Å²	113	74.1 Å²	74.1	59%	0.592	41%	0.405	S	S	*	.	H	α-helix	trans	-67.2	-44.2	179.1	-149.6	115.1	0	0	0	110.6	P115 L116 S121 L122	P115-L118 WeakPolarHBondContact O-CB 3.45Å; P115-L118 PolarHBondContact O-N 3.25Å; L116-L118 PolarHBondContact O-N 3.49Å; L118-S121 WeakPolarHBondContact CA-OG 3.46Å; L118-S121 PolarHBondContact O-N 3.38Å; L118-S121 PolarHBondContact O-OG 3.5Å; L118-L122 HydrophobicContact CD2-CD1 3.78Å; L118-L122 HydrophobicContact CG-CD1 4.37Å; L118-L122 WeakPolarHBondContact O-CB 3.45Å; L118-L122 PolarHBondContact O-N 2.89Å
119	L	65.3	Low	66.6	Low	69 Å²	69	76 Å²	76	36%	0.361	42%	0.417	S	S	.	.	H	α-helix	trans	-60.3	-45.7	175.6	-67.1	171.2	0	0	0	112.1	P115 L116 L122 G123 F163	P115-L119 WeakPolarHBondContact O-CG 3.39Å; P115-L119 PolarHBondContact O-N 3.08Å; L116-L119 PolarHBondContact O-N 2.95Å; L119-L122 PolarHBondContact O-N 2.87Å; L119-G123 PolarHBondContact O-N 3.44Å; L119-F163 HydrophobicContact CD2-CE1 4.16Å; L119-F163 HydrophobicContact CD2-CE2 3.37Å; L119-F163 HydrophobicContact CD2-CZ 3.12Å
120	I	68.9	Low	67.2	Low	78 Å²	78	76.5 Å²	76.5	40%	0.4	42%	0.421	S	S	.	.	H	α-helix	trans	-64.8	-44.9	179.5	-64.5	170.3	0	0	0	110.4	L116 P117 L122 G123 Y124	L116-I120 HydrophobicContact CG-CD1 4.37Å; L116-I120 WeakPolarHBondContact O-CG1 3.17Å; L116-I120 PolarHBondContact O-N 3.37Å; P117-I120 PolarHBondContact O-N 2.91Å; I120-L122 PolarHBondContact O-N 3.03Å; I120-G123 PolarHBondContact O-N 3.31Å; I120-Y124 PolarHBondContact O-N 3.25Å
121	S	71.5	Confident	67.9	Low	56 Å²	56	77.4 Å²	77.4	39%	0.392	43%	0.425	S	S	.	.	H	α-helix	trans	-63.4	-41.2	179.2	68.6	0	0	0	0	112.5	P117 L118 Y124 I125	P117-S121 WeakPolarHBondContact O-CB 3.46Å; P117-S121 PolarHBondContact O-N 3.2Å; P117-S121 PolarHBondContact O-OG 3.32Å; L118-S121 WeakPolarHBondContact CA-OG 3.46Å; L118-S121 PolarHBondContact O-N 3.38Å; L118-S121 PolarHBondContact O-OG 3.5Å; S121-Y124 PolarHBondContact O-N 2.9Å; S121-I125 WeakPolarHBondContact O-CD1 3.45Å; S121-I125 VanDerWaalsContact O-CG1 3.26Å; S121-I125 WeakPolarHBondContact O-CG1 3.03Å; S121-I125 PolarHBondContact O-N 3.45Å
122	L	69.3	Low	68.9	Low	58 Å²	58	77.4 Å²	77.4	30%	0.304	43%	0.425	S	S	.	.	H	α-helix	trans	-65.8	-41.4	175.9	-84.6	158	0	0	0	112.3	L118 L119 I120 Y124 I125 L126 F163	L118-L122 HydrophobicContact CD2-CD1 3.78Å; L118-L122 HydrophobicContact CG-CD1 4.37Å; L118-L122 WeakPolarHBondContact O-CB 3.45Å; L118-L122 PolarHBondContact O-N 2.89Å; L119-L122 PolarHBondContact O-N 2.87Å; I120-L122 PolarHBondContact O-N 3.03Å; L122-Y124 VanDerWaalsContact C-N 3.34Å; L122-Y124 PolarHBondContact O-N 2.93Å; L122-I125 PolarHBondContact O-N 3.2Å; L122-L126 WeakPolarHBondContact O-CB 3.34Å; L122-L126 PolarHBondContact O-N 3.33Å; L122-F163 HydrophobicContact CD1-CD2 4.28Å; L122-F163 HydrophobicContact CD1-CE2 3.95Å
123	G	73.6	Confident	69.7	Low	36 Å²	36	74.7 Å²	74.7	37%	0.371	42%	0.415	S	S	.	.	H	α-helix	trans	-59.4	-44.4	174.4	0	0	0	0	0	112.1	L119 I120 L126 S127	L119-G123 PolarHBondContact O-N 3.44Å; I120-G123 PolarHBondContact O-N 3.31Å; G123-L126 PolarHBondContact O-N 3.46Å; G123-S127 PolarHBondContact O-N 2.94Å; G123-S127 PolarHBondContact O-OG 3.04Å
124	Y	72.6	Confident	70.3	Confident	174 Å²	174	72.3 Å²	72.3	68%	0.682	41%	0.407	S	S	*	.	H	α-helix	trans	-62.7	-45.3	176.9	-170	-95.1	0	0	0	112.3	I120 S121 L122 L126 S127 V128	I120-Y124 PolarHBondContact O-N 3.25Å; S121-Y124 PolarHBondContact O-N 2.9Å; L122-Y124 VanDerWaalsContact C-N 3.34Å; L122-Y124 PolarHBondContact O-N 2.93Å; Y124-L126 VanDerWaalsContact C-N 3.3Å; Y124-L126 PolarHBondContact O-N 3.5Å; Y124-S127 PolarHBondContact O-N 3.3Å; Y124-V128 HydrophobicContact CD1-CG2 4.14Å; Y124-V128 HydrophobicContact CE1-CG2 3.83Å; Y124-V128 WeakPolarHBondContact O-CG2 3.42Å; Y124-V128 PolarHBondContact O-N 3.02Å
125	I	72.8	Confident	71.1	Confident	89 Å²	89	76 Å²	76	46%	0.456	41%	0.41	S	S	.	.	H	α-helix	trans	-59.1	-44	176.3	-68.1	164	0	0	0	110.4	S121 L122 V128 V129	S121-I125 WeakPolarHBondContact O-CD1 3.45Å; S121-I125 VanDerWaalsContact O-CG1 3.26Å; S121-I125 WeakPolarHBondContact O-CG1 3.03Å; S121-I125 PolarHBondContact O-N 3.45Å; L122-I125 PolarHBondContact O-N 3.2Å; I125-V128 PolarHBondContact O-N 3.47Å; I125-V129 WeakPolarHBondContact O-CG2 3.04Å; I125-V129 PolarHBondContact O-N 3.42Å
126	L	75.8	Confident	71.5	Confident	71 Å²	71	73.8 Å²	73.8	37%	0.372	40%	0.396	S	S	.	.	H	α-helix	trans	-62.4	-45.6	178.8	-160.2	80.6	0	0	0	111.9	L122 G123 Y124 V128 V129 C130 F155	L122-L126 WeakPolarHBondContact O-CB 3.34Å; L122-L126 PolarHBondContact O-N 3.33Å; G123-L126 PolarHBondContact O-N 3.46Å; Y124-L126 VanDerWaalsContact C-N 3.3Å; Y124-L126 PolarHBondContact O-N 3.5Å; L126-V128 VanDerWaalsContact C-N 3.34Å; L126-V128 PolarHBondContact O-N 3.33Å; L126-V129 PolarHBondContact O-N 3.1Å; L126-C130 WeakPolarHBondContact O-CB 3.49Å; L126-C130 PolarHBondContact O-N 2.94Å; L126-C130 PolarHBondContact O-SG 2.85Å; L126-C130 VanDerWaalsContact O-SG 3.36Å; L126-F155 HydrophobicContact CD1-CD1 3.86Å; L126-F155 HydrophobicContact CD1-CE1 3.18Å; L126-F155 HydrophobicContact CD1-CZ 3.9Å
127	S	73.8	Confident	71.9	Confident	32 Å²	32	75.9 Å²	75.9	22%	0.224	41%	0.407	C	S	.	.	H	α-helix	trans	-61.3	-41.5	177.8	-63.1	0	0	0	0	112.2	G123 Y124 C130 L131	G123-S127 PolarHBondContact O-N 2.94Å; G123-S127 PolarHBondContact O-OG 3.04Å; Y124-S127 PolarHBondContact O-N 3.3Å; S127-C130 PolarHBondContact O-N 3.43Å; S127-L131 WeakPolarHBondContact O-CG 3.43Å; S127-L131 PolarHBondContact O-N 3.36Å
128	V	73.9	Confident	72.4	Confident	58 Å²	58	75.6 Å²	75.6	35%	0.352	41%	0.412	S	S	.	.	H	α-helix	trans	-63.9	-45.3	176.6	172.5	0	0	0	0	111.1	Y124 I125 L126 C130 L131 L132	Y124-V128 HydrophobicContact CD1-CG2 4.14Å; Y124-V128 HydrophobicContact CE1-CG2 3.83Å; Y124-V128 WeakPolarHBondContact O-CG2 3.42Å; Y124-V128 PolarHBondContact O-N 3.02Å; I125-V128 PolarHBondContact O-N 3.47Å; L126-V128 VanDerWaalsContact C-N 3.34Å; L126-V128 PolarHBondContact O-N 3.33Å; V128-C130 VanDerWaalsContact C-N 3.32Å; V128-C130 PolarHBondContact O-N 3.28Å; V128-L131 PolarHBondContact O-N 3.1Å; V128-L132 HydrophobicContact CG1-CD1 3.99Å; V128-L132 HydrophobicContact CG1-CG 4.42Å; V128-L132 VanDerWaalsContact O-CG 3.31Å; V128-L132 WeakPolarHBondContact O-CG 3.13Å; V128-L132 PolarHBondContact O-N 3.42Å
129	V	74.8	Confident	72.9	Confident	70 Å²	70	74.3 Å²	74.3	42%	0.424	41%	0.408	S	S	.	.	H	α-helix	trans	-61.3	-41.4	177.1	172.2	0	0	0	0	111.3	I125 L126 L132 G133	I125-V129 WeakPolarHBondContact O-CG2 3.04Å; I125-V129 PolarHBondContact O-N 3.42Å; L126-V129 PolarHBondContact O-N 3.1Å; V129-L132 PolarHBondContact O-N 2.84Å; V129-G133 PolarHBondContact O-N 3.44Å
130	C	75.2	Confident	72.9	Confident	37 Å²	37	73.8 Å²	73.8	25%	0.25	41%	0.408	C	S	.	.	H	α-helix	trans	-62.8	-45.8	175.6	-74.6	0	0	0	0	112.4	L66 L126 S127 V128 L132 G133 I134	L66-C130 HydrophobicContact CD2-CB 4.31Å; L126-C130 WeakPolarHBondContact O-CB 3.49Å; L126-C130 PolarHBondContact O-N 2.94Å; L126-C130 PolarHBondContact O-SG 2.85Å; L126-C130 VanDerWaalsContact O-SG 3.36Å; S127-C130 PolarHBondContact O-N 3.43Å; V128-C130 VanDerWaalsContact C-N 3.32Å; V128-C130 PolarHBondContact O-N 3.28Å; C130-L132 PolarHBondContact O-N 3.44Å; C130-G133 PolarHBondContact O-N 2.75Å; C130-I134 WeakPolarHBondContact O-CG1 3.38Å; C130-I134 PolarHBondContact O-N 2.74Å
131	L	74.8	Confident	73	Confident	107 Å²	107	77.7 Å²	77.7	56%	0.56	43%	0.425	S	S	*	.	H	α-helix	trans	-63.7	-41	178.7	-72.8	171.5	0	0	0	112	S127 V128 G133 I134 W135	S127-L131 WeakPolarHBondContact O-CG 3.43Å; S127-L131 PolarHBondContact O-N 3.36Å; V128-L131 PolarHBondContact O-N 3.1Å; L131-G133 VanDerWaalsContact C-N 3.31Å; L131-G133 PolarHBondContact O-N 3.31Å; L131-I134 HydrophobicContact CD2-CD1 4.38Å; L131-I134 PolarHBondContact O-N 3.26Å; L131-W135 WeakPolarHBondContact O-CB 3.09Å; L131-W135 PolarHBondContact O-N 3.14Å
132	L	77.2	Confident	72.9	Confident	109 Å²	109	81 Å²	81	57%	0.571	44%	0.442	S	S	*	.	H	α-helix	trans	-63.6	-37.6	173.7	-69.4	173.4	0	0	0	111.8	V128 V129 C130 W135 G136	V128-L132 HydrophobicContact CG1-CD1 3.99Å; V128-L132 HydrophobicContact CG1-CG 4.42Å; V128-L132 VanDerWaalsContact O-CG 3.31Å; V128-L132 WeakPolarHBondContact O-CG 3.13Å; V128-L132 PolarHBondContact O-N 3.42Å; V129-L132 PolarHBondContact O-N 2.84Å; C130-L132 PolarHBondContact O-N 3.44Å; L132-W135 PolarHBondContact O-N 3.38Å; L132-G136 PolarHBondContact O-N 3.03Å
133	G	72.8	Confident	72.9	Confident	17 Å²	17	87.9 Å²	87.9	18%	0.175	47%	0.465	C	S	.	.	H	α-helix	trans	-63.3	-46.7	174	0	0	0	0	0	113.1	V129 C130 L131 G136 I137	V129-G133 PolarHBondContact O-N 3.44Å; C130-G133 PolarHBondContact O-N 2.75Å; L131-G133 VanDerWaalsContact C-N 3.31Å; L131-G133 PolarHBondContact O-N 3.31Å; G133-G136 PolarHBondContact O-N 3.47Å; G133-I137 VanDerWaalsContact O-CG1 3.3Å; G133-I137 WeakPolarHBondContact O-CG1 3.49Å; G133-I137 PolarHBondContact O-N 3.43Å
134	I	72.8	Confident	72.7	Confident	57 Å²	57	88.4 Å²	88.4	29%	0.292	46%	0.462	S	S	.	.	H	α-helix	trans	-61.6	-45.7	175.5	-61.7	163.8	0	0	0	110.5	L66 C130 L131 G136 I137 A138	L66-I134 HydrophobicContact CD2-CD1 3.13Å; L66-I134 HydrophobicContact CD2-CG1 3.51Å; C130-I134 WeakPolarHBondContact O-CG1 3.38Å; C130-I134 PolarHBondContact O-N 2.74Å; L131-I134 HydrophobicContact CD2-CD1 4.38Å; L131-I134 PolarHBondContact O-N 3.26Å; I134-G136 VanDerWaalsContact C-N 3.3Å; I134-G136 PolarHBondContact O-N 2.91Å; I134-I137 PolarHBondContact O-N 3.28Å; I134-I137 VanDerWaalsContact O-N 3.16Å; I134-A138 WeakPolarHBondContact O-CB 3.48Å; I134-A138 PolarHBondContact O-N 3.4Å
135	W	74.9	Confident	72.6	Confident	181 Å²	181	82.8 Å²	82.8	69%	0.686	45%	0.446	S	S	*	.	H	α-helix	trans	-60.4	-42.5	178.8	-172.2	-88.6	0	0	0	111.3	L131 L132 A138 T139	L131-W135 WeakPolarHBondContact O-CB 3.09Å; L131-W135 PolarHBondContact O-N 3.14Å; L132-W135 PolarHBondContact O-N 3.38Å; W135-A138 PolarHBondContact O-N 3.31Å; W135-T139 HydrophobicContact CD2-CG2 4.49Å; W135-T139 HydrophobicContact CZ2-CG2 4.44Å; W135-T139 WeakPolarHBondContact O-CB 3.48Å; W135-T139 WeakPolarHBondContact O-CG2 3.25Å; W135-T139 PolarHBondContact O-N 2.86Å; W135-T139 PolarHBondContact O-OG1 3.29Å
136	G	71.9	Confident	72.7	Confident	6 Å²	6	86.2 Å²	86.2	6%	0.062	46%	0.457	C	S	.	.	H	α-helix	trans	-61.7	-40.7	174.1	0	0	0	0	0	113	L132 G133 I134 A138 T139 V140	L132-G136 PolarHBondContact O-N 3.03Å; G133-G136 PolarHBondContact O-N 3.47Å; I134-G136 VanDerWaalsContact C-N 3.3Å; I134-G136 PolarHBondContact O-N 2.91Å; G136-A138 VanDerWaalsContact C-N 3.35Å; G136-T139 PolarHBondContact O-N 2.91Å; G136-V140 VanDerWaalsContact O-CB 3.25Å; G136-V140 WeakPolarHBondContact O-CB 3.22Å; G136-V140 WeakPolarHBondContact O-CG2 3.33Å; G136-V140 PolarHBondContact O-N 2.94Å
137	I	68.3	Low	72.8	Confident	90 Å²	90	91.7 Å²	91.7	46%	0.462	47%	0.474	S	S	.	.	H	α-helix	trans	-66	-38.3	175.7	-67.9	163.8	0	0	0	111.4	G133 I134	G133-I137 VanDerWaalsContact O-CG1 3.3Å; G133-I137 WeakPolarHBondContact O-CG1 3.49Å; G133-I137 PolarHBondContact O-N 3.43Å; I134-I137 PolarHBondContact O-N 3.28Å; I134-I137 VanDerWaalsContact O-N 3.16Å
138	A	73.9	Confident	72.8	Confident	80 Å²	80	95.1 Å²	95.1	66%	0.661	48%	0.483	S	S	*	.	H	α-helix	trans	-72.1	-31.3	-179.2	0	0	0	0	0	113	I134 W135 G136	I134-A138 WeakPolarHBondContact O-CB 3.48Å; I134-A138 PolarHBondContact O-N 3.4Å; W135-A138 PolarHBondContact O-N 3.31Å; G136-A138 VanDerWaalsContact C-N 3.35Å
139	T	76.3	Confident	72.8	Confident	85 Å²	85	94.3 Å²	94.3	52%	0.521	48%	0.483	S	S	.	.	H	α-helix	trans	-109.2	-18.1	-168.5	57.1	0	0	0	0	114.9	W135 G136	W135-T139 HydrophobicContact CD2-CG2 4.49Å; W135-T139 HydrophobicContact CZ2-CG2 4.44Å; W135-T139 WeakPolarHBondContact O-CB 3.48Å; W135-T139 WeakPolarHBondContact O-CG2 3.25Å; W135-T139 PolarHBondContact O-N 2.86Å; W135-T139 PolarHBondContact O-OG1 3.29Å; G136-T139 PolarHBondContact O-N 2.91Å
140	V	65.3	Low	73.1	Confident	59 Å²	59	95.5 Å²	95.5	36%	0.358	49%	0.49	S	S	.	.	S	Bend	trans	-117.9	141.3	-164.9	-167.8	0	0	0	0	113	G136 C144	G136-V140 VanDerWaalsContact O-CB 3.25Å; G136-V140 WeakPolarHBondContact O-CB 3.22Å; G136-V140 WeakPolarHBondContact O-CG2 3.33Å; G136-V140 PolarHBondContact O-N 2.94Å; V140-C144 HydrophobicContact CB-CB 4.18Å; V140-C144 HydrophobicContact CG1-CB 3.52Å; V140-C144 WeakPolarHBondContact CG1-SG 3.4Å
141	Q	72.6	Confident	73.2	Confident	159 Å²	159	99.3 Å²	99.3	74%	0.743	51%	0.507	S	S	*	.			trans	-40.1	142.7	172.6	-81.6	178.5	-15.8	0	0	112.6	R143 C144	Q141-R143 PolarHBondContact O-N 2.89Å; Q141-C144 PolarHBondContact O-N 2.85Å
142	T	68.2	Low	73.2	Confident	125 Å²	125	97 Å²	97	77%	0.767	50%	0.5	S	S	*	.	H	α-helix	trans	-46.9	-17.8	-179.2	41.8	0	0	0	0	116
143	R	68.6	Low	73.2	Confident	204 Å²	204	96.2 Å²	96.2	77%	0.77	50%	0.495	S	S	*	.	H	α-helix	trans	-70.5	-38.1	173.3	-78	-174	-171.8	172.9	3.8	113.9	Q141 V145 K146	Q141-R143 PolarHBondContact O-N 2.89Å; R143-V145 VanDerWaalsContact C-N 3.3Å; R143-V145 PolarHBondContact O-N 3.37Å; R143-K146 PolarHBondContact O-N 2.77Å
144	C	71	Confident	73.5	Confident	47 Å²	47	99.3 Å²	99.3	32%	0.318	51%	0.511	S	S	.	.	H	α-helix	trans	-72.7	-26.6	-177.6	-68.8	0	0	0	0	112.5	V140 Q141 K146 Y147 Y148	V140-C144 HydrophobicContact CB-CB 4.18Å; V140-C144 HydrophobicContact CG1-CB 3.52Å; V140-C144 WeakPolarHBondContact CG1-SG 3.4Å; Q141-C144 PolarHBondContact O-N 2.85Å; C144-K146 PolarHBondContact O-N 3.34Å; C144-Y147 PolarHBondContact O-N 3.28Å; C144-Y147 VanDerWaalsContact O-N 3.08Å; C144-Y148 HydrophobicContact CB-CD2 4.3Å; C144-Y148 HydrophobicContact CB-CE2 4.16Å; C144-Y148 VanDerWaalsContact O-CD2 3.24Å; C144-Y148 WeakPolarHBondContact O-CD2 3.21Å; C144-Y148 PolarHBondContact O-N 2.82Å; C144-Y148 VanDerWaalsContact O-N 3.12Å
145	V	69.1	Low	73.7	Confident	55 Å²	55	100.1 Å²	100.1	33%	0.333	51%	0.512	S	S	.	.	H	α-helix	trans	-55.9	-36.1	177.3	-179.1	0	0	0	0	111.7	R143 A149	R143-V145 VanDerWaalsContact C-N 3.3Å; R143-V145 PolarHBondContact O-N 3.37Å; V145-A149 VanDerWaalsContact O-CB 3.3Å; V145-A149 WeakPolarHBondContact O-CB 3.34Å; V145-A149 PolarHBondContact O-N 2.75Å
146	K	75.5	Confident	73.7	Confident	161 Å²	161	96.6 Å²	96.6	70%	0.7	51%	0.506	S	S	*	.	H	α-helix	trans	-66.1	-41.4	177.7	-67.2	-171.9	178.8	-176.5	0	112.6	R143 C144 A149 V150	R143-K146 PolarHBondContact O-N 2.77Å; C144-K146 PolarHBondContact O-N 3.34Å; K146-A149 PolarHBondContact O-N 3.48Å; K146-V150 WeakPolarHBondContact O-CG2 3.45Å; K146-V150 PolarHBondContact O-N 2.8Å; K146-V150 VanDerWaalsContact O-N 3.08Å
147	Y	78.8	Confident	74	Confident	186 Å²	186	102 Å²	102	73%	0.729	53%	0.533	S	S	*	.	H	α-helix	trans	-69.3	-43.2	179.8	-76	-80.6	0	0	0	112	C144 A149 V150 L151	C144-Y147 PolarHBondContact O-N 3.28Å; C144-Y147 VanDerWaalsContact O-N 3.08Å; Y147-A149 VanDerWaalsContact C-N 3.33Å; Y147-A149 PolarHBondContact O-N 3.01Å; Y147-V150 PolarHBondContact O-N 2.79Å; Y147-L151 PolarHBondContact O-N 3.21Å
148	Y	72.4	Confident	74.6	Confident	104 Å²	104	100.7 Å²	100.7	41%	0.408	54%	0.535	S	S	.	.	H	α-helix	trans	-63.6	-39.1	175.3	-73.9	-67.5	0	0	0	112	C144 L151 S152	C144-Y148 HydrophobicContact CB-CD2 4.3Å; C144-Y148 HydrophobicContact CB-CE2 4.16Å; C144-Y148 VanDerWaalsContact O-CD2 3.24Å; C144-Y148 WeakPolarHBondContact O-CD2 3.21Å; C144-Y148 PolarHBondContact O-N 2.82Å; C144-Y148 VanDerWaalsContact O-N 3.12Å; Y148-L151 PolarHBondContact O-N 3.47Å; Y148-S152 WeakPolarHBondContact O-CB 3.47Å; Y148-S152 PolarHBondContact O-N 2.81Å; Y148-S152 PolarHBondContact O-OG 3.34Å
149	A	74	Confident	74.8	Confident	42 Å²	42	99.4 Å²	99.4	35%	0.347	52%	0.519	S	S	.	.	H	α-helix	trans	-61	-45.9	174.9	0	0	0	0	0	112.2	V145 K146 Y147 S152 I153	V145-A149 VanDerWaalsContact O-CB 3.3Å; V145-A149 WeakPolarHBondContact O-CB 3.34Å; V145-A149 PolarHBondContact O-N 2.75Å; K146-A149 PolarHBondContact O-N 3.48Å; Y147-A149 VanDerWaalsContact C-N 3.33Å; Y147-A149 PolarHBondContact O-N 3.01Å; A149-S152 WeakPolarHBondContact CA-OG 3.48Å; A149-S152 PolarHBondContact O-OG 2.82Å; A149-I153 WeakPolarHBondContact O-CB 3.48Å; A149-I153 WeakPolarHBondContact O-CD1 3.16Å; A149-I153 WeakPolarHBondContact O-CG1 3.36Å; A149-I153 PolarHBondContact O-N 2.78Å
150	V	81.1	Confident	74.6	Confident	94 Å²	94	97 Å²	97	57%	0.57	51%	0.508	S	S	*	.	H	α-helix	trans	-63.3	-46.2	176.8	174.5	0	0	0	0	111.3	K146 Y147 S152 I153 T154	K146-V150 WeakPolarHBondContact O-CG2 3.45Å; K146-V150 PolarHBondContact O-N 2.8Å; K146-V150 VanDerWaalsContact O-N 3.08Å; Y147-V150 PolarHBondContact O-N 2.79Å; V150-S152 PolarHBondContact O-N 3.47Å; V150-I153 PolarHBondContact O-N 2.79Å; V150-T154 PolarHBondContact O-N 3.06Å; V150-T154 PolarHBondContact O-OG1 3.47Å
151	L	78.7	Confident	75.2	Confident	117 Å²	117	97 Å²	97	61%	0.613	51%	0.509	S	S	*	.	H	α-helix	trans	-62.4	-44.7	-178.7	-163.6	87.9	0	0	0	112.3	Y147 Y148 T154 F155	Y147-L151 PolarHBondContact O-N 3.21Å; Y148-L151 PolarHBondContact O-N 3.47Å; L151-T154 PolarHBondContact O-N 3.44Å; L151-F155 WeakPolarHBondContact O-CB 3.46Å; L151-F155 PolarHBondContact O-N 3.41Å
152	S	74.7	Confident	75.5	Confident	58 Å²	58	93 Å²	93	41%	0.406	50%	0.497	S	S	.	.	H	α-helix	trans	-65	-40.3	177.2	49.9	0	0	0	0	112.2	Y148 A149 V150 F155 L156	Y148-S152 WeakPolarHBondContact O-CB 3.47Å; Y148-S152 PolarHBondContact O-N 2.81Å; Y148-S152 PolarHBondContact O-OG 3.34Å; A149-S152 WeakPolarHBondContact CA-OG 3.48Å; A149-S152 PolarHBondContact O-OG 2.82Å; V150-S152 PolarHBondContact O-N 3.47Å; S152-F155 PolarHBondContact O-N 3.22Å; S152-L156 WeakPolarHBondContact O-CB 3.25Å; S152-L156 VanDerWaalsContact O-CG 3.3Å; S152-L156 WeakPolarHBondContact O-CG 3.3Å; S152-L156 PolarHBondContact O-N 3.27Å
153	I	77	Confident	75.4	Confident	94 Å²	94	90.8 Å²	90.8	48%	0.482	48%	0.477	S	S	.	.	H	α-helix	trans	-64	-45.6	173.6	-69.5	166.6	0	0	0	110.6	A149 V150 F155 L156 I157	A149-I153 WeakPolarHBondContact O-CB 3.48Å; A149-I153 WeakPolarHBondContact O-CD1 3.16Å; A149-I153 WeakPolarHBondContact O-CG1 3.36Å; A149-I153 PolarHBondContact O-N 2.78Å; V150-I153 PolarHBondContact O-N 2.79Å; I153-F155 VanDerWaalsContact C-N 3.34Å; I153-F155 PolarHBondContact O-N 3.32Å; I153-L156 PolarHBondContact O-N 3.36Å; I153-I157 HydrophobicContact CG2-CD1 3.64Å; I153-I157 HydrophobicContact CG2-CG1 4.38Å; I153-I157 VanDerWaalsContact O-CG1 3.31Å; I153-I157 WeakPolarHBondContact O-CG1 3.46Å; I153-I157 PolarHBondContact O-N 2.65Å
154	T	78.6	Confident	75.5	Confident	81 Å²	81	85.6 Å²	85.6	50%	0.497	46%	0.464	S	S	.	.	H	α-helix	trans	-61.5	-41.7	177.6	-58.5	0	0	0	0	111.7	V150 L151 I157 A158	V150-T154 PolarHBondContact O-N 3.06Å; V150-T154 PolarHBondContact O-OG1 3.47Å; L151-T154 PolarHBondContact O-N 3.44Å; T154-I157 PolarHBondContact O-N 3.19Å; T154-A158 VanDerWaalsContact O-CB 3.23Å; T154-A158 WeakPolarHBondContact O-CB 3.37Å; T154-A158 PolarHBondContact O-N 3.02Å
155	F	77	Confident	75.7	Confident	74 Å²	74	89 Å²	89	33%	0.325	48%	0.478	S	S	.	.	H	α-helix	trans	-63.8	-44.3	176	-171.7	-81.9	0	0	0	111.8	L126 L151 S152 I153 I157 A158 V159	L126-F155 HydrophobicContact CD1-CD1 3.86Å; L126-F155 HydrophobicContact CD1-CE1 3.18Å; L126-F155 HydrophobicContact CD1-CZ 3.9Å; L151-F155 WeakPolarHBondContact O-CB 3.46Å; L151-F155 PolarHBondContact O-N 3.41Å; S152-F155 PolarHBondContact O-N 3.22Å; I153-F155 VanDerWaalsContact C-N 3.34Å; I153-F155 PolarHBondContact O-N 3.32Å; F155-I157 VanDerWaalsContact C-N 3.3Å; F155-I157 PolarHBondContact O-N 3.48Å; F155-A158 PolarHBondContact O-N 3.45Å; F155-V159 HydrophobicContact CD1-CB 4.26Å; F155-V159 HydrophobicContact CD1-CG2 4.41Å; F155-V159 HydrophobicContact CD2-CG2 3.9Å; F155-V159 HydrophobicContact CE1-CB 3.9Å; F155-V159 HydrophobicContact CE1-CG1 4.06Å; F155-V159 HydrophobicContact CE1-CG2 4.23Å; F155-V159 HydrophobicContact CE2-CB 4.3Å; F155-V159 HydrophobicContact CE2-CG1 4.45Å; F155-V159 HydrophobicContact CE2-CG2 3.76Å; F155-V159 HydrophobicContact CG-CG2 4.24Å; F155-V159 HydrophobicContact CZ-CB 3.95Å; F155-V159 HydrophobicContact CZ-CG1 3.84Å; F155-V159 HydrophobicContact CZ-CG2 3.93Å; F155-V159 WeakPolarHBondContact O-CB 3.41Å; F155-V159 PolarHBondContact O-N 2.82Å
156	L	75	Confident	75.9	Confident	108 Å²	108	89 Å²	89	57%	0.565	48%	0.483	S	S	*	.	H	α-helix	trans	-61.3	-37.1	176.1	-77.1	168.7	0	0	0	112.2	S152 I153 A160 P161	S152-L156 WeakPolarHBondContact O-CB 3.25Å; S152-L156 VanDerWaalsContact O-CG 3.3Å; S152-L156 WeakPolarHBondContact O-CG 3.3Å; S152-L156 PolarHBondContact O-N 3.27Å; I153-L156 PolarHBondContact O-N 3.36Å; L156-A160 WeakPolarHBondContact O-CB 3.33Å; L156-P161 WeakPolarHBondContact O-CD 3.48Å
157	I	78.9	Confident	75.5	Confident	119 Å²	119	83.5 Å²	83.5	61%	0.61	47%	0.465	S	S	*	.	H	α-helix	trans	-78.6	-39.1	179.4	-66	170.7	0	0	0	111.7	I153 T154 F155 P161	I153-I157 HydrophobicContact CG2-CD1 3.64Å; I153-I157 HydrophobicContact CG2-CG1 4.38Å; I153-I157 VanDerWaalsContact O-CG1 3.31Å; I153-I157 WeakPolarHBondContact O-CG1 3.46Å; I153-I157 PolarHBondContact O-N 2.65Å; T154-I157 PolarHBondContact O-N 3.19Å; F155-I157 VanDerWaalsContact C-N 3.3Å; F155-I157 PolarHBondContact O-N 3.48Å; I157-P161 WeakPolarHBondContact O-CD 3.46Å; I157-P161 VanDerWaalsContact O-CG 3.27Å; I157-P161 WeakPolarHBondContact O-CG 3.33Å
158	A	80.6	Confident	74.8	Confident	62 Å²	62	81.3 Å²	81.3	51%	0.512	46%	0.46	S	S	.	.	H	α-helix	trans	-84	-36.8	-173.5	0	0	0	0	0	113.5	T154 F155 P162	T154-A158 VanDerWaalsContact O-CB 3.23Å; T154-A158 WeakPolarHBondContact O-CB 3.37Å; T154-A158 PolarHBondContact O-N 3.02Å; F155-A158 PolarHBondContact O-N 3.45Å; A158-P162 WeakPolarHBondContact O-CD 3.44Å
159	V	77.6	Confident	74.7	Confident	54 Å²	54	79.2 Å²	79.2	33%	0.327	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-37.6	-169.5	-175.6	0	0	0	0	112.5	F155 P162 F163	F155-V159 HydrophobicContact CD1-CB 4.26Å; F155-V159 HydrophobicContact CD1-CG2 4.41Å; F155-V159 HydrophobicContact CD2-CG2 3.9Å; F155-V159 HydrophobicContact CE1-CB 3.9Å; F155-V159 HydrophobicContact CE1-CG1 4.06Å; F155-V159 HydrophobicContact CE1-CG2 4.23Å; F155-V159 HydrophobicContact CE2-CB 4.3Å; F155-V159 HydrophobicContact CE2-CG1 4.45Å; F155-V159 HydrophobicContact CE2-CG2 3.76Å; F155-V159 HydrophobicContact CG-CG2 4.24Å; F155-V159 HydrophobicContact CZ-CB 3.95Å; F155-V159 HydrophobicContact CZ-CG1 3.84Å; F155-V159 HydrophobicContact CZ-CG2 3.93Å; F155-V159 WeakPolarHBondContact O-CB 3.41Å; F155-V159 PolarHBondContact O-N 2.82Å; V159-P162 WeakPolarHBondContact O-CD 3.29Å; V159-F163 WeakPolarHBondContact O-CB 3.43Å; V159-F163 PolarHBondContact O-N 3.17Å
160	A	70.9	Confident	74.5	Confident	35 Å²	35	81.4 Å²	81.4	29%	0.289	47%	0.473	S	S	.	.	H	α-helix	trans	-66	-42.7	-175.7	0	0	0	0	0	113.4	L156 F163 L164	L156-A160 WeakPolarHBondContact O-CB 3.33Å; A160-F163 PolarHBondContact O-N 3.45Å; A160-L164 WeakPolarHBondContact O-CB 3.19Å; A160-L164 WeakPolarHBondContact O-CG 3.24Å; A160-L164 PolarHBondContact O-N 3.13Å
161	P	79.2	Confident	73.8	Confident	58 Å²	58	84.8 Å²	84.8	38%	0.377	48%	0.475	S	S	.	.	H	α-helix	trans	-65.2	-48	-177.8	-20.7	32.7	0	0	0	114.2	L156 I157 F163 L164 I165	L156-P161 WeakPolarHBondContact O-CD 3.48Å; I157-P161 WeakPolarHBondContact O-CD 3.46Å; I157-P161 VanDerWaalsContact O-CG 3.27Å; I157-P161 WeakPolarHBondContact O-CG 3.33Å; P161-F163 PolarHBondContact O-N 2.9Å; P161-L164 PolarHBondContact O-N 3.13Å; P161-I165 WeakPolarHBondContact O-CB 3.19Å; P161-I165 WeakPolarHBondContact O-CD1 3.2Å; P161-I165 WeakPolarHBondContact O-CG1 3.49Å; P161-I165 PolarHBondContact O-N 3.47Å
162	P	77.8	Confident	73.3	Confident	76 Å²	76	82.4 Å²	82.4	49%	0.494	47%	0.473	S	S	.	.	H	α-helix	trans	-58.8	-37.2	176.6	-25.3	34.8	0	0	0	113	A158 V159 I165 A166	A158-P162 WeakPolarHBondContact O-CD 3.44Å; V159-P162 WeakPolarHBondContact O-CD 3.29Å; P162-I165 PolarHBondContact O-N 3.35Å; P162-A166 WeakPolarHBondContact O-CB 3.5Å; P162-A166 PolarHBondContact O-N 3.02Å
163	F	67.2	Low	73.2	Confident	78 Å²	78	87.3 Å²	87.3	34%	0.342	48%	0.482	S	S	.	.	H	α-helix	trans	-69.2	-44	178.9	-175.9	-90.1	0	0	0	112.7	L119 L122 V159 A160 P161 I165 A166 S167	L119-F163 HydrophobicContact CD2-CE1 4.16Å; L119-F163 HydrophobicContact CD2-CE2 3.37Å; L119-F163 HydrophobicContact CD2-CZ 3.12Å; L122-F163 HydrophobicContact CD1-CD2 4.28Å; L122-F163 HydrophobicContact CD1-CE2 3.95Å; V159-F163 WeakPolarHBondContact O-CB 3.43Å; V159-F163 PolarHBondContact O-N 3.17Å; A160-F163 PolarHBondContact O-N 3.45Å; P161-F163 PolarHBondContact O-N 2.9Å; F163-I165 VanDerWaalsContact C-N 3.32Å; F163-A166 PolarHBondContact O-N 3.39Å; F163-S167 WeakPolarHBondContact O-CB 3.36Å; F163-S167 PolarHBondContact O-N 3.33Å; F163-S167 PolarHBondContact O-OG 3.39Å
164	L	70.5	Confident	72.6	Confident	95 Å²	95	86.3 Å²	86.3	50%	0.497	48%	0.478	S	S	.	.	H	α-helix	trans	-60.5	-44.9	172.8	-73.2	173.3	0	0	0	110.2	A160 P161 A166 S167 F168	A160-L164 WeakPolarHBondContact O-CB 3.19Å; A160-L164 WeakPolarHBondContact O-CG 3.24Å; A160-L164 PolarHBondContact O-N 3.13Å; P161-L164 PolarHBondContact O-N 3.13Å; L164-A166 PolarHBondContact O-N 2.92Å; L164-S167 PolarHBondContact O-N 2.84Å; L164-F168 HydrophobicContact CB-CD2 4.44Å; L164-F168 WeakPolarHBondContact O-CB 3.32Å; L164-F168 WeakPolarHBondContact O-CD2 3.37Å; L164-F168 PolarHBondContact O-N 2.7Å
165	I	75.9	Confident	72.2	Confident	118 Å²	118	83.9 Å²	83.9	61%	0.605	47%	0.469	S	S	*	.	H	α-helix	trans	-59	-46.6	176.9	-68	164	0	0	0	111.2	P161 P162 F163 F168 A169	P161-I165 WeakPolarHBondContact O-CB 3.19Å; P161-I165 WeakPolarHBondContact O-CD1 3.2Å; P161-I165 WeakPolarHBondContact O-CG1 3.49Å; P161-I165 PolarHBondContact O-N 3.47Å; P162-I165 PolarHBondContact O-N 3.35Å; F163-I165 VanDerWaalsContact C-N 3.32Å; I165-F168 PolarHBondContact O-N 3.4Å; I165-A169 WeakPolarHBondContact O-CB 3.45Å; I165-A169 PolarHBondContact O-N 2.98Å
166	A	71.5	Confident	71.8	Confident	54 Å²	54	87 Å²	87	45%	0.446	48%	0.484	S	S	.	.	H	α-helix	trans	-64.7	-41.5	178	0	0	0	0	0	112.3	P162 F163 L164 A169 T170	P162-A166 WeakPolarHBondContact O-CB 3.5Å; P162-A166 PolarHBondContact O-N 3.02Å; F163-A166 PolarHBondContact O-N 3.39Å; L164-A166 PolarHBondContact O-N 2.92Å; A166-A169 PolarHBondContact O-N 2.83Å; A166-T170 WeakPolarHBondContact O-CB 3.28Å; A166-T170 PolarHBondContact O-N 2.64Å; A166-T170 PolarHBondContact O-OG1 3.44Å
167	S	67.3	Low	71.4	Confident	47 Å²	47	84.8 Å²	84.8	33%	0.329	47%	0.471	S	S	.	.	H	α-helix	trans	-63.9	-43.7	176.7	-59.4	0	0	0	0	111.2	F163 L164 T170 W171	F163-S167 WeakPolarHBondContact O-CB 3.36Å; F163-S167 PolarHBondContact O-N 3.33Å; F163-S167 PolarHBondContact O-OG 3.39Å; L164-S167 PolarHBondContact O-N 2.84Å; S167-T170 PolarHBondContact O-N 3.4Å; S167-W171 VanDerWaalsContact O-CB 3.32Å; S167-W171 WeakPolarHBondContact O-CB 3.32Å; S167-W171 PolarHBondContact O-N 2.84Å
168	F	64.6	Low	70.8	Confident	140 Å²	140	80.4 Å²	80.4	61%	0.614	45%	0.45	S	S	*	.	H	α-helix	trans	-65	-39.4	174.4	-86.8	-68.2	0	0	0	112.5	L164 I165 W171 A172	L164-F168 HydrophobicContact CB-CD2 4.44Å; L164-F168 WeakPolarHBondContact O-CB 3.32Å; L164-F168 WeakPolarHBondContact O-CD2 3.37Å; L164-F168 PolarHBondContact O-N 2.7Å; I165-F168 PolarHBondContact O-N 3.4Å; F168-W171 PolarHBondContact O-N 2.89Å; F168-A172 WeakPolarHBondContact O-CB 3.34Å; F168-A172 PolarHBondContact O-N 3.21Å
169	A	70.8	Confident	70.3	Confident	60 Å²	60	80.2 Å²	80.2	50%	0.496	44%	0.438	S	S	.	.	H	α-helix	trans	-64.5	-41.4	175.9	0	0	0	0	0	111.7	I165 A166 A172 R173	I165-A169 WeakPolarHBondContact O-CB 3.45Å; I165-A169 PolarHBondContact O-N 2.98Å; A166-A169 PolarHBondContact O-N 2.83Å; A169-A172 PolarHBondContact O-N 2.87Å; A169-R173 PolarHBondContact O-N 3.41Å; A169-R173 VanDerWaalsContact O-N 3.12Å
170	T	69.7	Low	69.8	Low	87 Å²	87	83 Å²	83	53%	0.534	45%	0.449	S	S	.	.	H	α-helix	trans	-66.5	-42.1	176.2	-44.3	0	0	0	0	110.9	A166 S167 R173 L174	A166-T170 WeakPolarHBondContact O-CB 3.28Å; A166-T170 PolarHBondContact O-N 2.64Å; A166-T170 PolarHBondContact O-OG1 3.44Å; S167-T170 PolarHBondContact O-N 3.4Å; T170-R173 PolarHBondContact O-N 3.29Å; T170-L174 PolarHBondContact O-N 3.36Å
171	W	66.7	Low	69.5	Low	165 Å²	165	85.5 Å²	85.5	63%	0.625	46%	0.457	S	S	*	.	H	α-helix	trans	-61.2	-43.1	174.2	-178.3	-91	0	0	0	112.7	S167 F168 R173 L174	S167-W171 VanDerWaalsContact O-CB 3.32Å; S167-W171 WeakPolarHBondContact O-CB 3.32Å; S167-W171 PolarHBondContact O-N 2.84Å; F168-W171 PolarHBondContact O-N 2.89Å; W171-R173 VanDerWaalsContact C-N 3.31Å; W171-R173 PolarHBondContact O-N 2.64Å; W171-L174 WeakPolarHBondContact O-CB 3.31Å; W171-L174 PolarHBondContact O-N 3Å
172	A	68.8	Low	69.2	Low	67 Å²	67	82.9 Å²	82.9	55%	0.554	44%	0.44	S	S	*	.	H	α-helix	trans	-61.6	-40.9	177.3	0	0	0	0	0	111.4	F168 A169 G175	F168-A172 WeakPolarHBondContact O-CB 3.34Å; F168-A172 PolarHBondContact O-N 3.21Å; A169-A172 PolarHBondContact O-N 2.87Å; A172-G175 PolarHBondContact O-N 3.41Å
173	R	71.4	Confident	68.9	Low	161 Å²	161	83.2 Å²	83.2	61%	0.608	43%	0.433	S	S	*	.	H	α-helix	trans	-70.4	-31.7	178.4	-158.2	173.5	-172.6	162.1	1.6	113.1	A169 T170 W171 G175 E176	A169-R173 PolarHBondContact O-N 3.41Å; A169-R173 VanDerWaalsContact O-N 3.12Å; T170-R173 PolarHBondContact O-N 3.29Å; W171-R173 VanDerWaalsContact C-N 3.31Å; W171-R173 PolarHBondContact O-N 2.64Å; R173-G175 PolarHBondContact O-N 2.75Å; R173-E176 PolarHBondContact O-N 2.71Å
174	L	65.6	Low	69	Low	73 Å²	73	81.4 Å²	81.4	38%	0.382	43%	0.433	S	S	.	.	H	α-helix	trans	-59.6	-29.5	176.4	-162.5	74.3	0	0	0	112.3	T170 W171 E177 V178	T170-L174 PolarHBondContact O-N 3.36Å; W171-L174 WeakPolarHBondContact O-CB 3.31Å; W171-L174 PolarHBondContact O-N 3Å; L174-E177 PolarHBondContact O-N 3.44Å; L174-V178 HydrophobicContact CG-CG2 4.1Å; L174-V178 WeakPolarHBondContact O-CB 3.49Å; L174-V178 WeakPolarHBondContact O-CG2 3.34Å; L174-V178 PolarHBondContact O-N 2.82Å
175	G	68.7	Low	69.2	Low	30 Å²	30	78.3 Å²	78.3	31%	0.309	42%	0.415	S	S	.	.	H	α-helix	trans	-58.4	-47.8	176.9	0	0	0	0	0	113.2	A172 R173 E179 V300	A172-G175 PolarHBondContact O-N 3.41Å; R173-G175 PolarHBondContact O-N 2.75Å; G175-E179 WeakPolarHBondContact O-CB 3.15Å; G175-E179 PolarHBondContact O-N 3.29Å; G175-V300 WeakPolarHBondContact O-CG1 3.37Å
176	E	68.7	Low	69.2	Low	139 Å²	139	72.9 Å²	72.9	65%	0.65	39%	0.387	S	S	*	.	H	α-helix	trans	-69	-38.1	-178.5	-65.5	-176.4	169.6	0	0	112.4	R173 E179 M180	R173-E176 PolarHBondContact O-N 2.71Å; E176-E179 WeakPolarHBondContact O-CB 3.11Å; E176-E179 PolarHBondContact O-N 2.71Å; E176-M180 PolarHBondContact O-N 2.97Å
177	E	67.6	Low	69.2	Low	63 Å²	63	71.2 Å²	71.2	29%	0.294	38%	0.375	S	S	.	.	H	α-helix	trans	-69.3	-42.3	178.4	-63.6	-65.5	161.3	0	0	111.6	T108 L174 E179 M180 L181	T108-E177 HydrophobicContact CG2-CB 4.4Å; T108-E177 HydrophobicContact CG2-CG 3.98Å; L174-E177 PolarHBondContact O-N 3.44Å; E177-E179 VanDerWaalsContact C-N 3.3Å; E177-E179 PolarHBondContact O-N 3.46Å; E177-M180 PolarHBondContact O-N 3.09Å; E177-L181 WeakPolarHBondContact O-CB 3Å; E177-L181 PolarHBondContact O-N 2.91Å
178	V	66.4	Low	69.4	Low	27 Å²	27	73 Å²	73	16%	0.164	38%	0.378	C	S	.	.	H	α-helix	trans	-63.9	-38.3	175.3	171.4	0	0	0	0	111	L174 L181 Y182 V300 F303	L174-V178 HydrophobicContact CG-CG2 4.1Å; L174-V178 WeakPolarHBondContact O-CB 3.49Å; L174-V178 WeakPolarHBondContact O-CG2 3.34Å; L174-V178 PolarHBondContact O-N 2.82Å; V178-L181 PolarHBondContact O-N 3.48Å; V178-Y182 WeakPolarHBondContact O-CB 3.46Å; V178-Y182 PolarHBondContact O-N 2.86Å; V178-V300 HydrophobicContact CB-CG1 4.48Å; V178-V300 HydrophobicContact CG1-CG1 4.33Å; V178-F303 HydrophobicContact CG1-CD1 3.57Å; V178-F303 HydrophobicContact CG1-CE1 4.25Å
179	E	69.1	Low	69.7	Low	57 Å²	57	71.4 Å²	71.4	27%	0.266	37%	0.371	S	S	.	.	H	α-helix	trans	-58.2	-49.1	173	179.7	174.6	151.7	0	0	111.6	G175 E176 E177 L181 Y182 K183 F215 V300	G175-E179 WeakPolarHBondContact O-CB 3.15Å; G175-E179 PolarHBondContact O-N 3.29Å; E176-E179 WeakPolarHBondContact O-CB 3.11Å; E176-E179 PolarHBondContact O-N 2.71Å; E177-E179 VanDerWaalsContact C-N 3.3Å; E177-E179 PolarHBondContact O-N 3.46Å; E179-L181 VanDerWaalsContact C-N 3.34Å; E179-L181 PolarHBondContact O-N 3.27Å; E179-Y182 PolarHBondContact O-N 2.85Å; E179-K183 VanDerWaalsContact CG-CE 3.47Å; E179-K183 WeakPolarHBondContact O-CG 3.42Å; E179-K183 PolarHBondContact O-N 2.69Å; E179-K183 VanDerWaalsContact OE1-CE 3.26Å; E179-K183 WeakPolarHBondContact OE1-CE 3.21Å; E179-K183 IonicContact OE1-NZ 2.71Å; E179-K183 PolarHBondContact OE1-NZ 3.37Å; E179-F215 HydrophobicContact CG-CE2 3.69Å; E179-F215 HydrophobicContact CG-CZ 3.57Å; E179-F215 WeakPolarHBondContact OE1-CZ 3.42Å; E179-V300 HydrophobicContact CB-CB 4.21Å; E179-V300 HydrophobicContact CB-CG1 3.67Å; E179-V300 HydrophobicContact CB-CG2 3.47Å; E179-V300 VanDerWaalsContact CB-CG2 3.47Å; E179-V300 HydrophobicContact CG-CG2 3.41Å; E179-V300 VanDerWaalsContact CG-CG2 3.41Å
180	M	67.2	Low	70	Confident	112 Å²	112	68.8 Å²	68.8	55%	0.552	35%	0.349	S	S	*	.	H	α-helix	trans	-62.5	-42.5	179	-168.4	-172.7	-53.4	0	0	111.6	E176 E177 K183 A184	E176-M180 PolarHBondContact O-N 2.97Å; E177-M180 PolarHBondContact O-N 3.09Å; M180-K183 WeakPolarHBondContact O-CB 3.22Å; M180-K183 PolarHBondContact O-N 3.02Å; M180-A184 WeakPolarHBondContact O-CB 3Å; M180-A184 PolarHBondContact O-N 2.76Å
181	L	65.5	Low	70.1	Confident	89 Å²	89	65.2 Å²	65.2	47%	0.466	33%	0.329	S	S	.	.	H	α-helix	trans	-63.8	-45	178.2	-173.9	67.4	0	0	0	111.5	L105 E177 V178 E179 A184 Y185	L105-L181 HydrophobicContact CD1-CD1 4.12Å; E177-L181 WeakPolarHBondContact O-CB 3Å; E177-L181 PolarHBondContact O-N 2.91Å; V178-L181 PolarHBondContact O-N 3.48Å; E179-L181 VanDerWaalsContact C-N 3.34Å; E179-L181 PolarHBondContact O-N 3.27Å; L181-A184 PolarHBondContact O-N 3.29Å; L181-Y185 WeakPolarHBondContact O-CB 3.42Å; L181-Y185 PolarHBondContact O-N 3.45Å
182	Y	71.3	Confident	70.5	Confident	3 Å²	3	57.9 Å²	57.9	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-62.8	-44	176.5	177.2	-111.8	0	0	0	111.9	V178 E179 A184 Y185 V186 V203 L206 F215 I299 F303	V178-Y182 WeakPolarHBondContact O-CB 3.46Å; V178-Y182 PolarHBondContact O-N 2.86Å; E179-Y182 PolarHBondContact O-N 2.85Å; Y182-A184 VanDerWaalsContact C-N 3.34Å; Y182-A184 PolarHBondContact O-N 3.31Å; Y182-Y185 PolarHBondContact O-N 3.45Å; Y182-V186 HydrophobicContact CD2-CG2 3.93Å; Y182-V186 HydrophobicContact CE1-CG2 4.05Å; Y182-V186 HydrophobicContact CE2-CG2 3.47Å; Y182-V186 VanDerWaalsContact CE2-CG2 3.47Å; Y182-V186 HydrophobicContact CG-CG2 4.47Å; Y182-V186 WeakPolarHBondContact O-CG2 3.25Å; Y182-V186 PolarHBondContact O-N 2.94Å; Y182-V203 HydrophobicContact CE2-CG2 4.45Å; Y182-L206 HydrophobicContact CE2-CD1 4.33Å; Y182-F215 AromaticContact CD1-CD2 3.69Å; Y182-F215 HydrophobicContact CD1-CD2 3.69Å; Y182-F215 HydrophobicContact CD1-CE2 4.21Å; Y182-F215 AromaticContact CE1-CD2 3.94Å; Y182-F215 HydrophobicContact CE1-CD2 3.94Å; Y182-I299 HydrophobicContact CD1-CG2 4.15Å; Y182-I299 HydrophobicContact CE1-CG2 3.46Å; Y182-I299 VanDerWaalsContact CE1-CG2 3.46Å; Y182-F303 AromaticContact CD2-CD2 3.03Å; Y182-F303 HydrophobicContact CD2-CD2 3.03Å; Y182-F303 AromaticContact CD2-CE2 3.24Å; Y182-F303 HydrophobicContact CD2-CE2 3.24Å; Y182-F303 AromaticContact CD2-CG 3.81Å; Y182-F303 HydrophobicContact CD2-CG 3.81Å; Y182-F303 HydrophobicContact CD2-CZ 4.08Å; Y182-F303 AromaticContact CE2-CD2 3.44Å; Y182-F303 HydrophobicContact CE2-CD2 3.44Å; Y182-F303 VanDerWaalsContact CE2-CD2 3.44Å; Y182-F303 AromaticContact CE2-CE2 3.78Å; Y182-F303 HydrophobicContact CE2-CE2 3.78Å; Y182-F303 HydrophobicContact CE2-CG 4.44Å; Y182-F303 AromaticContact CG-CD2 3.74Å; Y182-F303 HydrophobicContact CG-CD2 3.74Å; Y182-F303 HydrophobicContact CG-CE2 4.19Å; Y182-F303 HydrophobicContact CG-CG 4.07Å
183	K	72.8	Confident	70.1	Confident	82 Å²	82	59.9 Å²	59.9	36%	0.357	30%	0.303	S	S	.	.	H	α-helix	trans	-55.2	-49.3	172.8	-82.1	-171.2	-118.4	-141.3	0	111.9	E179 M180 Y185 G187 F215	E179-K183 VanDerWaalsContact CG-CE 3.47Å; E179-K183 WeakPolarHBondContact O-CG 3.42Å; E179-K183 PolarHBondContact O-N 2.69Å; E179-K183 VanDerWaalsContact OE1-CE 3.26Å; E179-K183 WeakPolarHBondContact OE1-CE 3.21Å; E179-K183 IonicContact OE1-NZ 2.71Å; E179-K183 PolarHBondContact OE1-NZ 3.37Å; M180-K183 WeakPolarHBondContact O-CB 3.22Å; M180-K183 PolarHBondContact O-N 3.02Å; K183-Y185 VanDerWaalsContact C-N 3.3Å; K183-Y185 PolarHBondContact O-N 3.12Å; K183-G187 PolarHBondContact O-N 3.02Å; K183-F215 HydrophobicContact CD-CD1 3.47Å; K183-F215 VanDerWaalsContact CD-CD1 3.47Å; K183-F215 HydrophobicContact CD-CD2 4.24Å; K183-F215 HydrophobicContact CD-CE1 3.15Å; K183-F215 HydrophobicContact CD-CE2 3.9Å; K183-F215 HydrophobicContact CD-CG 4.09Å; K183-F215 HydrophobicContact CD-CZ 3.42Å; K183-F215 VanDerWaalsContact CD-CZ 3.42Å; K183-F215 HydrophobicContact CG-CD1 3.37Å; K183-F215 HydrophobicContact CG-CD2 3.36Å; K183-F215 HydrophobicContact CG-CE1 3.43Å; K183-F215 VanDerWaalsContact CG-CE1 3.43Å; K183-F215 HydrophobicContact CG-CE2 3.32Å; K183-F215 HydrophobicContact CG-CG 3.43Å; K183-F215 VanDerWaalsContact CG-CG 3.43Å; K183-F215 HydrophobicContact CG-CZ 3.43Å; K183-F215 VanDerWaalsContact CG-CZ 3.43Å
184	A	69.6	Low	69.6	Low	40 Å²	40	58.7 Å²	58.7	33%	0.331	30%	0.299	S	S	.	.	H	α-helix	trans	-61.3	-42.6	179	0	0	0	0	0	110.6	M180 L181 Y182 H188	M180-A184 WeakPolarHBondContact O-CB 3Å; M180-A184 PolarHBondContact O-N 2.76Å; L181-A184 PolarHBondContact O-N 3.29Å; Y182-A184 VanDerWaalsContact C-N 3.34Å; Y182-A184 PolarHBondContact O-N 3.31Å; A184-H188 VanDerWaalsContact O-CB 3.26Å; A184-H188 WeakPolarHBondContact O-CB 3.21Å; A184-H188 PolarHBondContact O-CD2 3.5Å; A184-H188 PolarHBondContact O-N 3.15Å
185	Y	73.3	Confident	69.4	Low	31 Å²	31	63.1 Å²	63.1	12%	0.122	32%	0.315	C	S	.	.	H	α-helix	trans	-62.3	-53.7	179	-168.9	-87.4	0	0	0	113	L181 Y182 K183 G187 H188 F189 Y190 F199 V203	L181-Y185 WeakPolarHBondContact O-CB 3.42Å; L181-Y185 PolarHBondContact O-N 3.45Å; Y182-Y185 PolarHBondContact O-N 3.45Å; K183-Y185 VanDerWaalsContact C-N 3.3Å; K183-Y185 PolarHBondContact O-N 3.12Å; Y185-G187 VanDerWaalsContact C-N 3.3Å; Y185-G187 PolarHBondContact O-N 3.02Å; Y185-H188 PolarHBondContact O-N 3.22Å; Y185-F189 HydrophobicContact CD2-CB 3.92Å; Y185-F189 HydrophobicContact CD2-CD2 4.14Å; Y185-F189 HydrophobicContact CD2-CG 4.38Å; Y185-F189 HydrophobicContact CE1-CB 4.48Å; Y185-F189 HydrophobicContact CE2-CB 3.7Å; Y185-F189 HydrophobicContact CE2-CG 4.4Å; Y185-F189 HydrophobicContact CG-CB 4.39Å; Y185-F189 PolarHBondContact O-N 3.28Å; Y185-Y190 PolarHBondContact O-N 3.41Å; Y185-Y190 VanDerWaalsContact O-N 3.13Å; Y185-F199 HydrophobicContact CE1-CB 3.99Å; Y185-F199 HydrophobicContact CE1-CD1 4.32Å; Y185-F199 HydrophobicContact CE1-CG 4.45Å; Y185-F199 HydrophobicContact CE2-CB 4.36Å; Y185-F199 HydrophobicContact CE2-CD1 4.08Å; Y185-F199 HydrophobicContact CE2-CG 4.15Å; Y185-F199 AromaticContact CZ-CD1 3.93Å; Y185-F199 AromaticContact CZ-CG 3.8Å; Y185-F199 WeakPolarHBondContact OH-CB 3.48Å; Y185-V203 HydrophobicContact CD1-CG2 3.97Å; Y185-V203 HydrophobicContact CE1-CG2 3.89Å
186	V	76.5	Confident	69.3	Low	3 Å²	3	66.6 Å²	66.6	2%	0.018	32%	0.323	C	S	.	.	H	α-helix	trans	-62.9	-38.4	-180	175.6	0	0	0	0	111.4	Y182 V203 T234	Y182-V186 HydrophobicContact CD2-CG2 3.93Å; Y182-V186 HydrophobicContact CE1-CG2 4.05Å; Y182-V186 HydrophobicContact CE2-CG2 3.47Å; Y182-V186 VanDerWaalsContact CE2-CG2 3.47Å; Y182-V186 HydrophobicContact CG-CG2 4.47Å; Y182-V186 WeakPolarHBondContact O-CG2 3.25Å; Y182-V186 PolarHBondContact O-N 2.94Å; V186-V203 HydrophobicContact CG2-CG1 4.32Å; V186-T234 HydrophobicContact CG1-CG2 4.19Å
187	G	72.5	Confident	69.5	Low	19 Å²	19	63.5 Å²	63.5	20%	0.196	32%	0.321	C	S	.	.	H	α-helix	trans	-71	-37.2	178.7	0	0	0	0	0	114.1	K183 Y185	K183-G187 PolarHBondContact O-N 3.02Å; Y185-G187 VanDerWaalsContact C-N 3.3Å; Y185-G187 PolarHBondContact O-N 3.02Å
188	H	70.1	Confident	69.5	Low	84 Å²	84	64.9 Å²	64.9	39%	0.389	32%	0.324	S	S	.	.	H	α-helix	trans	-112	-26.5	-168.3	-72.6	-92.7	0	0	0	115.8	A184 Y185 T192 N235 R425	A184-H188 VanDerWaalsContact O-CB 3.26Å; A184-H188 WeakPolarHBondContact O-CB 3.21Å; A184-H188 PolarHBondContact O-CD2 3.5Å; A184-H188 PolarHBondContact O-N 3.15Å; Y185-H188 PolarHBondContact O-N 3.22Å; H188-T192 WeakPolarHBondContact O-CG2 3.2Å; H188-N235 PolarHBondContact O-ND2 3.39Å; H188-R425 PolarHBondContact CE1-NH2 2.99Å; H188-R425 PolarHBondContact NE2-NH2 3.31Å; H188-R425 VanDerWaalsContact NE2-NH2 3.12Å
189	F	70.6	Confident	69.7	Low	107 Å²	107	67.2 Å²	67.2	47%	0.469	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120	-27.4	-169.5	-63.2	-72.2	0	0	0	113.3	Y185 G191 T192	Y185-F189 HydrophobicContact CD2-CB 3.92Å; Y185-F189 HydrophobicContact CD2-CD2 4.14Å; Y185-F189 HydrophobicContact CD2-CG 4.38Å; Y185-F189 HydrophobicContact CE1-CB 4.48Å; Y185-F189 HydrophobicContact CE2-CB 3.7Å; Y185-F189 HydrophobicContact CE2-CG 4.4Å; Y185-F189 HydrophobicContact CG-CB 4.39Å; Y185-F189 PolarHBondContact O-N 3.28Å; F189-G191 PolarHBondContact O-N 3.29Å; F189-T192 WeakPolarHBondContact O-CB 3.46Å; F189-T192 VanDerWaalsContact O-CG2 3.25Å; F189-T192 WeakPolarHBondContact O-CG2 3.17Å; F189-T192 PolarHBondContact O-N 2.68Å; F189-T192 VanDerWaalsContact O-N 3.08Å; F189-T192 PolarHBondContact O-OG1 3.11Å
190	Y	77.5	Confident	69.9	Low	6 Å²	6	65.6 Å²	65.6	2%	0.024	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	127.1	179.2	-175.4	-109	0	0	0	112	Y185 T192 D200 V203 D204 Y230 W236 P256	Y185-Y190 PolarHBondContact O-N 3.41Å; Y185-Y190 VanDerWaalsContact O-N 3.13Å; Y190-T192 VanDerWaalsContact C-N 3.27Å; Y190-T192 PolarHBondContact O-N 3.49Å; Y190-D200 HydrophobicContact CE2-CB 4.41Å; Y190-V203 HydrophobicContact CD2-CB 3.79Å; Y190-V203 HydrophobicContact CD2-CG1 3.44Å; Y190-V203 VanDerWaalsContact CD2-CG1 3.44Å; Y190-V203 HydrophobicContact CD2-CG2 4.22Å; Y190-V203 HydrophobicContact CE2-CB 3.72Å; Y190-V203 HydrophobicContact CE2-CG1 3.36Å; Y190-V203 HydrophobicContact CG-CG1 4.13Å; Y190-D204 PolarHBondContact OH-OD1 2.81Å; Y190-Y230 HydrophobicContact CD1-CE1 4.32Å; Y190-Y230 HydrophobicContact CE1-CD1 4.28Å; Y190-Y230 AromaticContact CE1-CE1 3.93Å; Y190-Y230 HydrophobicContact CE1-CE1 3.93Å; Y190-W236 HydrophobicContact CD1-CB 3.76Å; Y190-W236 HydrophobicContact CD1-CG 4.23Å; Y190-W236 HydrophobicContact CE1-CB 4.03Å; Y190-W236 AromaticContact CE1-CG 3.99Å; Y190-W236 HydrophobicContact CE1-CG 3.99Å; Y190-W236 PolarHBondContact O-N 3.31Å; Y190-W236 VanDerWaalsContact O-N 3.08Å; Y190-P256 HydrophobicContact CE1-CG 3.69Å; Y190-P256 VanDerWaalsContact OH-CB 3.32Å; Y190-P256 WeakPolarHBondContact OH-CB 3.07Å; Y190-P256 WeakPolarHBondContact OH-CG 2.97Å
191	G	72.3	Confident	70.5	Confident	11 Å²	11	65.1 Å²	65.1	11%	0.113	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	10.9	-178.1	0	0	0	0	0	116.1	F189 L239	F189-G191 PolarHBondContact O-N 3.29Å; G191-L239 WeakPolarHBondContact O-CD2 3.23Å
192	T	73.9	Confident	71.1	Confident	12 Å²	12	61.1 Å²	61.1	7%	0.074	30%	0.304	C	S	.	.	S	Bend	trans	-74	166.2	172.6	64.5	0	0	0	0	111.8	H188 F189 Y190 Y194 K195 N235	H188-T192 WeakPolarHBondContact O-CG2 3.2Å; F189-T192 WeakPolarHBondContact O-CB 3.46Å; F189-T192 VanDerWaalsContact O-CG2 3.25Å; F189-T192 WeakPolarHBondContact O-CG2 3.17Å; F189-T192 PolarHBondContact O-N 2.68Å; F189-T192 VanDerWaalsContact O-N 3.08Å; F189-T192 PolarHBondContact O-OG1 3.11Å; Y190-T192 VanDerWaalsContact C-N 3.27Å; Y190-T192 PolarHBondContact O-N 3.49Å; T192-Y194 PolarHBondContact O-N 3.22Å; T192-K195 PolarHBondContact O-N 2.83Å; T192-N235 HydrophobicContact CG2-CB 3.88Å
193	I	61	Low	71.4	Confident	109 Å²	109	61 Å²	61	56%	0.559	30%	0.304	S	S	*	.	S	Bend	trans	-62.8	-19	173.9	55.9	168.5	0	0	0	113.1	K195 Y377	I193-K195 PolarHBondContact O-N 3.46Å; I193-Y377 WeakPolarHBondContact CG2-OH 3.48Å
194	Y	61.1	Low	71.9	Confident	136 Å²	136	59.2 Å²	59.2	53%	0.533	30%	0.299	S	S	.	.	S	Bend	trans	-72.9	60.1	164.1	-53.7	-72.1	0	0	0	108.7	T192 H196	T192-Y194 PolarHBondContact O-N 3.22Å; Y194-H196 PolarHBondContact O-N 3.12Å
195	K	60.8	Low	72.5	Confident	165 Å²	165	63 Å²	63	72%	0.717	31%	0.307	S	S	*	.			trans	-62.2	84.6	175	-79.8	-170.4	176.7	-176.8	0	107.5	T192 I193 A197	T192-K195 PolarHBondContact O-N 2.83Å; I193-K195 PolarHBondContact O-N 3.46Å; K195-A197 PolarHBondContact O-N 3.35Å
196	H	67.1	Low	72.7	Confident	104 Å²	104	61.6 Å²	61.6	48%	0.481	30%	0.302	S	S	.	.			trans	-74.2	83	155.8	-63.5	-56	0	0	0	105.3	Y194 Y198 F199 D200	Y194-H196 PolarHBondContact O-N 3.12Å; H196-Y198 CarbonylContact O-C 3.5Å; H196-Y198 PolarHBondContact O-N 3.32Å; H196-F199 HydrophobicContact CB-CB 3.92Å; H196-F199 HydrophobicContact CB-CD2 3.7Å; H196-F199 HydrophobicContact CB-CG 4.28Å; H196-F199 WeakPolarHBondContact O-CA 3.33Å; H196-F199 PolarHBondContact O-N 2.73Å; H196-D200 PolarHBondContact O-N 3.39Å
197	A	72	Confident	72.8	Confident	74 Å²	74	61.7 Å²	61.7	61%	0.612	30%	0.302	S	S	*	.	H	α-helix	trans	-47.6	-30.9	-179.9	0	0	0	0	0	111.7	K195 N201	K195-A197 PolarHBondContact O-N 3.35Å; A197-N201 WeakPolarHBondContact O-CB 3.17Å; A197-N201 PolarHBondContact O-N 3.45Å
198	Y	69.1	Low	73.1	Confident	91 Å²	91	63.2 Å²	63.2	36%	0.357	31%	0.31	S	S	.	.	H	α-helix	trans	-61.7	-51	170.3	-174.1	-93.7	0	0	0	114.5	H196 L202 M310 S314	H196-Y198 CarbonylContact O-C 3.5Å; H196-Y198 PolarHBondContact O-N 3.32Å; Y198-L202 WeakPolarHBondContact O-CB 3.34Å; Y198-L202 PolarHBondContact O-N 2.92Å; Y198-M310 HydrophobicContact CD2-CE 4.3Å; Y198-M310 HydrophobicContact CE1-CE 3.94Å; Y198-M310 HydrophobicContact CE2-CE 3.48Å; Y198-M310 VanDerWaalsContact CE2-CE 3.48Å; Y198-M310 HydrophobicContact CE2-SD 4.5Å; Y198-M310 WeakPolarHBondContact OH-CB 3.43Å; Y198-M310 WeakPolarHBondContact OH-CE 3.47Å; Y198-M310 PolarHBondContact OH-O 3.03Å; Y198-M310 PolarHBondContact OH-SD 3.33Å; Y198-S314 PolarHBondContact OH-OG 2.81Å
199	F	69.4	Low	73.5	Confident	76 Å²	76	62.4 Å²	62.4	33%	0.333	31%	0.313	S	S	.	.	H	α-helix	trans	-72.3	-37	179	-84	-82.2	0	0	0	112.3	Y185 H196 N201 L202 V203	Y185-F199 HydrophobicContact CE1-CB 3.99Å; Y185-F199 HydrophobicContact CE1-CD1 4.32Å; Y185-F199 HydrophobicContact CE1-CG 4.45Å; Y185-F199 HydrophobicContact CE2-CB 4.36Å; Y185-F199 HydrophobicContact CE2-CD1 4.08Å; Y185-F199 HydrophobicContact CE2-CG 4.15Å; Y185-F199 AromaticContact CZ-CD1 3.93Å; Y185-F199 AromaticContact CZ-CG 3.8Å; Y185-F199 WeakPolarHBondContact OH-CB 3.48Å; H196-F199 HydrophobicContact CB-CB 3.92Å; H196-F199 HydrophobicContact CB-CD2 3.7Å; H196-F199 HydrophobicContact CB-CG 4.28Å; H196-F199 WeakPolarHBondContact O-CA 3.33Å; H196-F199 PolarHBondContact O-N 2.73Å; F199-N201 VanDerWaalsContact C-N 3.33Å; F199-L202 HydrophobicContact CD1-CD2 4.22Å; F199-L202 WeakPolarHBondContact O-CB 3.43Å; F199-L202 PolarHBondContact O-N 3.03Å; F199-V203 VanDerWaalsContact O-CB 3.32Å; F199-V203 WeakPolarHBondContact O-CB 3.38Å; F199-V203 VanDerWaalsContact O-CG2 3.22Å; F199-V203 WeakPolarHBondContact O-CG2 3.1Å; F199-V203 PolarHBondContact O-N 3.25Å
200	D	74.9	Confident	73.7	Confident	24 Å²	24	59.9 Å²	59.9	13%	0.128	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-45.8	174.2	-72.6	-17.2	0	0	0	109.8	Y190 H196 L202 V203 D204	Y190-D200 HydrophobicContact CE2-CB 4.41Å; H196-D200 PolarHBondContact O-N 3.39Å; D200-L202 PolarHBondContact O-N 2.73Å; D200-V203 PolarHBondContact O-N 3.02Å; D200-D204 VanDerWaalsContact O-CB 3.32Å; D200-D204 WeakPolarHBondContact O-CB 3.39Å; D200-D204 VanDerWaalsContact O-CG 3.25Å; D200-D204 PolarHBondContact O-N 2.8Å
201	N	79.9	Confident	73.6	Confident	101 Å²	101	60.8 Å²	60.8	54%	0.54	31%	0.309	S	S	.	.	H	α-helix	trans	-62.4	-39.9	173.2	-173.5	-1.6	0	0	0	112.5	A197 F199 D204 K205	A197-N201 WeakPolarHBondContact O-CB 3.17Å; A197-N201 PolarHBondContact O-N 3.45Å; F199-N201 VanDerWaalsContact C-N 3.33Å; N201-D204 PolarHBondContact O-N 2.92Å; N201-K205 WeakPolarHBondContact O-CB 3.35Å; N201-K205 PolarHBondContact O-N 2.89Å
202	L	76.8	Confident	73.9	Confident	5 Å²	5	60.4 Å²	60.4	3%	0.026	30%	0.304	C	S	.	.	H	α-helix	trans	-60.6	-48.2	174.7	176.4	61.6	0	0	0	111.3	Y198 F199 D200 K205 L206 F303 M306 M310	Y198-L202 WeakPolarHBondContact O-CB 3.34Å; Y198-L202 PolarHBondContact O-N 2.92Å; F199-L202 HydrophobicContact CD1-CD2 4.22Å; F199-L202 WeakPolarHBondContact O-CB 3.43Å; F199-L202 PolarHBondContact O-N 3.03Å; D200-L202 PolarHBondContact O-N 2.73Å; L202-K205 PolarHBondContact O-N 2.85Å; L202-L206 HydrophobicContact CD1-CD1 4.12Å; L202-L206 HydrophobicContact CD1-CG 4.34Å; L202-L206 HydrophobicContact CG-CD1 4.01Å; L202-L206 VanDerWaalsContact O-CB 3.27Å; L202-L206 WeakPolarHBondContact O-CB 3.47Å; L202-L206 VanDerWaalsContact O-CG 3.29Å; L202-L206 WeakPolarHBondContact O-CG 2.89Å; L202-L206 PolarHBondContact O-N 3.45Å; L202-F303 HydrophobicContact CD2-CE2 4.33Å; L202-M306 HydrophobicContact CD1-CB 4.07Å; L202-M306 HydrophobicContact CD1-SD 3.98Å; L202-M310 HydrophobicContact CD1-CE 4.19Å; L202-M310 HydrophobicContact CD1-CG 3.86Å
203	V	77.9	Confident	73.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64.9	-42.8	179.7	170	0	0	0	0	110	Y182 Y185 V186 Y190 F199 D200 L206 Q207	Y182-V203 HydrophobicContact CE2-CG2 4.45Å; Y185-V203 HydrophobicContact CD1-CG2 3.97Å; Y185-V203 HydrophobicContact CE1-CG2 3.89Å; V186-V203 HydrophobicContact CG2-CG1 4.32Å; Y190-V203 HydrophobicContact CD2-CB 3.79Å; Y190-V203 HydrophobicContact CD2-CG1 3.44Å; Y190-V203 VanDerWaalsContact CD2-CG1 3.44Å; Y190-V203 HydrophobicContact CD2-CG2 4.22Å; Y190-V203 HydrophobicContact CE2-CB 3.72Å; Y190-V203 HydrophobicContact CE2-CG1 3.36Å; Y190-V203 HydrophobicContact CG-CG1 4.13Å; F199-V203 VanDerWaalsContact O-CB 3.32Å; F199-V203 WeakPolarHBondContact O-CB 3.38Å; F199-V203 VanDerWaalsContact O-CG2 3.22Å; F199-V203 WeakPolarHBondContact O-CG2 3.1Å; F199-V203 PolarHBondContact O-N 3.25Å; D200-V203 PolarHBondContact O-N 3.02Å; V203-L206 PolarHBondContact O-N 3.27Å; V203-Q207 HydrophobicContact CG1-CG 4.34Å; V203-Q207 VanDerWaalsContact O-CB 3.28Å; V203-Q207 WeakPolarHBondContact O-CB 3.09Å; V203-Q207 WeakPolarHBondContact O-CG 3.13Å; V203-Q207 PolarHBondContact O-N 3.28Å
204	D	82.9	Confident	73.8	Confident	46 Å²	46	55.8 Å²	55.8	25%	0.246	28%	0.283	C	S	.	.	H	α-helix	trans	-61.2	-47.2	174.4	-78.4	-24.5	0	0	0	112.2	Y190 D200 N201 L206 Q207 S208 S258	Y190-D204 PolarHBondContact OH-OD1 2.81Å; D200-D204 VanDerWaalsContact O-CB 3.32Å; D200-D204 WeakPolarHBondContact O-CB 3.39Å; D200-D204 VanDerWaalsContact O-CG 3.25Å; D200-D204 PolarHBondContact O-N 2.8Å; N201-D204 PolarHBondContact O-N 2.92Å; D204-L206 VanDerWaalsContact C-N 3.34Å; D204-L206 PolarHBondContact O-N 3.41Å; D204-Q207 PolarHBondContact O-N 2.84Å; D204-S208 VanDerWaalsContact O-CB 3.23Å; D204-S208 WeakPolarHBondContact O-CB 3.45Å; D204-S208 PolarHBondContact O-N 3.41Å; D204-S258 PolarHBondContact OD1-OG 3.44Å
205	K	82.2	Confident	73.9	Confident	119 Å²	119	50.6 Å²	50.6	52%	0.517	26%	0.263	S	S	.	.	H	α-helix	trans	-65.4	-39.5	178.7	-168.5	178	-175.3	170.9	0	111.7	N201 L202 S209 M306	N201-K205 WeakPolarHBondContact O-CB 3.35Å; N201-K205 PolarHBondContact O-N 2.89Å; L202-K205 PolarHBondContact O-N 2.85Å; K205-S209 VanDerWaalsContact O-CB 3.25Å; K205-S209 WeakPolarHBondContact O-CB 3.34Å; K205-S209 PolarHBondContact O-N 3.16Å; K205-S209 PolarHBondContact O-OG 2.87Å; K205-M306 HydrophobicContact CD-CE 4.19Å; K205-M306 HydrophobicContact CD-SD 4.41Å; K205-M306 HydrophobicContact CG-CE 3.86Å; K205-M306 HydrophobicContact CG-SD 4.37Å
206	L	77.3	Confident	74	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-63	-54.2	173.8	-84.3	168	0	0	0	110.7	Y182 L202 V203 D204 S208 S209 Y210 F303 M306	Y182-L206 HydrophobicContact CE2-CD1 4.33Å; L202-L206 HydrophobicContact CD1-CD1 4.12Å; L202-L206 HydrophobicContact CD1-CG 4.34Å; L202-L206 HydrophobicContact CG-CD1 4.01Å; L202-L206 VanDerWaalsContact O-CB 3.27Å; L202-L206 WeakPolarHBondContact O-CB 3.47Å; L202-L206 VanDerWaalsContact O-CG 3.29Å; L202-L206 WeakPolarHBondContact O-CG 2.89Å; L202-L206 PolarHBondContact O-N 3.45Å; V203-L206 PolarHBondContact O-N 3.27Å; D204-L206 VanDerWaalsContact C-N 3.34Å; D204-L206 PolarHBondContact O-N 3.41Å; L206-S208 VanDerWaalsContact C-N 3.3Å; L206-S208 PolarHBondContact O-N 3.43Å; L206-S209 WeakPolarHBondContact CA-OG 3.22Å; L206-S209 PolarHBondContact O-N 3.3Å; L206-S209 VanDerWaalsContact O-N 3.1Å; L206-S209 PolarHBondContact O-OG 3.49Å; L206-Y210 HydrophobicContact CD2-CD2 4.25Å; L206-Y210 HydrophobicContact CD2-CE2 4.06Å; L206-Y210 WeakPolarHBondContact O-CB 3.32Å; L206-Y210 VanDerWaalsContact O-CD2 3.27Å; L206-Y210 WeakPolarHBondContact O-CD2 3.01Å; L206-Y210 PolarHBondContact O-N 3.4Å; L206-F303 HydrophobicContact CD1-CB 4.3Å; L206-F303 HydrophobicContact CD1-CD2 3.25Å; L206-F303 HydrophobicContact CD1-CE2 3.83Å; L206-F303 HydrophobicContact CD1-CG 4.15Å; L206-M306 HydrophobicContact CD2-CB 3.95Å; L206-M306 HydrophobicContact CD2-CE 4.2Å; L206-M306 HydrophobicContact CD2-CG 3.99Å; L206-M306 HydrophobicContact CD2-SD 3.51Å; L206-M306 VanDerWaalsContact CD2-SD 3.51Å; L206-M306 HydrophobicContact CG-CB 4.41Å; L206-M306 HydrophobicContact CG-CE 4.47Å; L206-M306 HydrophobicContact CG-CG 4.49Å; L206-M306 HydrophobicContact CG-SD 3.52Å; L206-M306 VanDerWaalsContact CG-SD 3.52Å
207	Q	79.3	Confident	73.3	Confident	6 Å²	6	45.5 Å²	45.5	3%	0.028	26%	0.256	C	S	.	.	H	α-helix	trans	-54.3	-49.3	178.4	-75.1	173.4	24.6	0	0	110.8	V203 D204 S209 Y210 S211 C212 Y230	V203-Q207 HydrophobicContact CG1-CG 4.34Å; V203-Q207 VanDerWaalsContact O-CB 3.28Å; V203-Q207 WeakPolarHBondContact O-CB 3.09Å; V203-Q207 WeakPolarHBondContact O-CG 3.13Å; V203-Q207 PolarHBondContact O-N 3.28Å; D204-Q207 PolarHBondContact O-N 2.84Å; Q207-S209 PolarHBondContact O-N 2.86Å; Q207-Y210 CarbonylContact O-C 3.46Å; Q207-Y210 PolarHBondContact O-N 2.93Å; Q207-S211 PolarHBondContact O-N 3.23Å; Q207-S211 VanDerWaalsContact O-N 3.08Å; Q207-C212 WeakPolarHBondContact O-CA 3.46Å; Q207-C212 PolarHBondContact O-N 3.2Å; Q207-C212 PolarHBondContact O-SG 3.04Å; Q207-Y230 PolarHBondContact NE2-OH 2.78Å; Q207-Y230 PolarHBondContact OE1-OH 3.45Å
208	S	79.6	Confident	72.8	Confident	51 Å²	51	48 Å²	48	36%	0.357	26%	0.255	S	S	.	.	H	α-helix	trans	-56.8	-48.8	175	-172.7	0	0	0	0	112.3	D204 L206 Y210 S211 S258	D204-S208 VanDerWaalsContact O-CB 3.23Å; D204-S208 WeakPolarHBondContact O-CB 3.45Å; D204-S208 PolarHBondContact O-N 3.41Å; L206-S208 VanDerWaalsContact C-N 3.3Å; L206-S208 PolarHBondContact O-N 3.43Å; S208-Y210 PolarHBondContact O-N 2.93Å; S208-S211 PolarHBondContact O-N 3.09Å; S208-S211 VanDerWaalsContact O-N 3.1Å; S208-S258 WeakPolarHBondContact CB-O 3.32Å; S208-S258 PolarHBondContact OG-O 2.79Å
209	S	78.4	Confident	72.1	Confident	66 Å²	66	47.8 Å²	47.8	46%	0.462	27%	0.265	S	S	.	.	H	α-helix	trans	-64.7	-26.4	179.1	70.8	0	0	0	0	114	K205 L206 Q207	K205-S209 VanDerWaalsContact O-CB 3.25Å; K205-S209 WeakPolarHBondContact O-CB 3.34Å; K205-S209 PolarHBondContact O-N 3.16Å; K205-S209 PolarHBondContact O-OG 2.87Å; L206-S209 WeakPolarHBondContact CA-OG 3.22Å; L206-S209 PolarHBondContact O-N 3.3Å; L206-S209 VanDerWaalsContact O-N 3.1Å; L206-S209 PolarHBondContact O-OG 3.49Å; Q207-S209 PolarHBondContact O-N 2.86Å
210	Y	74.5	Confident	71.7	Confident	54 Å²	54	53.8 Å²	53.8	21%	0.212	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	22.2	177.5	-74.7	-82.6	0	0	0	112.6	L206 Q207 S208 C212 C213 I299 G302	L206-Y210 HydrophobicContact CD2-CD2 4.25Å; L206-Y210 HydrophobicContact CD2-CE2 4.06Å; L206-Y210 WeakPolarHBondContact O-CB 3.32Å; L206-Y210 VanDerWaalsContact O-CD2 3.27Å; L206-Y210 WeakPolarHBondContact O-CD2 3.01Å; L206-Y210 PolarHBondContact O-N 3.4Å; Q207-Y210 CarbonylContact O-C 3.46Å; Q207-Y210 PolarHBondContact O-N 2.93Å; S208-Y210 PolarHBondContact O-N 2.93Å; Y210-C212 PolarHBondContact O-N 3.4Å; Y210-C212 VanDerWaalsContact O-N 3.09Å; Y210-C213 PolarHBondContact O-N 3.4Å; Y210-C213 PolarHBondContact O-SG 3.24Å; Y210-I299 HydrophobicContact CD1-CG1 3.89Å; Y210-I299 HydrophobicContact CD2-CG1 4.39Å; Y210-I299 HydrophobicContact CG-CG1 3.7Å; Y210-G302 VanDerWaalsContact CE2-CA 3.4Å; Y210-G302 WeakPolarHBondContact OH-CA 3.28Å; Y210-G302 PolarHBondContact OH-N 3.02Å
211	S	75.8	Confident	71.1	Confident	26 Å²	26	55.2 Å²	55.2	18%	0.182	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	34.7	175	-68.8	0	0	0	0	113	Q207 S208 C213 H291	Q207-S211 PolarHBondContact O-N 3.23Å; Q207-S211 VanDerWaalsContact O-N 3.08Å; S208-S211 PolarHBondContact O-N 3.09Å; S208-S211 VanDerWaalsContact O-N 3.1Å; S211-C213 VanDerWaalsContact C-N 3.26Å; S211-C213 PolarHBondContact O-N 2.92Å; S211-C213 VanDerWaalsContact O-N 3.15Å; S211-H291 CarbonylContact O-C 3.49Å; S211-H291 WeakPolarHBondContact O-CB 3.45Å
212	C	78.1	Confident	70.9	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.02	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	45.4	176.8	-72.4	0	0	0	0	115.1	Q207 Y210 G214 H226 C259 I290	Q207-C212 WeakPolarHBondContact O-CA 3.46Å; Q207-C212 PolarHBondContact O-N 3.2Å; Q207-C212 PolarHBondContact O-SG 3.04Å; Y210-C212 PolarHBondContact O-N 3.4Å; Y210-C212 VanDerWaalsContact O-N 3.09Å; C212-G214 PolarHBondContact O-N 2.94Å; C212-H226 PolarHBondContact O-CE1 3.42Å; C212-H226 PolarHBondContact O-ND1 2.78Å; C212-C259 HydrophobicContact CB-CB 3.44Å; C212-C259 VanDerWaalsContact CB-CB 3.44Å; C212-C259 WeakPolarHBondContact CB-SG 3.37Å; C212-C259 WeakPolarHBondContact SG-CA 3.29Å; C212-C259 WeakPolarHBondContact SG-CB 3.39Å; C212-C259 CovalentContact SG-SG 2.02Å; C212-C259 PolarHBondContact SG-SG 3.15Å; C212-I290 HydrophobicContact CB-CG2 4.26Å
213	C	68.6	Low	71.3	Confident	17 Å²	17	51.4 Å²	51.4	12%	0.115	28%	0.283	C	S	.	.			trans	-72.1	0.3	-177.3	-74.7	0	0	0	0	115.4	Y210 S211 G294 C295 I299	Y210-C213 PolarHBondContact O-N 3.4Å; Y210-C213 PolarHBondContact O-SG 3.24Å; S211-C213 VanDerWaalsContact C-N 3.26Å; S211-C213 PolarHBondContact O-N 2.92Å; S211-C213 VanDerWaalsContact O-N 3.15Å; C213-G294 VanDerWaalsContact SG-C 3.56Å; C213-C295 VanDerWaalsContact CA-SG 3.59Å; C213-C295 HydrophobicContact CB-CB 3.63Å; C213-C295 WeakPolarHBondContact CB-SG 2.85Å; C213-C295 WeakPolarHBondContact SG-CA 3.23Å; C213-C295 WeakPolarHBondContact SG-CB 3.41Å; C213-C295 PolarHBondContact SG-N 2.93Å; C213-C295 CovalentContact SG-SG 2.03Å; C213-C295 PolarHBondContact SG-SG 2.85Å; C213-I299 HydrophobicContact CB-CD1 4.23Å
214	G	64.2	Low	71.6	Confident	7 Å²	7	52.4 Å²	52.4	7%	0.072	29%	0.287	C	S	.	.			trans	62.3	168.7	-170.6	0	0	0	0	0	110.9	C212 H226 I299	C212-G214 PolarHBondContact O-N 2.94Å; G214-H226 PolarHBondContact N-ND1 3.45Å; G214-I299 WeakPolarHBondContact O-CD1 3.41Å
215	F	62.3	Low	71.7	Confident	27 Å²	27	56 Å²	56	12%	0.118	30%	0.298	C	S	.	.	S	Bend	trans	-66.9	-41.5	179.9	176.2	-84.6	0	0	0	111.8	E179 Y182 K183 A217 V300	E179-F215 HydrophobicContact CG-CE2 3.69Å; E179-F215 HydrophobicContact CG-CZ 3.57Å; E179-F215 WeakPolarHBondContact OE1-CZ 3.42Å; Y182-F215 AromaticContact CD1-CD2 3.69Å; Y182-F215 HydrophobicContact CD1-CD2 3.69Å; Y182-F215 HydrophobicContact CD1-CE2 4.21Å; Y182-F215 AromaticContact CE1-CD2 3.94Å; Y182-F215 HydrophobicContact CE1-CD2 3.94Å; K183-F215 HydrophobicContact CD-CD1 3.47Å; K183-F215 VanDerWaalsContact CD-CD1 3.47Å; K183-F215 HydrophobicContact CD-CD2 4.24Å; K183-F215 HydrophobicContact CD-CE1 3.15Å; K183-F215 HydrophobicContact CD-CE2 3.9Å; K183-F215 HydrophobicContact CD-CG 4.09Å; K183-F215 HydrophobicContact CD-CZ 3.42Å; K183-F215 VanDerWaalsContact CD-CZ 3.42Å; K183-F215 HydrophobicContact CG-CD1 3.37Å; K183-F215 HydrophobicContact CG-CD2 3.36Å; K183-F215 HydrophobicContact CG-CE1 3.43Å; K183-F215 VanDerWaalsContact CG-CE1 3.43Å; K183-F215 HydrophobicContact CG-CE2 3.32Å; K183-F215 HydrophobicContact CG-CG 3.43Å; K183-F215 VanDerWaalsContact CG-CG 3.43Å; K183-F215 HydrophobicContact CG-CZ 3.43Å; K183-F215 VanDerWaalsContact CG-CZ 3.43Å; F215-A217 PolarHBondContact O-N 3.03Å; F215-V300 HydrophobicContact CE2-CG2 4.35Å
216	D	62.8	Low	71.8	Confident	99 Å²	99	50.8 Å²	50.8	53%	0.529	28%	0.276	S	S	.	.	S	Bend	trans	-86	92.8	178.9	-71	-35.5	0	0	0	109.2	Q218	D216-Q218 PolarHBondContact O-N 3.19Å
217	A	54.1	Low	72.4	Confident	62 Å²	62	50.8 Å²	50.8	51%	0.512	28%	0.276	S	S	.	.			trans	-60.4	65.6	175.6	0	0	0	0	0	112.4	F215 P219	F215-A217 PolarHBondContact O-N 3.03Å; A217-P219 WeakPolarHBondContact O-CD 3.14Å
218	Q	61.5	Low	72.8	Confident	126 Å²	126	52.3 Å²	52.3	59%	0.589	28%	0.284	S	S	*	.			trans	-94.2	82.5	166	-66.6	-162.6	19.5	0	0	107.9	D216 K220 L221	D216-Q218 PolarHBondContact O-N 3.19Å; Q218-K220 PolarHBondContact O-N 3.46Å; Q218-L221 HydrophobicContact CB-CD1 4.15Å; Q218-L221 PolarHBondContact O-N 2.93Å
219	P	54.4	Low	73.1	Confident	88 Å²	88	51.7 Å²	51.7	57%	0.571	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-59.3	-17.2	-175.1	24.6	-36.8	0	0	0	113.3	A217 L221 C295	A217-P219 WeakPolarHBondContact O-CD 3.14Å; P219-L221 VanDerWaalsContact C-N 3.3Å; P219-L221 PolarHBondContact O-N 3.03Å; P219-C295 HydrophobicContact CB-CB 4.27Å
220	K	59.9	Low	73.6	Confident	201 Å²	201	48.7 Å²	48.7	87%	0.874	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-74.8	-18.4	-176.8	-65.8	-171.2	178.2	-177.3	0	113.9	Q218	Q218-K220 PolarHBondContact O-N 3.46Å
221	L	62.7	Low	74.3	Confident	55 Å²	55	46.2 Å²	46.2	29%	0.288	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-103.6	-2.3	-167.1	-76.6	170.6	0	0	0	114	Q218 P219 Y225	Q218-L221 HydrophobicContact CB-CD1 4.15Å; Q218-L221 PolarHBondContact O-N 2.93Å; P219-L221 VanDerWaalsContact C-N 3.3Å; P219-L221 PolarHBondContact O-N 3.03Å; L221-Y225 HydrophobicContact CB-CD1 4.24Å; L221-Y225 HydrophobicContact CB-CD2 3.41Å; L221-Y225 VanDerWaalsContact CB-CD2 3.41Å; L221-Y225 HydrophobicContact CB-CE2 3.87Å; L221-Y225 HydrophobicContact CB-CG 3.57Å; L221-Y225 HydrophobicContact CD1-CD1 3.84Å; L221-Y225 HydrophobicContact CD1-CD2 4.21Å; L221-Y225 HydrophobicContact CD1-CE1 3.71Å; L221-Y225 HydrophobicContact CD1-CE2 4.07Å; L221-Y225 HydrophobicContact CD1-CG 4.05Å; L221-Y225 HydrophobicContact CD2-CD2 3.7Å; L221-Y225 HydrophobicContact CD2-CE1 4.23Å; L221-Y225 HydrophobicContact CD2-CE2 3.13Å; L221-Y225 HydrophobicContact CD2-CG 4.38Å; L221-Y225 VanDerWaalsContact CD2-CZ 3.43Å; L221-Y225 HydrophobicContact CG-CD1 4.44Å; L221-Y225 HydrophobicContact CG-CD2 3.92Å; L221-Y225 HydrophobicContact CG-CE1 4.38Å; L221-Y225 HydrophobicContact CG-CE2 3.83Å; L221-Y225 HydrophobicContact CG-CG 4.18Å; L221-Y225 WeakPolarHBondContact O-CD2 3.46Å
222	G	75.2	Confident	74.8	Confident	22 Å²	22	48.1 Å²	48.1	23%	0.227	25%	0.251	C	S	.	.	H	α-helix	trans	67.2	-168.7	167.3	0	0	0	0	0	115.2	Y224	G222-Y224 PolarHBondContact O-N 3.45Å
223	A	84.7	Confident	74.9	Confident	3 Å²	3	52.8 Å²	52.8	3%	0.025	28%	0.275	C	S	.	.	H	α-helix	trans	-62.5	-29.3	178.4	0	0	0	0	0	113.4	Y225 H226 V227 W286 N287 I290 V292	A223-Y225 PolarHBondContact O-N 3.23Å; A223-H226 VanDerWaalsContact O-CB 3.3Å; A223-H226 WeakPolarHBondContact O-CB 3.49Å; A223-H226 PolarHBondContact O-N 3.29Å; A223-V227 WeakPolarHBondContact O-CG2 3.25Å; A223-V227 PolarHBondContact O-N 2.97Å; A223-W286 VanDerWaalsContact CB-C 3.48Å; A223-W286 HydrophobicContact CB-CB 3.98Å; A223-W286 WeakPolarHBondContact CB-O 2.99Å; A223-N287 WeakPolarHBondContact CB-OD1 3.17Å; A223-N287 PolarHBondContact N-OD1 3.05Å; A223-I290 HydrophobicContact CB-CB 3.71Å; A223-I290 HydrophobicContact CB-CG1 4.42Å; A223-I290 HydrophobicContact CB-CG2 4.05Å; A223-V292 HydrophobicContact CB-CG2 3.94Å
224	Y	86.2	Confident	75.5	Confident	21 Å²	21	52 Å²	52	8%	0.082	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-42.3	-177.1	175.9	-106.6	0	0	0	112.8	G222 H226 V227 I228 R275 F276 D277 G278 I283	G222-Y224 PolarHBondContact O-N 3.45Å; Y224-H226 VanDerWaalsContact C-N 3.28Å; Y224-H226 PolarHBondContact O-N 2.85Å; Y224-V227 WeakPolarHBondContact O-CB 3.41Å; Y224-V227 PolarHBondContact O-N 2.8Å; Y224-I228 HydrophobicContact CD1-CD1 3.92Å; Y224-I228 HydrophobicContact CE1-CD1 3.35Å; Y224-I228 HydrophobicContact CE1-CG1 4.34Å; Y224-I228 HydrophobicContact CE2-CD1 4.39Å; Y224-I228 PolarHBondContact O-N 3.48Å; Y224-R275 PolarHBondContact OH-O 2.61Å; Y224-F276 WeakPolarHBondContact OH-CA 3.39Å; Y224-F276 PolarHBondContact OH-O 3.02Å; Y224-D277 VanDerWaalsContact CE2-O 3.25Å; Y224-D277 WeakPolarHBondContact CE2-O 3.24Å; Y224-G278 PolarHBondContact OH-N 2.69Å; Y224-I283 HydrophobicContact CD1-CG1 4.28Å; Y224-I283 HydrophobicContact CD2-CG1 4.42Å; Y224-I283 HydrophobicContact CG-CG1 4.01Å
225	Y	84	Confident	76.2	Confident	122 Å²	122	53.3 Å²	53.3	48%	0.478	28%	0.275	S	S	.	.	H	α-helix	trans	-69.4	-29	176.1	-90.4	-103.4	0	0	0	113	L221 A223 I228 H229	L221-Y225 HydrophobicContact CB-CD1 4.24Å; L221-Y225 HydrophobicContact CB-CD2 3.41Å; L221-Y225 VanDerWaalsContact CB-CD2 3.41Å; L221-Y225 HydrophobicContact CB-CE2 3.87Å; L221-Y225 HydrophobicContact CB-CG 3.57Å; L221-Y225 HydrophobicContact CD1-CD1 3.84Å; L221-Y225 HydrophobicContact CD1-CD2 4.21Å; L221-Y225 HydrophobicContact CD1-CE1 3.71Å; L221-Y225 HydrophobicContact CD1-CE2 4.07Å; L221-Y225 HydrophobicContact CD1-CG 4.05Å; L221-Y225 HydrophobicContact CD2-CD2 3.7Å; L221-Y225 HydrophobicContact CD2-CE1 4.23Å; L221-Y225 HydrophobicContact CD2-CE2 3.13Å; L221-Y225 HydrophobicContact CD2-CG 4.38Å; L221-Y225 VanDerWaalsContact CD2-CZ 3.43Å; L221-Y225 HydrophobicContact CG-CD1 4.44Å; L221-Y225 HydrophobicContact CG-CD2 3.92Å; L221-Y225 HydrophobicContact CG-CE1 4.38Å; L221-Y225 HydrophobicContact CG-CE2 3.83Å; L221-Y225 HydrophobicContact CG-CG 4.18Å; L221-Y225 WeakPolarHBondContact O-CD2 3.46Å; A223-Y225 PolarHBondContact O-N 3.23Å; Y225-I228 PolarHBondContact O-N 2.77Å; Y225-H229 WeakPolarHBondContact O-CB 3.48Å; Y225-H229 PolarHBondContact O-N 2.83Å
226	H	84.2	Confident	77.4	Confident	10 Å²	10	53.6 Å²	53.6	5%	0.046	28%	0.276	C	S	.	.	H	α-helix	trans	-63	-46.2	171.5	176.9	89.3	0	0	0	110.6	C212 G214 A223 Y224 I228 H229 Y230 T255 C259	C212-H226 PolarHBondContact O-CE1 3.42Å; C212-H226 PolarHBondContact O-ND1 2.78Å; G214-H226 PolarHBondContact N-ND1 3.45Å; A223-H226 VanDerWaalsContact O-CB 3.3Å; A223-H226 WeakPolarHBondContact O-CB 3.49Å; A223-H226 PolarHBondContact O-N 3.29Å; Y224-H226 VanDerWaalsContact C-N 3.28Å; Y224-H226 PolarHBondContact O-N 2.85Å; H226-I228 VanDerWaalsContact C-N 3.32Å; H226-I228 PolarHBondContact O-N 3.08Å; H226-H229 PolarHBondContact O-N 3.25Å; H226-H229 VanDerWaalsContact O-N 3.1Å; H226-Y230 AromaticContact CD2-CD2 3.97Å; H226-Y230 AromaticContact CE1-CD2 3.46Å; H226-Y230 VanDerWaalsContact CE1-CD2 3.46Å; H226-Y230 WeakPolarHBondContact CE1-CD2 3.21Å; H226-Y230 AromaticContact CE1-CE2 2.97Å; H226-Y230 WeakPolarHBondContact CE1-CE2 3.4Å; H226-Y230 AromaticContact CE1-CZ 3.73Å; H226-Y230 AromaticContact ND1-CD2 3.76Å; H226-Y230 AromaticContact ND1-CE2 3.41Å; H226-Y230 WeakPolarHBondContact ND1-CE2 3.08Å; H226-Y230 AromaticContact NE2-CD2 3.56Å; H226-Y230 AromaticContact NE2-CE2 3.52Å; H226-Y230 WeakPolarHBondContact O-CD2 3.21Å; H226-Y230 PolarHBondContact O-N 2.88Å; H226-T255 PolarHBondContact CD2-OG1 3.34Å; H226-T255 PolarHBondContact NE2-OG1 2.62Å; H226-C259 PolarHBondContact NE2-SG 3.39Å; H226-C259 VanDerWaalsContact NE2-SG 3.41Å
227	V	89.8	Confident	78.6	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-55.8	-45.4	173.7	173.9	0	0	0	0	111.5	A223 Y224 S231 L254 R275 W286	A223-V227 WeakPolarHBondContact O-CG2 3.25Å; A223-V227 PolarHBondContact O-N 2.97Å; Y224-V227 WeakPolarHBondContact O-CB 3.41Å; Y224-V227 PolarHBondContact O-N 2.8Å; V227-S231 VanDerWaalsContact O-CB 3.31Å; V227-S231 WeakPolarHBondContact O-CB 3.5Å; V227-S231 PolarHBondContact O-N 3.1Å; V227-S231 PolarHBondContact O-OG 3.1Å; V227-L254 HydrophobicContact CG1-CB 3.62Å; V227-L254 HydrophobicContact CG1-CD1 3.89Å; V227-L254 HydrophobicContact CG1-CG 4.38Å; V227-R275 HydrophobicContact CG1-CB 4.39Å; V227-W286 HydrophobicContact CG1-CZ2 4.33Å; V227-W286 HydrophobicContact CG2-CD2 3.57Å; V227-W286 HydrophobicContact CG2-CE3 3.43Å; V227-W286 VanDerWaalsContact CG2-CE3 3.43Å; V227-W286 HydrophobicContact CG2-CG 4.09Å; V227-W286 HydrophobicContact CG2-CH2 4.33Å; V227-W286 HydrophobicContact CG2-CZ2 4.45Å; V227-W286 HydrophobicContact CG2-CZ3 3.83Å
228	I	88.5	Confident	80.1	Confident	38 Å²	38	47.3 Å²	47.3	20%	0.195	23%	0.233	C	C	.	.	H	α-helix	trans	-61.7	-46.4	175	-67	169.5	0	0	0	111.1	Y224 Y225 H226 Y230 S231 E232 R275	Y224-I228 HydrophobicContact CD1-CD1 3.92Å; Y224-I228 HydrophobicContact CE1-CD1 3.35Å; Y224-I228 HydrophobicContact CE1-CG1 4.34Å; Y224-I228 HydrophobicContact CE2-CD1 4.39Å; Y224-I228 PolarHBondContact O-N 3.48Å; Y225-I228 PolarHBondContact O-N 2.77Å; H226-I228 VanDerWaalsContact C-N 3.32Å; H226-I228 PolarHBondContact O-N 3.08Å; I228-Y230 PolarHBondContact O-N 3.4Å; I228-S231 WeakPolarHBondContact CA-OG 3.34Å; I228-S231 PolarHBondContact O-N 2.83Å; I228-S231 PolarHBondContact O-OG 3.39Å; I228-E232 HydrophobicContact CG2-CG 4.35Å; I228-E232 VanDerWaalsContact O-CB 3.31Å; I228-E232 WeakPolarHBondContact O-CB 3.36Å; I228-E232 PolarHBondContact O-N 3.35Å; I228-R275 WeakPolarHBondContact CG1-O 3.45Å
229	H	85.9	Confident	81.3	Confident	39 Å²	39	43 Å²	43	18%	0.181	21%	0.214	C	C	.	.	H	α-helix	trans	-60.3	-47	-177.7	179.8	88.3	0	0	0	111.7	Y225 H226 N233	Y225-H229 WeakPolarHBondContact O-CB 3.48Å; Y225-H229 PolarHBondContact O-N 2.83Å; H226-H229 PolarHBondContact O-N 3.25Å; H226-H229 VanDerWaalsContact O-N 3.1Å; H229-N233 WeakPolarHBondContact O-CA 3.46Å; H229-N233 VanDerWaalsContact O-CB 3.28Å; H229-N233 WeakPolarHBondContact O-CB 3.4Å; H229-N233 PolarHBondContact O-N 3.17Å
230	Y	87.7	Confident	83	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-66.2	-50	178.2	-83.4	-95.7	0	0	0	111.3	Y190 Q207 H226 I228 E232 T234 W236 G237 P256	Y190-Y230 HydrophobicContact CD1-CE1 4.32Å; Y190-Y230 HydrophobicContact CE1-CD1 4.28Å; Y190-Y230 AromaticContact CE1-CE1 3.93Å; Y190-Y230 HydrophobicContact CE1-CE1 3.93Å; Q207-Y230 PolarHBondContact NE2-OH 2.78Å; Q207-Y230 PolarHBondContact OE1-OH 3.45Å; H226-Y230 AromaticContact CD2-CD2 3.97Å; H226-Y230 AromaticContact CE1-CD2 3.46Å; H226-Y230 VanDerWaalsContact CE1-CD2 3.46Å; H226-Y230 WeakPolarHBondContact CE1-CD2 3.21Å; H226-Y230 AromaticContact CE1-CE2 2.97Å; H226-Y230 WeakPolarHBondContact CE1-CE2 3.4Å; H226-Y230 AromaticContact CE1-CZ 3.73Å; H226-Y230 AromaticContact ND1-CD2 3.76Å; H226-Y230 AromaticContact ND1-CE2 3.41Å; H226-Y230 WeakPolarHBondContact ND1-CE2 3.08Å; H226-Y230 AromaticContact NE2-CD2 3.56Å; H226-Y230 AromaticContact NE2-CE2 3.52Å; H226-Y230 WeakPolarHBondContact O-CD2 3.21Å; H226-Y230 PolarHBondContact O-N 2.88Å; I228-Y230 PolarHBondContact O-N 3.4Å; Y230-E232 VanDerWaalsContact C-N 3.32Å; Y230-E232 PolarHBondContact O-N 3.43Å; Y230-T234 HydrophobicContact CD1-CG2 4.14Å; Y230-T234 HydrophobicContact CE1-CG2 4.46Å; Y230-T234 HydrophobicContact CG-CG2 4.44Å; Y230-T234 PolarHBondContact O-OG1 2.95Å; Y230-W236 HydrophobicContact CD1-CE3 4.5Å; Y230-G237 VanDerWaalsContact O-CA 3.23Å; Y230-G237 WeakPolarHBondContact O-CA 3.49Å; Y230-G237 PolarHBondContact O-N 2.86Å; Y230-P256 HydrophobicContact CD1-CG 3.78Å; Y230-P256 HydrophobicContact CE1-CG 3.73Å
231	S	89.9	Confident	84.5	Confident	3 Å²	3	30.3 Å²	30.3	2%	0.021	15%	0.15	C	C	.	.	H	α-helix	trans	-64	-32.1	-176.9	57.9	0	0	0	0	114.1	V227 I228 G237	V227-S231 VanDerWaalsContact O-CB 3.31Å; V227-S231 WeakPolarHBondContact O-CB 3.5Å; V227-S231 PolarHBondContact O-N 3.1Å; V227-S231 PolarHBondContact O-OG 3.1Å; I228-S231 WeakPolarHBondContact CA-OG 3.34Å; I228-S231 PolarHBondContact O-N 2.83Å; I228-S231 PolarHBondContact O-OG 3.39Å; S231-G237 CarbonylContact O-C 3.54Å; S231-G237 VanDerWaalsContact O-C 3.29Å
232	E	85.3	Confident	85.7	Confident	66 Å²	66	28.8 Å²	28.8	31%	0.308	15%	0.146	S	C	.	.	H	α-helix	trans	-112.1	-28.3	-171.7	-62.4	-71.4	148	0	0	115	I228 Y230 R275 F276	I228-E232 HydrophobicContact CG2-CG 4.35Å; I228-E232 VanDerWaalsContact O-CB 3.31Å; I228-E232 WeakPolarHBondContact O-CB 3.36Å; I228-E232 PolarHBondContact O-N 3.35Å; Y230-E232 VanDerWaalsContact C-N 3.32Å; Y230-E232 PolarHBondContact O-N 3.43Å; E232-R275 IonicContact OE1-CZ 2.71Å; E232-R275 IonicContact OE1-NE 3.55Å; E232-R275 PolarHBondContact OE1-NE 3.48Å; E232-R275 IonicContact OE1-NH2 2.73Å; E232-R275 PolarHBondContact OE1-NH2 3.04Å; E232-F276 HydrophobicContact CG-CE1 4.47Å; E232-F276 VanDerWaalsContact OE1-CZ 3.3Å; E232-F276 WeakPolarHBondContact OE1-CZ 3.25Å
233	N	80.7	Confident	86.3	Confident	101 Å²	101	34.3 Å²	34.3	54%	0.54	16%	0.164	S	C	.	.	H	α-helix	trans	-111.3	-4.3	-172.1	-61.3	-47.7	0	0	0	114.4	H229	H229-N233 WeakPolarHBondContact O-CA 3.46Å; H229-N233 VanDerWaalsContact O-CB 3.28Å; H229-N233 WeakPolarHBondContact O-CB 3.4Å; H229-N233 PolarHBondContact O-N 3.17Å
234	T	82.2	Confident	86.6	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-110.6	147.1	175.7	75	0	0	0	0	110.6	V186 Y230 W236 G237 I238	V186-T234 HydrophobicContact CG1-CG2 4.19Å; Y230-T234 HydrophobicContact CD1-CG2 4.14Å; Y230-T234 HydrophobicContact CE1-CG2 4.46Å; Y230-T234 HydrophobicContact CG-CG2 4.44Å; Y230-T234 PolarHBondContact O-OG1 2.95Å; T234-W236 PolarHBondContact O-N 2.76Å; T234-G237 PolarHBondContact O-N 3.08Å; T234-G237 VanDerWaalsContact O-N 3.15Å; T234-G237 PolarHBondContact OG1-N 3.34Å; T234-G237 VanDerWaalsContact OG1-N 3.13Å; T234-I238 WeakPolarHBondContact O-CG1 3.27Å; T234-I238 PolarHBondContact O-N 3.42Å; T234-I238 VanDerWaalsContact O-N 3.12Å
235	N	79.2	Confident	86.8	Confident	35 Å²	35	42.6 Å²	42.6	19%	0.187	20%	0.202	C	C	.	.	H	α-helix	trans	-60.7	-31.4	173.4	-83.9	-6.5	0	0	0	112.4	H188 T192 L239	H188-N235 PolarHBondContact O-ND2 3.39Å; T192-N235 HydrophobicContact CG2-CB 3.88Å; N235-L239 WeakPolarHBondContact O-CB 3.32Å; N235-L239 PolarHBondContact O-N 3.22Å
236	W	87.2	Confident	87.1	Confident	33 Å²	33	40.1 Å²	40.1	13%	0.125	19%	0.192	C	C	.	.	H	α-helix	trans	-55.6	-52.3	171	-177.7	92.8	0	0	0	111.7	Y190 Y230 T234 L239 Q240 P253 T255	Y190-W236 HydrophobicContact CD1-CB 3.76Å; Y190-W236 HydrophobicContact CD1-CG 4.23Å; Y190-W236 HydrophobicContact CE1-CB 4.03Å; Y190-W236 AromaticContact CE1-CG 3.99Å; Y190-W236 HydrophobicContact CE1-CG 3.99Å; Y190-W236 PolarHBondContact O-N 3.31Å; Y190-W236 VanDerWaalsContact O-N 3.08Å; Y230-W236 HydrophobicContact CD1-CE3 4.5Å; T234-W236 PolarHBondContact O-N 2.76Å; W236-L239 WeakPolarHBondContact O-CB 3.28Å; W236-L239 PolarHBondContact O-N 2.92Å; W236-L239 VanDerWaalsContact O-N 3.17Å; W236-Q240 HydrophobicContact CD2-CG 4.16Å; W236-Q240 HydrophobicContact CE3-CG 4.16Å; W236-Q240 HydrophobicContact CH2-CG 3.96Å; W236-Q240 HydrophobicContact CZ2-CG 3.98Å; W236-Q240 HydrophobicContact CZ3-CG 4.05Å; W236-Q240 WeakPolarHBondContact O-CG 3.27Å; W236-Q240 PolarHBondContact O-N 3.45Å; W236-P253 HydrophobicContact CH2-CB 3.82Å; W236-P253 HydrophobicContact CH2-CG 4.17Å; W236-P253 VanDerWaalsContact CH2-O 3.22Å; W236-P253 WeakPolarHBondContact CH2-O 2.95Å; W236-P253 HydrophobicContact CZ2-CB 4.02Å; W236-P253 HydrophobicContact CZ2-CG 4.1Å; W236-T255 VanDerWaalsContact CH2-O 3.28Å; W236-T255 WeakPolarHBondContact CH2-O 2.99Å
237	G	88	Confident	87.5	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-66.9	-39.1	-178.5	0	0	0	0	0	113.6	Y230 S231 T234 L239 Q240 G241	Y230-G237 VanDerWaalsContact O-CA 3.23Å; Y230-G237 WeakPolarHBondContact O-CA 3.49Å; Y230-G237 PolarHBondContact O-N 2.86Å; S231-G237 CarbonylContact O-C 3.54Å; S231-G237 VanDerWaalsContact O-C 3.29Å; T234-G237 PolarHBondContact O-N 3.08Å; T234-G237 VanDerWaalsContact O-N 3.15Å; T234-G237 PolarHBondContact OG1-N 3.34Å; T234-G237 VanDerWaalsContact OG1-N 3.13Å; G237-L239 VanDerWaalsContact C-N 3.26Å; G237-L239 PolarHBondContact O-N 2.71Å; G237-Q240 PolarHBondContact O-N 3.35Å; G237-Q240 VanDerWaalsContact O-N 3.16Å; G237-G241 PolarHBondContact O-N 2.94Å
238	I	85.3	Confident	87.8	Confident	28 Å²	28	47.3 Å²	47.3	14%	0.144	23%	0.228	C	C	.	.	H	α-helix	trans	-59.2	-40.9	172.7	-65.5	169.8	0	0	0	110.3	T234 G241 A242 W246 F381	T234-I238 WeakPolarHBondContact O-CG1 3.27Å; T234-I238 PolarHBondContact O-N 3.42Å; T234-I238 VanDerWaalsContact O-N 3.12Å; I238-G241 PolarHBondContact O-N 2.84Å; I238-A242 VanDerWaalsContact O-CB 3.29Å; I238-A242 WeakPolarHBondContact O-CB 3.42Å; I238-A242 PolarHBondContact O-N 3.23Å; I238-W246 HydrophobicContact CG2-CH2 4.22Å; I238-W246 HydrophobicContact CG2-CZ2 4.38Å; I238-F381 HydrophobicContact CD1-CZ 4.46Å; I238-F381 HydrophobicContact CG2-CZ 4.15Å
239	L	86.8	Confident	88.2	Confident	34 Å²	34	52.5 Å²	52.5	18%	0.178	25%	0.252	C	S	.	.	H	α-helix	trans	-65.5	-39.6	176.8	-168.6	73.7	0	0	0	111.8	G191 N235 W236 G237 A242 K243	G191-L239 WeakPolarHBondContact O-CD2 3.23Å; N235-L239 WeakPolarHBondContact O-CB 3.32Å; N235-L239 PolarHBondContact O-N 3.22Å; W236-L239 WeakPolarHBondContact O-CB 3.28Å; W236-L239 PolarHBondContact O-N 2.92Å; W236-L239 VanDerWaalsContact O-N 3.17Å; G237-L239 VanDerWaalsContact C-N 3.26Å; G237-L239 PolarHBondContact O-N 2.71Å; L239-A242 PolarHBondContact O-N 3.48Å; L239-K243 WeakPolarHBondContact O-CB 3.14Å; L239-K243 VanDerWaalsContact O-CG 3.28Å; L239-K243 WeakPolarHBondContact O-CG 3.44Å; L239-K243 PolarHBondContact O-N 3.06Å
240	Q	90.3	Very high	88.7	Confident	23 Å²	23	51.8 Å²	51.8	11%	0.107	25%	0.252	C	S	.	.	H	α-helix	trans	-65	-44.1	175.3	-56.7	-53.7	-21.3	0	0	111.6	W236 G237 A242 K243 A244 P253	W236-Q240 HydrophobicContact CD2-CG 4.16Å; W236-Q240 HydrophobicContact CE3-CG 4.16Å; W236-Q240 HydrophobicContact CH2-CG 3.96Å; W236-Q240 HydrophobicContact CZ2-CG 3.98Å; W236-Q240 HydrophobicContact CZ3-CG 4.05Å; W236-Q240 WeakPolarHBondContact O-CG 3.27Å; W236-Q240 PolarHBondContact O-N 3.45Å; G237-Q240 PolarHBondContact O-N 3.35Å; G237-Q240 VanDerWaalsContact O-N 3.16Å; Q240-A242 PolarHBondContact O-N 2.79Å; Q240-K243 PolarHBondContact O-N 3.12Å; Q240-A244 PolarHBondContact O-N 2.95Å; Q240-P253 HydrophobicContact CG-CG 4.07Å
241	G	90.4	Very high	89.1	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-44.5	174.2	0	0	0	0	0	112.2	G237 I238 A244 K245 W246	G237-G241 PolarHBondContact O-N 2.94Å; I238-G241 PolarHBondContact O-N 2.84Å; G241-A244 CarbonylContact O-C 3.56Å; G241-A244 PolarHBondContact O-N 3.44Å; G241-K245 PolarHBondContact O-N 3.41Å; G241-W246 PolarHBondContact O-N 3.48Å
242	A	87.4	Confident	89.3	Confident	24 Å²	24	56.8 Å²	56.8	20%	0.198	28%	0.283	C	S	.	.	H	α-helix	trans	-63.7	-42.1	176.3	0	0	0	0	0	112.6	I238 L239 Q240 A244 K245 W246 Y379	I238-A242 VanDerWaalsContact O-CB 3.29Å; I238-A242 WeakPolarHBondContact O-CB 3.42Å; I238-A242 PolarHBondContact O-N 3.23Å; L239-A242 PolarHBondContact O-N 3.48Å; Q240-A242 PolarHBondContact O-N 2.79Å; A242-A244 VanDerWaalsContact C-N 3.3Å; A242-A244 PolarHBondContact O-N 3.23Å; A242-K245 WeakPolarHBondContact O-CA 3.39Å; A242-K245 PolarHBondContact O-N 2.65Å; A242-W246 HydrophobicContact CB-CZ2 4.29Å; A242-Y379 HydrophobicContact CB-CD1 4.39Å; A242-Y379 HydrophobicContact CB-CE1 3.88Å
243	K	88.5	Confident	89.8	Confident	138 Å²	138	55.3 Å²	55.3	60%	0.6	28%	0.279	S	S	*	.	H	α-helix	trans	-59.2	-40.3	174.7	-78.8	174.7	-179.1	177.6	0	112.1	L239 Q240 K245	L239-K243 WeakPolarHBondContact O-CB 3.14Å; L239-K243 VanDerWaalsContact O-CG 3.28Å; L239-K243 WeakPolarHBondContact O-CG 3.44Å; L239-K243 PolarHBondContact O-N 3.06Å; Q240-K243 PolarHBondContact O-N 3.12Å; K243-K245 PolarHBondContact O-N 3.37Å
244	A	91.3	Very high	90.5	Very high	15 Å²	15	50.6 Å²	50.6	12%	0.124	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	4.8	174.1	0	0	0	0	0	114.3	Q240 G241 A242 W246 N247 A250 V252	Q240-A244 PolarHBondContact O-N 2.95Å; G241-A244 CarbonylContact O-C 3.56Å; G241-A244 PolarHBondContact O-N 3.44Å; A242-A244 VanDerWaalsContact C-N 3.3Å; A242-A244 PolarHBondContact O-N 3.23Å; A244-W246 PolarHBondContact O-N 2.71Å; A244-W246 VanDerWaalsContact O-N 3.08Å; A244-N247 WeakPolarHBondContact O-CB 3.48Å; A244-N247 PolarHBondContact O-N 2.83Å; A244-A250 HydrophobicContact CB-CB 3.64Å; A244-V252 HydrophobicContact CB-CG1 3.44Å; A244-V252 VanDerWaalsContact CB-CG1 3.44Å
245	K	91	Very high	90.9	Very high	183 Å²	183	50.6 Å²	50.6	80%	0.796	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	30.2	-172.3	-56.9	-178.6	178.8	-179.5	0	112.4	G241 A242 K243 N247	G241-K245 PolarHBondContact O-N 3.41Å; A242-K245 WeakPolarHBondContact O-CA 3.39Å; A242-K245 PolarHBondContact O-N 2.65Å; K243-K245 PolarHBondContact O-N 3.37Å; K245-N247 PolarHBondContact O-N 2.93Å; K245-N247 VanDerWaalsContact O-N 3.09Å
246	W	89.1	Confident	91.4	Very high	70 Å²	70	49.1 Å²	49.1	27%	0.265	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	21.3	-175.4	-47.6	89.8	0	0	0	114	I238 G241 A242 A244 Q248 Y272	I238-W246 HydrophobicContact CG2-CH2 4.22Å; I238-W246 HydrophobicContact CG2-CZ2 4.38Å; G241-W246 PolarHBondContact O-N 3.48Å; A242-W246 HydrophobicContact CB-CZ2 4.29Å; A244-W246 PolarHBondContact O-N 2.71Å; A244-W246 VanDerWaalsContact O-N 3.08Å; W246-Q248 PolarHBondContact O-N 3.18Å; W246-Y272 HydrophobicContact CB-CE1 4.37Å; W246-Y272 AromaticContact CE3-CE1 3.72Å; W246-Y272 HydrophobicContact CE3-CE1 3.72Å; W246-Y272 AromaticContact CE3-CZ 3.75Å; W246-Y272 HydrophobicContact CZ3-CE1 4.44Å; W246-Y272 WeakPolarHBondContact CZ3-OH 3.34Å
247	N	93.1	Very high	91.6	Very high	82 Å²	82	52 Å²	52	44%	0.439	26%	0.261	S	S	.	.			trans	-64.6	119	174.4	-179.7	-1.2	0	0	0	109.2	A244 K245 E249 A250 Y272	A244-N247 WeakPolarHBondContact O-CB 3.48Å; A244-N247 PolarHBondContact O-N 2.83Å; K245-N247 PolarHBondContact O-N 2.93Å; K245-N247 VanDerWaalsContact O-N 3.09Å; N247-E249 PolarHBondContact O-N 3.13Å; N247-E249 PolarHBondContact OD1-N 2.98Å; N247-A250 HydrophobicContact CB-CB 3.97Å; N247-A250 WeakPolarHBondContact O-CB 3.38Å; N247-A250 PolarHBondContact O-N 3.39Å; N247-A250 VanDerWaalsContact O-N 3.14Å; N247-Y272 WeakPolarHBondContact O-CB 3.26Å
248	Q	95.3	Very high	91.6	Very high	79 Å²	79	52.8 Å²	52.8	37%	0.369	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-21.2	-176.8	-65.5	-59.2	-20.5	0	0	113.1	W246 Y272 K273	W246-Q248 PolarHBondContact O-N 3.18Å; Q248-Y272 PolarHBondContact O-N 3.35Å; Q248-K273 HydrophobicContact CB-CB 4.09Å; Q248-K273 WeakPolarHBondContact O-CB 3.33Å; Q248-K273 WeakPolarHBondContact O-CG 3.33Å; Q248-K273 PolarHBondContact O-N 3.18Å
249	E	97	Very high	91.7	Very high	147 Å²	147	51.4 Å²	51.4	69%	0.687	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-10.9	178.2	-59.1	-175.9	165.8	0	0	113	N247 V251	N247-E249 PolarHBondContact O-N 3.13Å; N247-E249 PolarHBondContact OD1-N 2.98Å; E249-V251 PolarHBondContact O-N 3.29Å
250	A	96.4	Very high	92	Very high	23 Å²	23	49.9 Å²	49.9	19%	0.19	25%	0.251	C	S	.	.			trans	-67.9	134.4	179	0	0	0	0	0	110.9	A244 N247 T271 Y272	A244-A250 HydrophobicContact CB-CB 3.64Å; N247-A250 HydrophobicContact CB-CB 3.97Å; N247-A250 WeakPolarHBondContact O-CB 3.38Å; N247-A250 PolarHBondContact O-N 3.39Å; N247-A250 VanDerWaalsContact O-N 3.14Å; A250-T271 CarbonylContact O-C 3.54Å; A250-T271 WeakPolarHBondContact O-CA 3.46Å; A250-Y272 PolarHBondContact O-N 3.25Å
251	V	96.7	Very high	92	Very high	101 Å²	101	53.9 Å²	53.9	61%	0.612	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	117.3	171.8	179.1	0	0	0	0	108.4	E249 D270 T271	E249-V251 PolarHBondContact O-N 3.29Å; V251-D270 WeakPolarHBondContact CA-O 3.26Å; V251-T271 HydrophobicContact CG2-CG2 4.25Å
252	V	95.2	Very high	92	Very high	10 Å²	10	60.6 Å²	60.6	6%	0.061	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	152	178.7	-66.9	0	0	0	0	110.8	A244 L254 S269 D270 Y272	A244-V252 HydrophobicContact CB-CG1 3.44Å; A244-V252 VanDerWaalsContact CB-CG1 3.44Å; V252-L254 HydrophobicContact CG2-CD2 3.81Å; V252-L254 PolarHBondContact O-N 3.39Å; V252-S269 WeakPolarHBondContact O-CA 3.18Å; V252-D270 PolarHBondContact N-O 3.08Å; V252-D270 PolarHBondContact O-N 2.8Å; V252-Y272 HydrophobicContact CG2-CD2 3.47Å; V252-Y272 VanDerWaalsContact CG2-CD2 3.47Å; V252-Y272 HydrophobicContact CG2-CE2 4.32Å; V252-Y272 HydrophobicContact CG2-CG 4.14Å
253	P	95	Very high	92	Very high	34 Å²	34	65.6 Å²	65.6	22%	0.221	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	121.6	169.7	29.6	-34.8	0	0	0	108.8	W236 Q240 S268	W236-P253 HydrophobicContact CH2-CB 3.82Å; W236-P253 HydrophobicContact CH2-CG 4.17Å; W236-P253 VanDerWaalsContact CH2-O 3.22Å; W236-P253 WeakPolarHBondContact CH2-O 2.95Å; W236-P253 HydrophobicContact CZ2-CB 4.02Å; W236-P253 HydrophobicContact CZ2-CG 4.1Å; Q240-P253 HydrophobicContact CG-CG 4.07Å; P253-S268 WeakPolarHBondContact CA-O 3Å
254	L	94.5	Very high	92.1	Very high	2 Å²	2	64.5 Å²	64.5	1%	0.01	31%	0.311	C	S	.	.	S	Bend	trans	-94.8	-12.9	-179.8	-60.7	177.3	0	0	0	113	V227 V252 S268 D270 Y272 R275 W286	V227-L254 HydrophobicContact CG1-CB 3.62Å; V227-L254 HydrophobicContact CG1-CD1 3.89Å; V227-L254 HydrophobicContact CG1-CG 4.38Å; V252-L254 HydrophobicContact CG2-CD2 3.81Å; V252-L254 PolarHBondContact O-N 3.39Å; L254-S268 PolarHBondContact N-O 3.27Å; L254-D270 HydrophobicContact CD1-CB 3.88Å; L254-Y272 HydrophobicContact CD2-CD2 3.88Å; L254-Y272 HydrophobicContact CD2-CE2 4.37Å; L254-R275 HydrophobicContact CD1-CB 4.05Å; L254-R275 HydrophobicContact CD2-CB 4.18Å; L254-W286 HydrophobicContact CB-CH2 4.27Å; L254-W286 HydrophobicContact CD1-CH2 4.13Å; L254-W286 HydrophobicContact CD1-CZ2 3.68Å
255	T	91.6	Very high	92.1	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	34%	0.344	C	S	.	.	S	Bend	trans	-148.6	160.8	173.2	-176	0	0	0	0	109.8	H226 W236 C259 S268 W286 I290	H226-T255 PolarHBondContact CD2-OG1 3.34Å; H226-T255 PolarHBondContact NE2-OG1 2.62Å; W236-T255 VanDerWaalsContact CH2-O 3.28Å; W236-T255 WeakPolarHBondContact CH2-O 2.99Å; T255-C259 HydrophobicContact CG2-CB 4.45Å; T255-S268 WeakPolarHBondContact O-CB 3.45Å; T255-S268 PolarHBondContact O-OG 2.61Å; T255-W286 HydrophobicContact CG2-CZ3 4.38Å; T255-I290 HydrophobicContact CG2-CD1 3.53Å; T255-I290 HydrophobicContact CG2-CG1 4.25Å
256	P	89.5	Confident	92.2	Very high	5 Å²	5	62.3 Å²	62.3	3%	0.032	32%	0.323	C	S	.	.			trans	-57.6	142.7	173.2	-28.9	39.5	0	0	0	112.7	Y190 Y230 S258 C259	Y190-P256 HydrophobicContact CE1-CG 3.69Å; Y190-P256 VanDerWaalsContact OH-CB 3.32Å; Y190-P256 WeakPolarHBondContact OH-CB 3.07Å; Y190-P256 WeakPolarHBondContact OH-CG 2.97Å; Y230-P256 HydrophobicContact CD1-CG 3.78Å; Y230-P256 HydrophobicContact CE1-CG 3.73Å; P256-S258 WeakPolarHBondContact CB-OG 2.96Å; P256-S258 PolarHBondContact O-N 3.1Å; P256-C259 VanDerWaalsContact O-CB 3.3Å; P256-C259 WeakPolarHBondContact O-CB 2.85Å; P256-C259 PolarHBondContact O-N 2.98Å
257	E	90.4	Very high	92.5	Very high	94 Å²	94	60 Å²	60	44%	0.439	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-63.1	-23.9	178.2	-68.3	-175	152.5	0	0	112.4	C259 C260 Q263 G266	E257-C259 PolarHBondContact O-N 3.41Å; E257-C260 WeakPolarHBondContact O-CB 3.44Å; E257-C260 PolarHBondContact O-N 3.09Å; E257-Q263 PolarHBondContact O-NE2 3.2Å; E257-G266 PolarHBondContact OE1-N 3.49Å
258	S	87.9	Confident	92.5	Very high	16 Å²	16	56 Å²	56	11%	0.112	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-57	-16.6	172.2	60.9	0	0	0	0	113.5	D204 S208 P256	D204-S258 PolarHBondContact OD1-OG 3.44Å; S208-S258 WeakPolarHBondContact CB-O 3.32Å; S208-S258 PolarHBondContact OG-O 2.79Å; P256-S258 WeakPolarHBondContact CB-OG 2.96Å; P256-S258 PolarHBondContact O-N 3.1Å
259	C	89.2	Confident	92.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-91.7	-11.2	178.2	-67.4	0	0	0	0	116.4	C212 H226 T255 P256 E257 I290 H291	C212-C259 HydrophobicContact CB-CB 3.44Å; C212-C259 VanDerWaalsContact CB-CB 3.44Å; C212-C259 WeakPolarHBondContact CB-SG 3.37Å; C212-C259 WeakPolarHBondContact SG-CA 3.29Å; C212-C259 WeakPolarHBondContact SG-CB 3.39Å; C212-C259 CovalentContact SG-SG 2.02Å; C212-C259 PolarHBondContact SG-SG 3.15Å; H226-C259 PolarHBondContact NE2-SG 3.39Å; H226-C259 VanDerWaalsContact NE2-SG 3.41Å; T255-C259 HydrophobicContact CG2-CB 4.45Å; P256-C259 VanDerWaalsContact O-CB 3.3Å; P256-C259 WeakPolarHBondContact O-CB 2.85Å; P256-C259 PolarHBondContact O-N 2.98Å; E257-C259 PolarHBondContact O-N 3.41Å; C259-I290 HydrophobicContact CB-CD1 4.03Å; C259-I290 HydrophobicContact CB-CG2 4.22Å; C259-I290 WeakPolarHBondContact O-CA 3.06Å; C259-H291 PolarHBondContact O-N 2.02Å
260	C	91.5	Very high	92.5	Very high	1 Å²	1	48 Å²	48	1%	0.007	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-72.2	137	176.8	-57.7	0	0	0	0	111.4	E257 K262 Q263 C267 I289	E257-C260 WeakPolarHBondContact O-CB 3.44Å; E257-C260 PolarHBondContact O-N 3.09Å; C260-K262 WeakPolarHBondContact CB-O 3.46Å; C260-K262 PolarHBondContact O-N 3.03Å; C260-Q263 PolarHBondContact O-NE2 3.04Å; C260-C267 HydrophobicContact CB-CB 3.61Å; C260-C267 WeakPolarHBondContact CB-SG 3.48Å; C260-C267 VanDerWaalsContact SG-C 3.57Å; C260-C267 WeakPolarHBondContact SG-CB 2.87Å; C260-C267 CovalentContact SG-SG 2.01Å; C260-C267 PolarHBondContact SG-SG 2.01Å; C260-I289 WeakPolarHBondContact CA-O 3.3Å
261	R	90.4	Very high	92.6	Very high	107 Å²	107	48.4 Å²	48.4	40%	0.404	26%	0.263	S	S	.	.	S	Bend	trans	-60	-37.5	173.8	-67.8	-173.5	-171.4	-167.8	-8.5	112.3	N287 E288 I289 I290 H291	R261-N287 PolarHBondContact NE-O 3.47Å; R261-N287 PolarHBondContact NH2-O 3.27Å; R261-E288 VanDerWaalsContact CD-O 3.3Å; R261-E288 WeakPolarHBondContact CD-O 3.26Å; R261-I289 WeakPolarHBondContact CB-O 3.01Å; R261-I289 WeakPolarHBondContact CG-O 3.44Å; R261-I289 PolarHBondContact N-O 3.22Å; R261-I290 PolarHBondContact NE-O 3.32Å; R261-H291 WeakPolarHBondContact CA-NE2 2.96Å
262	K	91.2	Very high	92.5	Very high	141 Å²	141	43.6 Å²	43.6	61%	0.613	23%	0.234	S	C	*	.	S	Bend	trans	-114.6	126.8	172.3	-61.9	-173.5	-177.2	179.2	0	107.7	C260 E264	C260-K262 WeakPolarHBondContact CB-O 3.46Å; C260-K262 PolarHBondContact O-N 3.03Å; K262-E264 HydrophobicContact CB-CG 4.05Å; K262-E264 WeakPolarHBondContact CD-OE1 3.19Å; K262-E264 PolarHBondContact O-N 2.99Å
263	Q	87.2	Confident	92.5	Very high	129 Å²	129	48.2 Å²	48.2	60%	0.603	25%	0.253	S	S	*	.			trans	-76.7	67.1	177.7	-67.4	-66.6	-46.2	0	0	109.5	E257 C260	E257-Q263 PolarHBondContact O-NE2 3.2Å; C260-Q263 PolarHBondContact O-NE2 3.04Å
264	E	91.4	Very high	92.4	Very high	115 Å²	115	48 Å²	48	54%	0.537	25%	0.25	S	S	.	.			trans	-103.5	135.5	176.8	-69.3	172.2	-165.3	0	0	108.7	K262 G266 C267	K262-E264 HydrophobicContact CB-CG 4.05Å; K262-E264 WeakPolarHBondContact CD-OE1 3.19Å; K262-E264 PolarHBondContact O-N 2.99Å; E264-G266 PolarHBondContact O-N 3.38Å; E264-C267 WeakPolarHBondContact O-CB 3.5Å; E264-C267 PolarHBondContact O-N 3.22Å; E264-C267 PolarHBondContact O-SG 3.2Å
265	S	91.1	Very high	92.3	Very high	119 Å²	119	48.4 Å²	48.4	83%	0.832	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	126.2	179.7	55.8	0	0	0	0	110.9	C267	S265-C267 VanDerWaalsContact C-N 3.34Å
266	G	93.3	Very high	92.3	Very high	33 Å²	33	53.8 Å²	53.8	34%	0.34	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	8.1	-179.4	0	0	0	0	0	115.1	E257 E264 S268 S269	E257-G266 PolarHBondContact OE1-N 3.49Å; E264-G266 PolarHBondContact O-N 3.38Å; G266-S268 PolarHBondContact O-N 2.86Å; G266-S269 WeakPolarHBondContact O-CB 3.31Å; G266-S269 PolarHBondContact O-N 3.39Å
267	C	94.1	Very high	92.4	Very high	21 Å²	21	56.5 Å²	56.5	14%	0.142	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-32.5	174.9	62.2	0	0	0	0	113.4	C260 E264 S265 I289	C260-C267 HydrophobicContact CB-CB 3.61Å; C260-C267 WeakPolarHBondContact CB-SG 3.48Å; C260-C267 VanDerWaalsContact SG-C 3.57Å; C260-C267 WeakPolarHBondContact SG-CB 2.87Å; C260-C267 CovalentContact SG-SG 2.01Å; C260-C267 PolarHBondContact SG-SG 2.01Å; E264-C267 WeakPolarHBondContact O-CB 3.5Å; E264-C267 PolarHBondContact O-N 3.22Å; E264-C267 PolarHBondContact O-SG 3.2Å; S265-C267 VanDerWaalsContact C-N 3.34Å; C267-I289 WeakPolarHBondContact O-CG2 3.41Å
268	S	94	Very high	92.5	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	0	179.5	67.1	0	0	0	0	113.6	P253 L254 T255 G266	P253-S268 WeakPolarHBondContact CA-O 3Å; L254-S268 PolarHBondContact N-O 3.27Å; T255-S268 WeakPolarHBondContact O-CB 3.45Å; T255-S268 PolarHBondContact O-OG 2.61Å; G266-S268 PolarHBondContact O-N 2.86Å
269	S	96.2	Very high	92.7	Very high	40 Å²	40	55 Å²	55	28%	0.28	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	134.7	-175.6	-65.6	0	0	0	0	111.7	V252 G266	V252-S269 WeakPolarHBondContact O-CA 3.18Å; G266-S269 WeakPolarHBondContact O-CB 3.31Å; G266-S269 PolarHBondContact O-N 3.39Å
270	D	96.6	Very high	92.9	Very high	16 Å²	16	63.4 Å²	63.4	9%	0.086	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	170.5	173.7	-155.9	-6.1	0	0	0	110.2	V251 V252 L254 Y272 N274 K285 W286	V251-D270 WeakPolarHBondContact CA-O 3.26Å; V252-D270 PolarHBondContact N-O 3.08Å; V252-D270 PolarHBondContact O-N 2.8Å; L254-D270 HydrophobicContact CD1-CB 3.88Å; D270-Y272 PolarHBondContact O-N 3.24Å; D270-N274 HydrophobicContact CB-CB 4.44Å; D270-N274 PolarHBondContact OD1-ND2 3.43Å; D270-N274 WeakPolarHBondContact OD2-CB 3.26Å; D270-N274 PolarHBondContact OD2-ND2 3.22Å; D270-K285 IonicContact OD1-NZ 2.69Å; D270-K285 PolarHBondContact OD1-NZ 3.03Å; D270-K285 IonicContact OD2-NZ 3.46Å; D270-K285 PolarHBondContact OD2-NZ 3.16Å; D270-W286 HydrophobicContact CB-CH2 4.12Å; D270-W286 HydrophobicContact CB-CZ2 3.65Å
271	T	96.5	Very high	93.1	Very high	32 Å²	32	69.9 Å²	69.9	20%	0.196	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	134.9	171.5	63.3	0	0	0	0	109.7	A250 V251 K273 N274	A250-T271 CarbonylContact O-C 3.54Å; A250-T271 WeakPolarHBondContact O-CA 3.46Å; V251-T271 HydrophobicContact CG2-CG2 4.25Å; T271-K273 PolarHBondContact O-N 3.15Å; T271-K273 VanDerWaalsContact O-N 3.07Å; T271-K273 WeakPolarHBondContact OG1-CG 3.35Å; T271-N274 WeakPolarHBondContact O-CB 3.13Å; T271-N274 PolarHBondContact O-N 3.46Å; T271-N274 PolarHBondContact OG1-ND2 3.24Å; T271-N274 PolarHBondContact OG1-OD1 3.26Å
272	Y	94.9	Very high	93.3	Very high	1 Å²	1	65.1 Å²	65.1	0%	0.004	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-56	-35.5	-171.3	-169.1	-130.9	0	0	0	111.8	W246 N247 Q248 A250 V252 L254 D270 N274 R275	W246-Y272 HydrophobicContact CB-CE1 4.37Å; W246-Y272 AromaticContact CE3-CE1 3.72Å; W246-Y272 HydrophobicContact CE3-CE1 3.72Å; W246-Y272 AromaticContact CE3-CZ 3.75Å; W246-Y272 HydrophobicContact CZ3-CE1 4.44Å; W246-Y272 WeakPolarHBondContact CZ3-OH 3.34Å; N247-Y272 WeakPolarHBondContact O-CB 3.26Å; Q248-Y272 PolarHBondContact O-N 3.35Å; A250-Y272 PolarHBondContact O-N 3.25Å; V252-Y272 HydrophobicContact CG2-CD2 3.47Å; V252-Y272 VanDerWaalsContact CG2-CD2 3.47Å; V252-Y272 HydrophobicContact CG2-CE2 4.32Å; V252-Y272 HydrophobicContact CG2-CG 4.14Å; L254-Y272 HydrophobicContact CD2-CD2 3.88Å; L254-Y272 HydrophobicContact CD2-CE2 4.37Å; D270-Y272 PolarHBondContact O-N 3.24Å; Y272-N274 VanDerWaalsContact C-N 3.27Å; Y272-N274 PolarHBondContact O-N 3.42Å; Y272-R275 VanDerWaalsContact C-NH1 3.29Å; Y272-R275 VanDerWaalsContact CG-NH1 3.27Å; Y272-R275 WeakPolarHBondContact O-CD 3.49Å; Y272-R275 WeakPolarHBondContact O-CG 3.31Å; Y272-R275 PolarHBondContact O-N 3.12Å; Y272-R275 PolarHBondContact O-NH1 3.42Å; Y272-R275 PolarHBondContact OH-NH2 2.71Å; Y272-R275 VanDerWaalsContact OH-NH2 3.15Å
273	K	94.9	Very high	93.2	Very high	106 Å²	106	61 Å²	61	46%	0.461	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-58.2	-30.9	174.4	68.3	-174.3	-177.4	-176.5	0	114.8	Q248 T271 R275 F276	Q248-K273 HydrophobicContact CB-CB 4.09Å; Q248-K273 WeakPolarHBondContact O-CB 3.33Å; Q248-K273 WeakPolarHBondContact O-CG 3.33Å; Q248-K273 PolarHBondContact O-N 3.18Å; T271-K273 PolarHBondContact O-N 3.15Å; T271-K273 VanDerWaalsContact O-N 3.07Å; T271-K273 WeakPolarHBondContact OG1-CG 3.35Å; K273-R275 PolarHBondContact O-N 3.43Å; K273-R275 VanDerWaalsContact O-N 3.11Å; K273-F276 PolarHBondContact O-N 2.91Å
274	N	94	Very high	93.5	Very high	30 Å²	30	61.2 Å²	61.2	16%	0.16	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-67.6	-14.1	-174.7	-73	-5	0	0	0	113	D270 T271 Y272 F276 D277 N282	D270-N274 HydrophobicContact CB-CB 4.44Å; D270-N274 PolarHBondContact OD1-ND2 3.43Å; D270-N274 WeakPolarHBondContact OD2-CB 3.26Å; D270-N274 PolarHBondContact OD2-ND2 3.22Å; T271-N274 WeakPolarHBondContact O-CB 3.13Å; T271-N274 PolarHBondContact O-N 3.46Å; T271-N274 PolarHBondContact OG1-ND2 3.24Å; T271-N274 PolarHBondContact OG1-OD1 3.26Å; Y272-N274 VanDerWaalsContact C-N 3.27Å; Y272-N274 PolarHBondContact O-N 3.42Å; N274-F276 PolarHBondContact O-N 3.14Å; N274-D277 PolarHBondContact O-N 3.21Å; N274-N282 PolarHBondContact O-ND2 3.13Å
275	R	92.5	Very high	93.7	Very high	10 Å²	10	59.2 Å²	59.2	4%	0.038	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-63.2	-22.8	169.2	81.5	-167.9	-175.2	-82.9	10.7	113.3	Y224 V227 I228 E232 L254 Y272 K273	Y224-R275 PolarHBondContact OH-O 2.61Å; V227-R275 HydrophobicContact CG1-CB 4.39Å; I228-R275 WeakPolarHBondContact CG1-O 3.45Å; E232-R275 IonicContact OE1-CZ 2.71Å; E232-R275 IonicContact OE1-NE 3.55Å; E232-R275 PolarHBondContact OE1-NE 3.48Å; E232-R275 IonicContact OE1-NH2 2.73Å; E232-R275 PolarHBondContact OE1-NH2 3.04Å; L254-R275 HydrophobicContact CD1-CB 4.05Å; L254-R275 HydrophobicContact CD2-CB 4.18Å; Y272-R275 VanDerWaalsContact C-NH1 3.29Å; Y272-R275 VanDerWaalsContact CG-NH1 3.27Å; Y272-R275 WeakPolarHBondContact O-CD 3.49Å; Y272-R275 WeakPolarHBondContact O-CG 3.31Å; Y272-R275 PolarHBondContact O-N 3.12Å; Y272-R275 PolarHBondContact O-NH1 3.42Å; Y272-R275 PolarHBondContact OH-NH2 2.71Å; Y272-R275 VanDerWaalsContact OH-NH2 3.15Å; K273-R275 PolarHBondContact O-N 3.43Å; K273-R275 VanDerWaalsContact O-N 3.11Å
276	F	91.7	Very high	93.7	Very high	113 Å²	113	53.6 Å²	53.6	50%	0.496	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-104.7	-2.5	176.9	-60.7	-48.9	0	0	0	113.1	Y224 E232 K273 N274 G278	Y224-F276 WeakPolarHBondContact OH-CA 3.39Å; Y224-F276 PolarHBondContact OH-O 3.02Å; E232-F276 HydrophobicContact CG-CE1 4.47Å; E232-F276 VanDerWaalsContact OE1-CZ 3.3Å; E232-F276 WeakPolarHBondContact OE1-CZ 3.25Å; K273-F276 PolarHBondContact O-N 2.91Å; N274-F276 PolarHBondContact O-N 3.14Å; F276-G278 PolarHBondContact O-N 2.72Å
277	D	92.4	Very high	93.5	Very high	62 Å²	62	54.1 Å²	54.1	33%	0.332	27%	0.274	S	S	.	.			trans	-78.2	93	176.8	-177.4	14.9	0	0	0	110.2	Y224 N274 S279 N282	Y224-D277 VanDerWaalsContact CE2-O 3.25Å; Y224-D277 WeakPolarHBondContact CE2-O 3.24Å; N274-D277 PolarHBondContact O-N 3.21Å; D277-S279 PolarHBondContact O-N 2.86Å; D277-S279 WeakPolarHBondContact OD1-CB 3.31Å; D277-S279 PolarHBondContact OD1-N 3.3Å; D277-S279 PolarHBondContact OD1-OG 2.66Å; D277-S279 PolarHBondContact OD2-OG 2.79Å; D277-N282 HydrophobicContact CB-CB 4.22Å; D277-N282 WeakPolarHBondContact O-CB 3.31Å; D277-N282 PolarHBondContact O-ND2 2.88Å; D277-N282 WeakPolarHBondContact OD2-CB 2.88Å
278	G	90.8	Very high	93.4	Very high	46 Å²	46	58.6 Å²	58.6	47%	0.474	29%	0.293	S	S	.	.			trans	-76.5	14.8	174.2	0	0	0	0	0	114.4	Y224 F276 I283	Y224-G278 PolarHBondContact OH-N 2.69Å; F276-G278 PolarHBondContact O-N 2.72Å; G278-I283 WeakPolarHBondContact O-CD1 3.28Å
279	S	93.8	Very high	93.3	Very high	32 Å²	32	60.8 Å²	60.8	22%	0.224	30%	0.304	C	S	.	.			trans	-58.4	151.2	177.3	67.2	0	0	0	0	111.9	D277 E281 N282 I283	D277-S279 PolarHBondContact O-N 2.86Å; D277-S279 WeakPolarHBondContact OD1-CB 3.31Å; D277-S279 PolarHBondContact OD1-N 3.3Å; D277-S279 PolarHBondContact OD1-OG 2.66Å; D277-S279 PolarHBondContact OD2-OG 2.79Å; S279-E281 PolarHBondContact O-N 2.04Å; S279-N282 PolarHBondContact O-N 2.87Å; S279-N282 WeakPolarHBondContact OG-CB 3.02Å; S279-N282 PolarHBondContact OG-N 3.12Å; S279-N282 VanDerWaalsContact OG-N 3.09Å; S279-I283 WeakPolarHBondContact O-CB 3.47Å; S279-I283 VanDerWaalsContact O-CG1 3.29Å; S279-I283 WeakPolarHBondContact O-CG1 3.08Å; S279-I283 PolarHBondContact O-N 3.02Å
280	K	93	Very high	93	Very high	178 Å²	178	58.9 Å²	58.9	77%	0.774	29%	0.291	S	S	*	.	H	α-helix	trans	-61.5	-34.6	178.1	-72	-177.9	179.8	176.5	0	110.7	K284	K280-K284 WeakPolarHBondContact O-CB 3.25Å; K280-K284 PolarHBondContact O-N 3.46Å
281	E	95.3	Very high	92.3	Very high	137 Å²	137	61 Å²	61	64%	0.64	30%	0.3	S	S	*	.	H	α-helix	trans	-64.7	-49	177.9	-64.6	68.3	-150.4	0	0	110.9	S279 K284 K285	S279-E281 PolarHBondContact O-N 2.04Å; E281-K284 PolarHBondContact O-N 2.03Å; E281-K285 WeakPolarHBondContact O-CB 2.87Å; E281-K285 PolarHBondContact O-N 2.95Å
282	N	93.6	Very high	91.1	Very high	6 Å²	6	61 Å²	61	3%	0.032	30%	0.3	C	S	.	.	H	α-helix	trans	-69.3	-40.5	178.4	-171	53.2	0	0	0	112	N274 D277 S279 K284 K285 W286	N274-N282 PolarHBondContact O-ND2 3.13Å; D277-N282 HydrophobicContact CB-CB 4.22Å; D277-N282 WeakPolarHBondContact O-CB 3.31Å; D277-N282 PolarHBondContact O-ND2 2.88Å; D277-N282 WeakPolarHBondContact OD2-CB 2.88Å; S279-N282 PolarHBondContact O-N 2.87Å; S279-N282 WeakPolarHBondContact OG-CB 3.02Å; S279-N282 PolarHBondContact OG-N 3.12Å; S279-N282 VanDerWaalsContact OG-N 3.09Å; N282-K284 VanDerWaalsContact C-N 3.31Å; N282-K284 PolarHBondContact O-N 3.15Å; N282-K285 WeakPolarHBondContact O-CB 3.34Å; N282-K285 PolarHBondContact O-N 3.3Å; N282-W286 PolarHBondContact O-N 2.64Å; N282-W286 PolarHBondContact OD1-NE1 2.95Å; N282-W286 VanDerWaalsContact OD1-NE1 3.11Å
283	I	90.9	Very high	89.5	Confident	56 Å²	56	67.8 Å²	67.8	29%	0.287	34%	0.336	S	S	.	.	H	α-helix	trans	-59.7	-43.8	173.5	-68.4	168.8	0	0	0	110.5	Y224 G278 S279 N287	Y224-I283 HydrophobicContact CD1-CG1 4.28Å; Y224-I283 HydrophobicContact CD2-CG1 4.42Å; Y224-I283 HydrophobicContact CG-CG1 4.01Å; G278-I283 WeakPolarHBondContact O-CD1 3.28Å; S279-I283 WeakPolarHBondContact O-CB 3.47Å; S279-I283 VanDerWaalsContact O-CG1 3.29Å; S279-I283 WeakPolarHBondContact O-CG1 3.08Å; S279-I283 PolarHBondContact O-N 3.02Å; I283-N287 WeakPolarHBondContact O-CB 3.19Å; I283-N287 PolarHBondContact O-N 2.86Å; I283-N287 PolarHBondContact O-ND2 2.96Å; I283-N287 VanDerWaalsContact O-ND2 3.16Å
284	K	92.5	Very high	87.7	Confident	132 Å²	132	63.8 Å²	63.8	57%	0.574	33%	0.325	S	S	*	.	H	α-helix	trans	-62	-46.7	175.7	-174.8	-177.7	176.3	-169.8	0	111.1	K280 E281 N282 W286 N287 E288	K280-K284 WeakPolarHBondContact O-CB 3.25Å; K280-K284 PolarHBondContact O-N 3.46Å; E281-K284 PolarHBondContact O-N 2.03Å; N282-K284 VanDerWaalsContact C-N 3.31Å; N282-K284 PolarHBondContact O-N 3.15Å; K284-W286 PolarHBondContact O-N 3.04Å; K284-N287 PolarHBondContact O-N 3.41Å; K284-E288 WeakPolarHBondContact CE-OE1 3.28Å; K284-E288 WeakPolarHBondContact O-CG 3.45Å; K284-E288 PolarHBondContact O-N 2.9Å
285	K	94.6	Very high	86.2	Confident	73 Å²	73	63.9 Å²	63.9	32%	0.317	33%	0.328	S	S	.	.	H	α-helix	trans	-53.5	-54.3	175.2	176.5	-170.8	175.6	-173.4	0	111.6	D270 E281 N282 N287 E288 I289	D270-K285 IonicContact OD1-NZ 2.69Å; D270-K285 PolarHBondContact OD1-NZ 3.03Å; D270-K285 IonicContact OD2-NZ 3.46Å; D270-K285 PolarHBondContact OD2-NZ 3.16Å; E281-K285 WeakPolarHBondContact O-CB 2.87Å; E281-K285 PolarHBondContact O-N 2.95Å; N282-K285 WeakPolarHBondContact O-CB 3.34Å; N282-K285 PolarHBondContact O-N 3.3Å; K285-N287 VanDerWaalsContact C-N 3.31Å; K285-N287 PolarHBondContact O-N 2.92Å; K285-E288 PolarHBondContact O-N 3.26Å; K285-E288 VanDerWaalsContact O-N 3.09Å; K285-I289 HydrophobicContact CD-CD1 4.44Å; K285-I289 HydrophobicContact CG-CD1 3.71Å; K285-I289 VanDerWaalsContact O-CG1 3.31Å; K285-I289 WeakPolarHBondContact O-CG1 3.38Å; K285-I289 PolarHBondContact O-N 3.12Å
286	W	92.4	Very high	84.6	Confident	1 Å²	1	73.4 Å²	73.4	0%	0.004	37%	0.37	C	S	.	.	H	α-helix	trans	-64.5	-36.3	179.9	-75.6	108.2	0	0	0	112.7	A223 V227 L254 T255 D270 N282 K284 E288 I289 I290	A223-W286 VanDerWaalsContact CB-C 3.48Å; A223-W286 HydrophobicContact CB-CB 3.98Å; A223-W286 WeakPolarHBondContact CB-O 2.99Å; V227-W286 HydrophobicContact CG1-CZ2 4.33Å; V227-W286 HydrophobicContact CG2-CD2 3.57Å; V227-W286 HydrophobicContact CG2-CE3 3.43Å; V227-W286 VanDerWaalsContact CG2-CE3 3.43Å; V227-W286 HydrophobicContact CG2-CG 4.09Å; V227-W286 HydrophobicContact CG2-CH2 4.33Å; V227-W286 HydrophobicContact CG2-CZ2 4.45Å; V227-W286 HydrophobicContact CG2-CZ3 3.83Å; L254-W286 HydrophobicContact CB-CH2 4.27Å; L254-W286 HydrophobicContact CD1-CH2 4.13Å; L254-W286 HydrophobicContact CD1-CZ2 3.68Å; T255-W286 HydrophobicContact CG2-CZ3 4.38Å; D270-W286 HydrophobicContact CB-CH2 4.12Å; D270-W286 HydrophobicContact CB-CZ2 3.65Å; N282-W286 PolarHBondContact O-N 2.64Å; N282-W286 PolarHBondContact OD1-NE1 2.95Å; N282-W286 VanDerWaalsContact OD1-NE1 3.11Å; K284-W286 PolarHBondContact O-N 3.04Å; W286-E288 VanDerWaalsContact C-N 3.27Å; W286-E288 PolarHBondContact O-N 3.39Å; W286-I289 HydrophobicContact CZ3-CG2 4.49Å; W286-I289 PolarHBondContact O-N 3.17Å; W286-I290 HydrophobicContact CE3-CG1 3.79Å; W286-I290 HydrophobicContact CZ3-CD1 4.46Å; W286-I290 HydrophobicContact CZ3-CG1 4.21Å; W286-I290 WeakPolarHBondContact O-CB 3.4Å; W286-I290 PolarHBondContact O-N 2.8Å
287	N	88.6	Confident	83.1	Confident	45 Å²	45	69.4 Å²	69.4	24%	0.241	36%	0.36	C	S	.	.	H	α-helix	trans	-66.5	-28.2	174.8	-74.9	-28.4	0	0	0	112.6	A223 R261 I283 K284 K285 V292	A223-N287 WeakPolarHBondContact CB-OD1 3.17Å; A223-N287 PolarHBondContact N-OD1 3.05Å; R261-N287 PolarHBondContact NE-O 3.47Å; R261-N287 PolarHBondContact NH2-O 3.27Å; I283-N287 WeakPolarHBondContact O-CB 3.19Å; I283-N287 PolarHBondContact O-N 2.86Å; I283-N287 PolarHBondContact O-ND2 2.96Å; I283-N287 VanDerWaalsContact O-ND2 3.16Å; K284-N287 PolarHBondContact O-N 3.41Å; K285-N287 VanDerWaalsContact C-N 3.31Å; K285-N287 PolarHBondContact O-N 2.92Å; N287-V292 HydrophobicContact CB-CG2 4.01Å; N287-V292 WeakPolarHBondContact O-CG2 3.37Å; N287-V292 WeakPolarHBondContact OD1-CG2 3.37Å
288	E	91.7	Very high	81.9	Confident	114 Å²	114	70.4 Å²	70.4	53%	0.533	37%	0.366	S	S	.	.	H	α-helix	trans	-78.4	-31.8	174.3	-73.5	172.1	-177.3	0	0	112.5	R261 K284 K285 W286	R261-E288 VanDerWaalsContact CD-O 3.3Å; R261-E288 WeakPolarHBondContact CD-O 3.26Å; K284-E288 WeakPolarHBondContact CE-OE1 3.28Å; K284-E288 WeakPolarHBondContact O-CG 3.45Å; K284-E288 PolarHBondContact O-N 2.9Å; K285-E288 PolarHBondContact O-N 3.26Å; K285-E288 VanDerWaalsContact O-N 3.09Å; W286-E288 VanDerWaalsContact C-N 3.27Å; W286-E288 PolarHBondContact O-N 3.39Å
289	I	92.4	Very high	80.8	Confident	46 Å²	46	68.9 Å²	68.9	24%	0.236	35%	0.346	C	S	.	.	H	α-helix	trans	-83.6	-45.8	-177.4	-67.4	171.2	0	0	0	112.3	C260 R261 C267 K285 W286	C260-I289 WeakPolarHBondContact CA-O 3.3Å; R261-I289 WeakPolarHBondContact CB-O 3.01Å; R261-I289 WeakPolarHBondContact CG-O 3.44Å; R261-I289 PolarHBondContact N-O 3.22Å; C267-I289 WeakPolarHBondContact O-CG2 3.41Å; K285-I289 HydrophobicContact CD-CD1 4.44Å; K285-I289 HydrophobicContact CG-CD1 3.71Å; K285-I289 VanDerWaalsContact O-CG1 3.31Å; K285-I289 WeakPolarHBondContact O-CG1 3.38Å; K285-I289 PolarHBondContact O-N 3.12Å; W286-I289 HydrophobicContact CZ3-CG2 4.49Å; W286-I289 PolarHBondContact O-N 3.17Å
290	I	89	Confident	79.5	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-100.9	149.3	-171.7	-58.3	-62.7	0	0	0	110.1	C212 A223 T255 C259 R261 W286 V292	C212-I290 HydrophobicContact CB-CG2 4.26Å; A223-I290 HydrophobicContact CB-CB 3.71Å; A223-I290 HydrophobicContact CB-CG1 4.42Å; A223-I290 HydrophobicContact CB-CG2 4.05Å; T255-I290 HydrophobicContact CG2-CD1 3.53Å; T255-I290 HydrophobicContact CG2-CG1 4.25Å; C259-I290 HydrophobicContact CB-CD1 4.03Å; C259-I290 HydrophobicContact CB-CG2 4.22Å; C259-I290 WeakPolarHBondContact O-CA 3.06Å; R261-I290 PolarHBondContact NE-O 3.32Å; W286-I290 HydrophobicContact CE3-CG1 3.79Å; W286-I290 HydrophobicContact CZ3-CD1 4.46Å; W286-I290 HydrophobicContact CZ3-CG1 4.21Å; W286-I290 WeakPolarHBondContact O-CB 3.4Å; W286-I290 PolarHBondContact O-N 2.8Å; I290-V292 VanDerWaalsContact O-CG2 3.32Å; I290-V292 WeakPolarHBondContact O-CG2 3.29Å; I290-V292 PolarHBondContact O-N 3.37Å
291	H	82.2	Confident	78.3	Confident	60 Å²	60	66.1 Å²	66.1	28%	0.278	33%	0.331	S	S	.	.			trans	-61.8	125.8	173.1	-73.1	-83.8	0	0	0	110.7	S211 C259 R261	S211-H291 CarbonylContact O-C 3.49Å; S211-H291 WeakPolarHBondContact O-CB 3.45Å; C259-H291 PolarHBondContact O-N 2.02Å; R261-H291 WeakPolarHBondContact CA-NE2 2.96Å
292	V	71.3	Confident	77	Confident	32 Å²	32	59.7 Å²	59.7	19%	0.194	30%	0.301	C	S	.	.			trans	-120.5	-24.6	178.7	-156	0	0	0	0	112.1	A223 N287 I290 G294	A223-V292 HydrophobicContact CB-CG2 3.94Å; N287-V292 HydrophobicContact CB-CG2 4.01Å; N287-V292 WeakPolarHBondContact O-CG2 3.37Å; N287-V292 WeakPolarHBondContact OD1-CG2 3.37Å; I290-V292 VanDerWaalsContact O-CG2 3.32Å; I290-V292 WeakPolarHBondContact O-CG2 3.29Å; I290-V292 PolarHBondContact O-N 3.37Å; V292-G294 VanDerWaalsContact C-N 3.28Å; V292-G294 PolarHBondContact O-N 2.88Å
293	N	62.6	Low	75.8	Confident	144 Å²	144	60.2 Å²	60.2	77%	0.77	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	1.7	-164.4	-69.5	-13.9	0	0	0	114.4
294	G	56.9	Low	74.6	Confident	22 Å²	22	59.7 Å²	59.7	23%	0.227	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	11.7	-165.3	0	0	0	0	0	117	C213 V292 K296	C213-G294 VanDerWaalsContact SG-C 3.56Å; V292-G294 VanDerWaalsContact C-N 3.28Å; V292-G294 PolarHBondContact O-N 2.88Å; G294-K296 PolarHBondContact O-N 3.32Å
295	C	62.9	Low	73.4	Confident	32 Å²	32	56.4 Å²	56.4	22%	0.216	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	17.2	-175.5	-50.3	0	0	0	0	114.9	C213 P219 G297	C213-C295 VanDerWaalsContact CA-SG 3.59Å; C213-C295 HydrophobicContact CB-CB 3.63Å; C213-C295 WeakPolarHBondContact CB-SG 2.85Å; C213-C295 WeakPolarHBondContact SG-CA 3.23Å; C213-C295 WeakPolarHBondContact SG-CB 3.41Å; C213-C295 PolarHBondContact SG-N 2.93Å; C213-C295 CovalentContact SG-SG 2.03Å; C213-C295 PolarHBondContact SG-SG 2.85Å; P219-C295 HydrophobicContact CB-CB 4.27Å; C295-G297 VanDerWaalsContact C-N 3.27Å; C295-G297 PolarHBondContact O-N 3.25Å
296	K	57.3	Low	72	Confident	211 Å²	211	54.5 Å²	54.5	92%	0.917	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-3.4	176	-77.1	-175.5	172.7	-180	0	113.5	G294	G294-K296 PolarHBondContact O-N 3.32Å
297	G	61.1	Low	70.6	Confident	28 Å²	28	55.9 Å²	55.9	29%	0.289	30%	0.302	S	S	.	.	S	Bend	trans	-100.6	132.2	177.4	0	0	0	0	0	112.6	C295 I299	C295-G297 VanDerWaalsContact C-N 3.27Å; C295-G297 PolarHBondContact O-N 3.25Å; G297-I299 PolarHBondContact O-N 2.88Å
298	N	66.5	Low	69.2	Low	84 Å²	84	59.2 Å²	59.2	45%	0.449	32%	0.315	S	S	.	.			trans	-68.4	101	164.2	-175.9	-16.1	0	0	0	107.6	V300 K301 G302	N298-V300 PolarHBondContact O-N 2.92Å; N298-V300 WeakPolarHBondContact OD1-CB 3.46Å; N298-V300 WeakPolarHBondContact OD1-CG2 3.3Å; N298-V300 PolarHBondContact OD1-N 2.66Å; N298-K301 HydrophobicContact CB-CB 4.37Å; N298-K301 HydrophobicContact CB-CD 4.2Å; N298-K301 HydrophobicContact CB-CG 4.02Å; N298-K301 WeakPolarHBondContact O-CA 3.28Å; N298-K301 WeakPolarHBondContact O-CB 3.43Å; N298-K301 PolarHBondContact O-N 3.2Å; N298-G302 PolarHBondContact O-N 2.66Å
299	I	67.7	Low	67.8	Low	13 Å²	13	62 Å²	62	7%	0.067	32%	0.32	C	S	.	.	H	α-helix	trans	-51.6	-30.9	179.4	-74.6	164.7	0	0	0	111	Y182 Y210 C213 G214 G297 K301 G302 F303	Y182-I299 HydrophobicContact CD1-CG2 4.15Å; Y182-I299 HydrophobicContact CE1-CG2 3.46Å; Y182-I299 VanDerWaalsContact CE1-CG2 3.46Å; Y210-I299 HydrophobicContact CD1-CG1 3.89Å; Y210-I299 HydrophobicContact CD2-CG1 4.39Å; Y210-I299 HydrophobicContact CG-CG1 3.7Å; C213-I299 HydrophobicContact CB-CD1 4.23Å; G214-I299 WeakPolarHBondContact O-CD1 3.41Å; G297-I299 PolarHBondContact O-N 2.88Å; I299-K301 VanDerWaalsContact C-N 3.34Å; I299-K301 PolarHBondContact O-N 3.3Å; I299-G302 CarbonylContact O-C 3.55Å; I299-G302 WeakPolarHBondContact O-CA 2.97Å; I299-G302 PolarHBondContact O-N 3.09Å; I299-F303 PolarHBondContact O-N 2.84Å
300	V	66.7	Low	66.1	Low	6 Å²	6	61.3 Å²	61.3	4%	0.036	32%	0.317	C	S	.	.	H	α-helix	trans	-62.1	-40.7	175.8	-174.4	0	0	0	0	111.6	G175 V178 E179 F215 N298 G302 F303 S304	G175-V300 WeakPolarHBondContact O-CG1 3.37Å; V178-V300 HydrophobicContact CB-CG1 4.48Å; V178-V300 HydrophobicContact CG1-CG1 4.33Å; E179-V300 HydrophobicContact CB-CB 4.21Å; E179-V300 HydrophobicContact CB-CG1 3.67Å; E179-V300 HydrophobicContact CB-CG2 3.47Å; E179-V300 VanDerWaalsContact CB-CG2 3.47Å; E179-V300 HydrophobicContact CG-CG2 3.41Å; E179-V300 VanDerWaalsContact CG-CG2 3.41Å; F215-V300 HydrophobicContact CE2-CG2 4.35Å; N298-V300 PolarHBondContact O-N 2.92Å; N298-V300 WeakPolarHBondContact OD1-CB 3.46Å; N298-V300 WeakPolarHBondContact OD1-CG2 3.3Å; N298-V300 PolarHBondContact OD1-N 2.66Å; V300-G302 PolarHBondContact O-N 3Å; V300-F303 PolarHBondContact O-N 3.17Å; V300-S304 WeakPolarHBondContact O-CB 3Å; V300-S304 PolarHBondContact O-N 3.14Å; V300-S304 PolarHBondContact O-OG 3.33Å
301	K	67.8	Low	64.6	Low	147 Å²	147	64.2 Å²	64.2	64%	0.639	33%	0.33	S	S	*	.	H	α-helix	trans	-65.1	-31.4	173.8	-68.5	-173.6	177.4	-177.4	0	111.5	N298 I299 S304 S305	N298-K301 HydrophobicContact CB-CB 4.37Å; N298-K301 HydrophobicContact CB-CD 4.2Å; N298-K301 HydrophobicContact CB-CG 4.02Å; N298-K301 WeakPolarHBondContact O-CA 3.28Å; N298-K301 WeakPolarHBondContact O-CB 3.43Å; N298-K301 PolarHBondContact O-N 3.2Å; I299-K301 VanDerWaalsContact C-N 3.34Å; I299-K301 PolarHBondContact O-N 3.3Å; K301-S304 PolarHBondContact O-OG 3.3Å; K301-S304 VanDerWaalsContact O-OG 3.12Å; K301-S305 WeakPolarHBondContact O-CB 3.22Å; K301-S305 PolarHBondContact O-N 3.3Å; K301-S305 VanDerWaalsContact O-N 3.11Å
302	G	69.3	Low	63	Low	2 Å²	2	65.3 Å²	65.3	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-69.7	-48.4	172.8	0	0	0	0	0	113.6	Y210 N298 I299 V300 S305 M306	Y210-G302 VanDerWaalsContact CE2-CA 3.4Å; Y210-G302 WeakPolarHBondContact OH-CA 3.28Å; Y210-G302 PolarHBondContact OH-N 3.02Å; N298-G302 PolarHBondContact O-N 2.66Å; I299-G302 CarbonylContact O-C 3.55Å; I299-G302 WeakPolarHBondContact O-CA 2.97Å; I299-G302 PolarHBondContact O-N 3.09Å; V300-G302 PolarHBondContact O-N 3Å; G302-S305 PolarHBondContact O-N 3.17Å; G302-M306 WeakPolarHBondContact O-CB 3.44Å; G302-M306 PolarHBondContact O-N 2.84Å
303	F	67.2	Low	62	Low	16 Å²	16	68.2 Å²	68.2	7%	0.07	35%	0.352	C	S	.	.	H	α-helix	trans	-61.3	-45.2	177	-168.8	-85.9	0	0	0	110.2	V178 Y182 L202 L206 I299 V300 S305 M306 A307	V178-F303 HydrophobicContact CG1-CD1 3.57Å; V178-F303 HydrophobicContact CG1-CE1 4.25Å; Y182-F303 AromaticContact CD2-CD2 3.03Å; Y182-F303 HydrophobicContact CD2-CD2 3.03Å; Y182-F303 AromaticContact CD2-CE2 3.24Å; Y182-F303 HydrophobicContact CD2-CE2 3.24Å; Y182-F303 AromaticContact CD2-CG 3.81Å; Y182-F303 HydrophobicContact CD2-CG 3.81Å; Y182-F303 HydrophobicContact CD2-CZ 4.08Å; Y182-F303 AromaticContact CE2-CD2 3.44Å; Y182-F303 HydrophobicContact CE2-CD2 3.44Å; Y182-F303 VanDerWaalsContact CE2-CD2 3.44Å; Y182-F303 AromaticContact CE2-CE2 3.78Å; Y182-F303 HydrophobicContact CE2-CE2 3.78Å; Y182-F303 HydrophobicContact CE2-CG 4.44Å; Y182-F303 AromaticContact CG-CD2 3.74Å; Y182-F303 HydrophobicContact CG-CD2 3.74Å; Y182-F303 HydrophobicContact CG-CE2 4.19Å; Y182-F303 HydrophobicContact CG-CG 4.07Å; L202-F303 HydrophobicContact CD2-CE2 4.33Å; L206-F303 HydrophobicContact CD1-CB 4.3Å; L206-F303 HydrophobicContact CD1-CD2 3.25Å; L206-F303 HydrophobicContact CD1-CE2 3.83Å; L206-F303 HydrophobicContact CD1-CG 4.15Å; I299-F303 PolarHBondContact O-N 2.84Å; V300-F303 PolarHBondContact O-N 3.17Å; F303-S305 PolarHBondContact O-N 2.95Å; F303-M306 PolarHBondContact O-N 3.4Å; F303-A307 HydrophobicContact CD1-CB 4.22Å; F303-A307 HydrophobicContact CE1-CB 4.09Å; F303-A307 WeakPolarHBondContact O-CA 3.48Å; F303-A307 WeakPolarHBondContact O-CB 3.32Å; F303-A307 PolarHBondContact O-N 3.09Å
304	S	65.7	Low	61.7	Low	45 Å²	45	62.4 Å²	62.4	32%	0.315	32%	0.322	S	S	.	.	H	α-helix	trans	-64.2	-41.9	176.9	66.6	0	0	0	0	112.3	V300 K301 F308	V300-S304 WeakPolarHBondContact O-CB 3Å; V300-S304 PolarHBondContact O-N 3.14Å; V300-S304 PolarHBondContact O-OG 3.33Å; K301-S304 PolarHBondContact O-OG 3.3Å; K301-S304 VanDerWaalsContact O-OG 3.12Å; S304-F308 VanDerWaalsContact O-CB 3.25Å; S304-F308 WeakPolarHBondContact O-CB 3.49Å; S304-F308 PolarHBondContact O-N 3.42Å
305	S	67.4	Low	61.2	Low	63 Å²	63	62 Å²	62	44%	0.441	32%	0.317	S	S	.	.	H	α-helix	trans	-66.2	-44.6	176.3	-179.6	0	0	0	0	112.8	K301 G302 F303 R309	K301-S305 WeakPolarHBondContact O-CB 3.22Å; K301-S305 PolarHBondContact O-N 3.3Å; K301-S305 VanDerWaalsContact O-N 3.11Å; G302-S305 PolarHBondContact O-N 3.17Å; F303-S305 PolarHBondContact O-N 2.95Å; S305-R309 WeakPolarHBondContact O-CG 3.34Å; S305-R309 PolarHBondContact O-N 3.11Å
306	M	64.8	Low	60.4	Low	34 Å²	34	65 Å²	65	17%	0.167	33%	0.33	C	S	.	.	H	α-helix	trans	-71.6	-45.4	176.9	-93.7	-163.6	-160.5	0	0	111.6	L202 K205 L206 G302 F303 F308 R309 M310	L202-M306 HydrophobicContact CD1-CB 4.07Å; L202-M306 HydrophobicContact CD1-SD 3.98Å; K205-M306 HydrophobicContact CD-CE 4.19Å; K205-M306 HydrophobicContact CD-SD 4.41Å; K205-M306 HydrophobicContact CG-CE 3.86Å; K205-M306 HydrophobicContact CG-SD 4.37Å; L206-M306 HydrophobicContact CD2-CB 3.95Å; L206-M306 HydrophobicContact CD2-CE 4.2Å; L206-M306 HydrophobicContact CD2-CG 3.99Å; L206-M306 HydrophobicContact CD2-SD 3.51Å; L206-M306 VanDerWaalsContact CD2-SD 3.51Å; L206-M306 HydrophobicContact CG-CB 4.41Å; L206-M306 HydrophobicContact CG-CE 4.47Å; L206-M306 HydrophobicContact CG-CG 4.49Å; L206-M306 HydrophobicContact CG-SD 3.52Å; L206-M306 VanDerWaalsContact CG-SD 3.52Å; G302-M306 WeakPolarHBondContact O-CB 3.44Å; G302-M306 PolarHBondContact O-N 2.84Å; F303-M306 PolarHBondContact O-N 3.4Å; M306-F308 PolarHBondContact O-N 3.43Å; M306-R309 CarbonylContact O-C 3.52Å; M306-R309 PolarHBondContact O-N 3.18Å; M306-R309 VanDerWaalsContact O-N 3.09Å; M306-M310 WeakPolarHBondContact O-CA 3.14Å; M306-M310 WeakPolarHBondContact O-CB 3.17Å; M306-M310 WeakPolarHBondContact O-CG 3.3Å; M306-M310 PolarHBondContact O-N 3.22Å
307	A	63	Low	60.2	Low	29 Å²	29	58.5 Å²	58.5	24%	0.24	31%	0.308	C	S	.	.	H	α-helix	trans	-56	-40	175	0	0	0	0	0	110.2	F303 M310 E311	F303-A307 HydrophobicContact CD1-CB 4.22Å; F303-A307 HydrophobicContact CE1-CB 4.09Å; F303-A307 WeakPolarHBondContact O-CA 3.48Å; F303-A307 WeakPolarHBondContact O-CB 3.32Å; F303-A307 PolarHBondContact O-N 3.09Å; A307-M310 PolarHBondContact O-N 3.19Å; A307-E311 WeakPolarHBondContact O-CB 3.42Å; A307-E311 VanDerWaalsContact O-CG 3.24Å; A307-E311 WeakPolarHBondContact O-CG 3.3Å; A307-E311 PolarHBondContact O-N 1.98Å
308	F	59.2	Low	59.7	Low	116 Å²	116	62 Å²	62	51%	0.509	32%	0.32	S	S	.	.	H	α-helix	trans	-65.6	-44.7	174.2	-165.9	-95.2	0	0	0	113	S304 M306 M310 L312	S304-F308 VanDerWaalsContact O-CB 3.25Å; S304-F308 WeakPolarHBondContact O-CB 3.49Å; S304-F308 PolarHBondContact O-N 3.42Å; M306-F308 PolarHBondContact O-N 3.43Å; F308-M310 VanDerWaalsContact C-N 3.3Å; F308-M310 PolarHBondContact O-N 3.28Å; F308-L312 WeakPolarHBondContact O-CB 3.43Å; F308-L312 PolarHBondContact O-N 2.75Å
309	R	62.4	Low	58.9	Low	171 Å²	171	64.9 Å²	64.9	65%	0.645	33%	0.331	S	S	*	.	H	α-helix	trans	-65.1	-36.1	175.4	-74.6	179.4	176.8	-148.9	-1.5	112.5	S305 M306 L312 L313	S305-R309 WeakPolarHBondContact O-CG 3.34Å; S305-R309 PolarHBondContact O-N 3.11Å; M306-R309 CarbonylContact O-C 3.52Å; M306-R309 PolarHBondContact O-N 3.18Å; M306-R309 VanDerWaalsContact O-N 3.09Å; R309-L312 WeakPolarHBondContact O-CB 3.46Å; R309-L312 PolarHBondContact O-N 2.78Å; R309-L313 VanDerWaalsContact O-CG 3.32Å; R309-L313 WeakPolarHBondContact O-CG 3.4Å; R309-L313 PolarHBondContact O-N 3.02Å
310	M	57.6	Low	58	Low	33 Å²	33	70.6 Å²	70.6	16%	0.163	36%	0.36	C	S	.	.	H	α-helix	trans	-79	-38.4	-176.6	-76.9	-64.3	-93.6	0	0	110.3	Y198 L202 M306 A307 F308 L312 L313 S314	Y198-M310 HydrophobicContact CD2-CE 4.3Å; Y198-M310 HydrophobicContact CE1-CE 3.94Å; Y198-M310 HydrophobicContact CE2-CE 3.48Å; Y198-M310 VanDerWaalsContact CE2-CE 3.48Å; Y198-M310 HydrophobicContact CE2-SD 4.5Å; Y198-M310 WeakPolarHBondContact OH-CB 3.43Å; Y198-M310 WeakPolarHBondContact OH-CE 3.47Å; Y198-M310 PolarHBondContact OH-O 3.03Å; Y198-M310 PolarHBondContact OH-SD 3.33Å; L202-M310 HydrophobicContact CD1-CE 4.19Å; L202-M310 HydrophobicContact CD1-CG 3.86Å; M306-M310 WeakPolarHBondContact O-CA 3.14Å; M306-M310 WeakPolarHBondContact O-CB 3.17Å; M306-M310 WeakPolarHBondContact O-CG 3.3Å; M306-M310 PolarHBondContact O-N 3.22Å; A307-M310 PolarHBondContact O-N 3.19Å; F308-M310 VanDerWaalsContact C-N 3.3Å; F308-M310 PolarHBondContact O-N 3.28Å; M310-L312 VanDerWaalsContact C-N 3.31Å; M310-L312 PolarHBondContact O-N 2.7Å; M310-L313 CarbonylContact O-C 3.59Å; M310-L313 PolarHBondContact O-N 3.44Å; M310-L313 HydrophobicContact SD-CD1 4.23Å; M310-S314 WeakPolarHBondContact O-CA 2.81Å; M310-S314 WeakPolarHBondContact O-CB 3.36Å; M310-S314 PolarHBondContact O-N 3.35Å; M310-S314 PolarHBondContact O-OG 2.75Å
311	E	57.7	Low	57.4	Low	61 Å²	61	75.3 Å²	75.3	29%	0.285	39%	0.385	S	S	.	.	H	α-helix	trans	-59.4	-41.2	166.3	-81.3	-72	151	0	0	111.4	L83 T86 A307 L313 S314 A315	L83-E311 HydrophobicContact CD1-CB 4.45Å; T86-E311 WeakPolarHBondContact CG2-OE2 3.3Å; A307-E311 WeakPolarHBondContact O-CB 3.42Å; A307-E311 VanDerWaalsContact O-CG 3.24Å; A307-E311 WeakPolarHBondContact O-CG 3.3Å; A307-E311 PolarHBondContact O-N 1.98Å; E311-L313 VanDerWaalsContact C-N 3.33Å; E311-L313 PolarHBondContact O-N 3.26Å; E311-S314 PolarHBondContact O-N 2.86Å; E311-A315 WeakPolarHBondContact O-CB 3.27Å; E311-A315 PolarHBondContact O-N 2.87Å
312	L	48.4	Very low	56.3	Low	82 Å²	82	72.5 Å²	72.5	43%	0.429	39%	0.389	S	S	.	.	H	α-helix	trans	-61.4	-42.1	174.3	-157.9	84.2	0	0	0	111.6	F308 R309 M310 L316	F308-L312 WeakPolarHBondContact O-CB 3.43Å; F308-L312 PolarHBondContact O-N 2.75Å; R309-L312 WeakPolarHBondContact O-CB 3.46Å; R309-L312 PolarHBondContact O-N 2.78Å; M310-L312 VanDerWaalsContact C-N 3.31Å; M310-L312 PolarHBondContact O-N 2.7Å; L312-L316 PolarHBondContact O-N 2.77Å
313	L	50.9	Low	55.3	Low	94 Å²	94	83.7 Å²	83.7	49%	0.492	43%	0.43	S	S	.	.	H	α-helix	trans	-75.4	-36	177.9	-72.7	167.9	0	0	0	112.6	R309 M310 E311 L316 V317	R309-L313 VanDerWaalsContact O-CG 3.32Å; R309-L313 WeakPolarHBondContact O-CG 3.4Å; R309-L313 PolarHBondContact O-N 3.02Å; M310-L313 CarbonylContact O-C 3.59Å; M310-L313 PolarHBondContact O-N 3.44Å; M310-L313 HydrophobicContact SD-CD1 4.23Å; E311-L313 VanDerWaalsContact C-N 3.33Å; E311-L313 PolarHBondContact O-N 3.26Å; L313-L316 CarbonylContact O-C 3.51Å; L313-L316 WeakPolarHBondContact O-CA 3.23Å; L313-L316 WeakPolarHBondContact O-CB 3.41Å; L313-L316 PolarHBondContact O-N 2.82Å; L313-L316 VanDerWaalsContact O-N 3.14Å; L313-V317 WeakPolarHBondContact O-CB 3.26Å; L313-V317 WeakPolarHBondContact O-CG2 2.85Å; L313-V317 PolarHBondContact O-N 3.31Å
314	S	55.8	Low	54.3	Low	21 Å²	21	88.9 Å²	88.9	15%	0.147	46%	0.463	C	S	.	.	H	α-helix	trans	-66.6	-42.1	174.8	-64.7	0	0	0	0	110.4	Y198 M310 E311 L316 V317 L318	Y198-S314 PolarHBondContact OH-OG 2.81Å; M310-S314 WeakPolarHBondContact O-CA 2.81Å; M310-S314 WeakPolarHBondContact O-CB 3.36Å; M310-S314 PolarHBondContact O-N 3.35Å; M310-S314 PolarHBondContact O-OG 2.75Å; E311-S314 PolarHBondContact O-N 2.86Å; S314-L316 PolarHBondContact O-N 3.29Å; S314-V317 PolarHBondContact O-N 2.8Å; S314-L318 WeakPolarHBondContact O-CA 3.43Å; S314-L318 WeakPolarHBondContact O-CB 3.47Å; S314-L318 WeakPolarHBondContact O-CD1 3.21Å; S314-L318 VanDerWaalsContact O-CG 3.25Å; S314-L318 WeakPolarHBondContact O-CG 3.09Å; S314-L318 PolarHBondContact O-N 2.93Å
315	A	46.5	Very low	53.2	Low	15 Å²	15	95.2 Å²	95.2	12%	0.124	49%	0.485	C	S	.	.	H	α-helix	trans	-66.2	-19.1	173.4	0	0	0	0	0	112.8	K82 E311	K82-A315 HydrophobicContact CD-CB 4.27Å; K82-A315 WeakPolarHBondContact CE-O 3.36Å; K82-A315 PolarHBondContact NZ-O 2.9Å; E311-A315 WeakPolarHBondContact O-CB 3.27Å; E311-A315 PolarHBondContact O-N 2.87Å
316	L	46.4	Very low	51.9	Low	94 Å²	94	101.6 Å²	101.6	49%	0.492	51%	0.508	S	S	.	.	H	α-helix	trans	-90.2	-39	172.9	-99.8	149.9	0	0	0	112.3	L312 L313 S314	L312-L316 PolarHBondContact O-N 2.77Å; L313-L316 CarbonylContact O-C 3.51Å; L313-L316 WeakPolarHBondContact O-CA 3.23Å; L313-L316 WeakPolarHBondContact O-CB 3.41Å; L313-L316 PolarHBondContact O-N 2.82Å; L313-L316 VanDerWaalsContact O-N 3.14Å; S314-L316 PolarHBondContact O-N 3.29Å
317	V	52.9	Low	50.6	Low	75 Å²	75	107.7 Å²	107.7	46%	0.455	54%	0.536	S	S	.	.	H	α-helix	trans	-83.7	-32.9	-177.1	172.8	0	0	0	0	112.1	L313 S314 Q319 I320 N321	L313-V317 WeakPolarHBondContact O-CB 3.26Å; L313-V317 WeakPolarHBondContact O-CG2 2.85Å; L313-V317 PolarHBondContact O-N 3.31Å; S314-V317 PolarHBondContact O-N 2.8Å; V317-Q319 PolarHBondContact O-N 3.1Å; V317-I320 PolarHBondContact O-N 2.79Å; V317-N321 PolarHBondContact O-N 2.69Å
318	L	49.2	Very low	49.6	Very low	101 Å²	101	112.3 Å²	112.3	53%	0.529	56%	0.557	S	S	.	*	H	α-helix	trans	-67.7	-23.1	172.3	-73.7	163.6	0	0	0	112.3	S314 I320 A322	S314-L318 WeakPolarHBondContact O-CA 3.43Å; S314-L318 WeakPolarHBondContact O-CB 3.47Å; S314-L318 WeakPolarHBondContact O-CD1 3.21Å; S314-L318 VanDerWaalsContact O-CG 3.25Å; S314-L318 WeakPolarHBondContact O-CG 3.09Å; S314-L318 PolarHBondContact O-N 2.93Å; L318-I320 PolarHBondContact O-N 3.25Å; L318-A322 WeakPolarHBondContact O-CB 3.49Å; L318-A322 PolarHBondContact O-N 3.48Å
319	Q	49.6	Very low	48.7	Very low	145 Å²	145	115 Å²	115	68%	0.678	58%	0.577	S	S	*	*	H	α-helix	trans	-70.4	-20.3	169.5	-81.9	-167.3	-58.7	0	0	113.1	K82 V317	K82-Q319 VanDerWaalsContact NZ-OE1 3.16Å; V317-Q319 PolarHBondContact O-N 3.1Å
320	I	48.8	Very low	47.6	Very low	133 Å²	133	114.1 Å²	114.1	68%	0.682	58%	0.584	S	S	*	*	H	α-helix	trans	-98.8	-31.8	-178	-61.2	175.1	0	0	0	111.1	V317 L318	V317-I320 PolarHBondContact O-N 2.79Å; L318-I320 PolarHBondContact O-N 3.25Å
321	N	53.9	Low	46.7	Very low	105 Å²	105	119.7 Å²	119.7	56%	0.561	61%	0.61	S	S	*	*	H	α-helix	trans	-104.1	-1.8	-171	-72.6	-18.3	0	0	0	116.4	V317 R323	V317-N321 PolarHBondContact O-N 2.69Å; N321-R323 PolarHBondContact O-N 2.84Å
322	A	45.5	Very low	45.7	Very low	87 Å²	87	119.9 Å²	119.9	72%	0.719	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	22.1	179	0	0	0	0	0	115.6	L318	L318-A322 WeakPolarHBondContact O-CB 3.49Å; L318-A322 PolarHBondContact O-N 3.48Å
323	R	48	Very low	44.9	Very low	237 Å²	237	120.5 Å²	120.5	89%	0.894	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.8	2	178.5	-82.4	-168.9	-175.3	177.4	2.7	115.6	N321	N321-R323 PolarHBondContact O-N 2.84Å
324	V	46.9	Very low	44.4	Very low	125 Å²	125	122.1 Å²	122.1	76%	0.758	65%	0.648	S	S	*	*	S	Bend	trans	-124.4	97	-174.5	-174.6	0	0	0	0	111.9
325	K	41.3	Very low	43.5	Very low	179 Å²	179	128.3 Å²	128.3	78%	0.778	68%	0.676	S	S	*	*			trans	42.7	106.8	143.8	-75.1	-175.9	170.8	-172.5	0	120.2
326	E	40.3	Very low	43.9	Very low	197 Å²	197	130.7 Å²	130.7	92%	0.921	69%	0.691	S	S	*	*			trans	-44.8	111.2	131.8	-141.3	168.9	-158	0	0	111.1
327	Q	39.1	Very low	44.3	Very low	161 Å²	161	130.9 Å²	130.9	75%	0.752	69%	0.692	S	S	*	*			trans	-169	148.9	153.9	-147.5	155.6	-21.4	0	0	112.6
328	D	40.7	Very low	44	Very low	127 Å²	127	131.2 Å²	131.2	68%	0.679	71%	0.711	S	S	*	*			trans	89.5	72.1	172.3	-70.2	-6.3	0	0	0	118.8
329	D	40	Very low	44.3	Very low	173 Å²	173	133 Å²	133	93%	0.925	72%	0.717	S	S	*	*			trans	-83	101	144.3	-70.7	-37	0	0	0	108.7
330	N	39.7	Very low	44.4	Very low	151 Å²	151	132.3 Å²	132.3	81%	0.807	72%	0.718	S	S	*	*			trans	-82.9	122.5	167.4	-99.3	-32.4	0	0	0	110	G332	N330-G332 PolarHBondContact O-N 2.54Å
331	E	39.2	Very low	44.9	Very low	150 Å²	150	128.7 Å²	128.7	70%	0.701	71%	0.708	S	S	*	*			trans	-50.7	121.4	174.4	-85.1	168.2	103.8	0	0	113.4	W556	E331-W556 VanDerWaalsContact CD-CH2 3.41Å; E331-W556 HydrophobicContact CG-CH2 3.94Å; E331-W556 HydrophobicContact CG-CZ2 4.44Å; E331-W556 WeakPolarHBondContact OE1-CH2 3.39Å; E331-W556 WeakPolarHBondContact OE1-CZ3 3.4Å
332	G	35.7	Very low	45.1	Very low	65 Å²	65	126.5 Å²	126.5	67%	0.67	70%	0.704	S	S	*	*			trans	-110.1	108.3	160.1	0	0	0	0	0	109.3	N330 I334	N330-G332 PolarHBondContact O-N 2.54Å; G332-I334 PolarHBondContact O-N 2.94Å
333	S	31.9	Very low	46	Very low	95 Å²	95	126 Å²	126	66%	0.664	70%	0.695	S	S	*	*			trans	-56.7	126.5	174.5	68.4	0	0	0	0	110.6	M335	S333-M335 VanDerWaalsContact C-N 3.31Å; S333-M335 PolarHBondContact O-N 2.77Å
334	I	41.1	Very low	46.8	Very low	129 Å²	129	116.5 Å²	116.5	66%	0.662	66%	0.661	S	S	*	*			trans	-74.7	91.3	167.1	-60.2	172.9	0	0	0	106.7	G332 C336	G332-I334 PolarHBondContact O-N 2.94Å; I334-C336 PolarHBondContact O-N 2.88Å
335	M	37.3	Very low	47.6	Very low	151 Å²	151	113.2 Å²	113.2	74%	0.744	64%	0.639	S	S	*	*			trans	-69.9	113.4	168.4	-70.2	-151.7	-77.4	0	0	108.4	S333 N337	S333-M335 VanDerWaalsContact C-N 3.31Å; S333-M335 PolarHBondContact O-N 2.77Å; M335-N337 PolarHBondContact O-N 2.92Å
336	C	53.6	Low	48.8	Very low	65 Å²	65	113.4 Å²	113.4	44%	0.439	64%	0.643	S	S	.	*			trans	-61.2	117.5	146.8	-71.1	0	0	0	0	105.2	I334 G338 C462	I334-C336 PolarHBondContact O-N 2.88Å; C336-G338 PolarHBondContact O-N 3.34Å; C336-C462 WeakPolarHBondContact CB-SG 3.39Å; C336-C462 WeakPolarHBondContact SG-CB 3.34Å; C336-C462 CovalentContact SG-SG 2.04Å; C336-C462 PolarHBondContact SG-SG 3.23Å
337	N	55	Low	50.2	Low	97 Å²	97	105.9 Å²	105.9	52%	0.519	61%	0.612	S	S	.	*			trans	-39	115.3	178.3	-84	-14.3	0	0	0	108.2	M335 E339	M335-N337 PolarHBondContact O-N 2.92Å; N337-E339 PolarHBondContact O-N 3.44Å
338	G	46.8	Very low	51.8	Low	83 Å²	83	108 Å²	108	86%	0.856	62%	0.619	S	S	*	*	S	Bend	trans	-64.9	35.3	-160.2	0	0	0	0	0	117	C336	C336-G338 PolarHBondContact O-N 3.34Å
339	E	55.9	Low	53.7	Low	137 Å²	137	108.3 Å²	108.3	64%	0.64	62%	0.616	S	S	*	*	S	Bend	trans	-88.3	125.7	165.7	-70.9	-179.2	164.1	0	0	108.8	N337 A341	N337-E339 PolarHBondContact O-N 3.44Å; E339-A341 PolarHBondContact O-N 2.86Å
340	N	52.4	Low	55.7	Low	132 Å²	132	101.8 Å²	101.8	71%	0.706	58%	0.583	S	S	*	*			trans	-56.6	113.8	172.9	-80.3	-20.9	0	0	0	108.6	A342 S343	N340-A342 HydrophobicContact CB-CB 4.31Å; N340-A342 PolarHBondContact O-N 3.38Å; N340-S343 PolarHBondContact O-N 3.18Å; N340-S343 PolarHBondContact O-OG 3.45Å; N340-S343 VanDerWaalsContact O-OG 3.11Å
341	A	57.8	Low	58.2	Low	56 Å²	56	95 Å²	95	46%	0.463	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-24.3	175.7	0	0	0	0	0	112.8	E339 S343 H344 L345	E339-A341 PolarHBondContact O-N 2.86Å; A341-S343 VanDerWaalsContact C-N 3.26Å; A341-S343 PolarHBondContact O-N 2.93Å; A341-H344 PolarHBondContact O-N 3.1Å; A341-H344 VanDerWaalsContact O-N 3.16Å; A341-L345 WeakPolarHBondContact O-CG 3.21Å
342	A	59.6	Low	60.7	Low	59 Å²	59	88.2 Å²	88.2	49%	0.488	52%	0.515	S	S	.	.	H	α-helix	trans	-50.4	-36.2	171.9	0	0	0	0	0	114.5	N340 H344 L345	N340-A342 HydrophobicContact CB-CB 4.31Å; N340-A342 PolarHBondContact O-N 3.38Å; A342-H344 PolarHBondContact O-N 3.45Å; A342-L345 WeakPolarHBondContact O-CB 3.08Å; A342-L345 PolarHBondContact O-N 3.49Å
343	S	63.2	Low	63.5	Low	77 Å²	77	86.3 Å²	86.3	54%	0.538	49%	0.488	S	S	.	.	H	α-helix	trans	-63.8	-28.7	-179.4	63.4	0	0	0	0	112.9	N340 A341	N340-S343 PolarHBondContact O-N 3.18Å; N340-S343 PolarHBondContact O-OG 3.45Å; N340-S343 VanDerWaalsContact O-OG 3.11Å; A341-S343 VanDerWaalsContact C-N 3.26Å; A341-S343 PolarHBondContact O-N 2.93Å
344	H	65.1	Low	66.5	Low	38 Å²	38	82.3 Å²	82.3	18%	0.176	46%	0.459	C	S	.	.	H	α-helix	trans	-84	-16.4	176.3	-70.9	-64.9	0	0	0	113.3	A341 A342 E346 S347 F351 F459	A341-H344 PolarHBondContact O-N 3.1Å; A341-H344 VanDerWaalsContact O-N 3.16Å; A342-H344 PolarHBondContact O-N 3.45Å; H344-E346 VanDerWaalsContact C-N 3.3Å; H344-E346 PolarHBondContact O-N 3.43Å; H344-S347 PolarHBondContact O-N 2.67Å; H344-S347 PolarHBondContact O-OG 2.84Å; H344-F351 HydrophobicContact CB-CD1 4.33Å; H344-F459 AromaticContact CD2-CZ 3.94Å; H344-F459 AromaticContact NE2-CE1 3.72Å; H344-F459 AromaticContact NE2-CZ 3.69Å
345	L	64.9	Low	69.1	Low	55 Å²	55	76.1 Å²	76.1	29%	0.288	43%	0.427	S	S	.	.	H	α-helix	trans	-73.9	-22.5	-175	-63.1	-176.8	0	0	0	113	A341 A342 F351 Y477	A341-L345 WeakPolarHBondContact O-CG 3.21Å; A342-L345 WeakPolarHBondContact O-CB 3.08Å; A342-L345 PolarHBondContact O-N 3.49Å; L345-F351 HydrophobicContact CD2-CE1 3.9Å; L345-F351 HydrophobicContact CD2-CZ 4.17Å; L345-Y477 HydrophobicContact CB-CD2 4.43Å; L345-Y477 HydrophobicContact CB-CE1 4.19Å; L345-Y477 HydrophobicContact CB-CE2 3.84Å; L345-Y477 HydrophobicContact CD1-CD2 4.14Å; L345-Y477 HydrophobicContact CD1-CE2 3.7Å; L345-Y477 HydrophobicContact CD2-CD1 4.33Å; L345-Y477 HydrophobicContact CD2-CD2 3.43Å; L345-Y477 VanDerWaalsContact CD2-CD2 3.43Å; L345-Y477 HydrophobicContact CD2-CE2 3.7Å; L345-Y477 HydrophobicContact CD2-CG 3.8Å; L345-Y477 HydrophobicContact CG-CD2 4.18Å; L345-Y477 HydrophobicContact CG-CE2 3.92Å; L345-Y477 WeakPolarHBondContact O-CE1 3.46Å
346	E	66.2	Low	71.8	Confident	184 Å²	184	69 Å²	69	86%	0.86	39%	0.392	S	S	*	.	S	Bend	trans	-89.9	-15.6	177.7	-64.6	-173.8	173.8	0	0	113.2	H344	H344-E346 VanDerWaalsContact C-N 3.3Å; H344-E346 PolarHBondContact O-N 3.43Å
347	S	68.4	Low	73.7	Confident	38 Å²	38	65.9 Å²	65.9	27%	0.266	37%	0.371	S	S	.	.	S	Bend	trans	-82.7	143	-177.6	87.8	0	0	0	0	111.1	H344 E349	H344-S347 PolarHBondContact O-N 2.67Å; H344-S347 PolarHBondContact O-OG 2.84Å; S347-E349 PolarHBondContact O-N 3.15Å; S347-E349 WeakPolarHBondContact OG-CB 3.23Å; S347-E349 PolarHBondContact OG-N 2.69Å
348	K	73.7	Confident	75.5	Confident	207 Å²	207	61.3 Å²	61.3	90%	0.9	35%	0.346	S	S	*	.	S	Bend	trans	-73.6	4.9	170.1	-69.8	-175.5	178.6	179.3	0	112.5
349	E	79.7	Confident	77.5	Confident	132 Å²	132	59.2 Å²	59.2	62%	0.617	32%	0.316	S	S	*	.	S	Bend	trans	-83.5	152.7	-175.1	-62.2	-170.1	161.3	0	0	110.8	S347	S347-E349 PolarHBondContact O-N 3.15Å; S347-E349 WeakPolarHBondContact OG-CB 3.23Å; S347-E349 PolarHBondContact OG-N 2.69Å
350	P	82.9	Confident	79	Confident	36 Å²	36	57.2 Å²	57.2	23%	0.234	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-62.5	141.1	174.1	29.7	-38.6	0	0	0	110.4	D410 I486	P350-D410 HydrophobicContact CG-CB 3.78Å; P350-I486 HydrophobicContact CB-CB 4.11Å; P350-I486 HydrophobicContact CB-CG2 4.2Å
351	F	91.3	Very high	80.4	Confident	8 Å²	8	57 Å²	57	4%	0.035	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-58.2	139.3	171.9	-59.9	-58.3	0	0	0	111.7	H344 L345 W353 N354 Y477 S479 A488	H344-F351 HydrophobicContact CB-CD1 4.33Å; L345-F351 HydrophobicContact CD2-CE1 3.9Å; L345-F351 HydrophobicContact CD2-CZ 4.17Å; F351-W353 HydrophobicContact CB-CD2 3.9Å; F351-W353 VanDerWaalsContact CB-CE2 3.4Å; F351-W353 HydrophobicContact CB-CG 4.24Å; F351-W353 HydrophobicContact CB-CH2 4.36Å; F351-W353 HydrophobicContact CB-CZ2 3.68Å; F351-W353 AromaticContact CD1-CH2 3.96Å; F351-W353 HydrophobicContact CD1-CH2 3.96Å; F351-W353 AromaticContact CD1-CZ2 3.55Å; F351-W353 HydrophobicContact CD1-CZ2 3.55Å; F351-W353 HydrophobicContact CD2-CZ2 4.21Å; F351-W353 AromaticContact CD2-NE1 4Å; F351-W353 HydrophobicContact CE1-CZ2 4.27Å; F351-W353 AromaticContact CG-CE2 3.72Å; F351-W353 HydrophobicContact CG-CH2 4.32Å; F351-W353 AromaticContact CG-CZ2 3.54Å; F351-W353 HydrophobicContact CG-CZ2 3.54Å; F351-W353 AromaticContact CG-NE1 3.8Å; F351-W353 PolarHBondContact O-N 3Å; F351-N354 PolarHBondContact N-ND2 3.03Å; F351-N354 WeakPolarHBondContact O-CB 3.1Å; F351-N354 VanDerWaalsContact O-CG 3.29Å; F351-N354 PolarHBondContact O-N 3.07Å; F351-N354 PolarHBondContact O-ND2 3.41Å; F351-Y477 HydrophobicContact CZ-CD1 4.17Å; F351-Y477 HydrophobicContact CZ-CG 4.04Å; F351-S479 WeakPolarHBondContact CD2-OG 3.41Å; F351-A488 HydrophobicContact CD2-CB 4.48Å; F351-A488 HydrophobicContact CE1-CB 4.48Å; F351-A488 HydrophobicContact CE2-CB 3.68Å; F351-A488 HydrophobicContact CZ-CB 3.67Å
352	P	92.3	Very high	81.6	Confident	8 Å²	8	58.7 Å²	58.7	5%	0.052	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-23.8	-177	22.4	-31.3	0	0	0	113	N354 A458 F459	P352-N354 VanDerWaalsContact C-N 3.26Å; P352-N354 PolarHBondContact O-N 3.23Å; P352-A458 VanDerWaalsContact O-CA 3.29Å; P352-A458 WeakPolarHBondContact O-CA 3.19Å; P352-F459 HydrophobicContact CB-CD1 3.57Å; P352-F459 HydrophobicContact CB-CE1 3.51Å; P352-F459 HydrophobicContact CB-CG 4.27Å; P352-F459 HydrophobicContact CB-CZ 4.12Å; P352-F459 HydrophobicContact CG-CD1 3.57Å; P352-F459 HydrophobicContact CG-CD2 4.38Å; P352-F459 HydrophobicContact CG-CE1 2.98Å; P352-F459 HydrophobicContact CG-CE2 3.88Å; P352-F459 HydrophobicContact CG-CG 4.26Å; P352-F459 HydrophobicContact CG-CZ 3.15Å
353	W	94.4	Very high	82.8	Confident	26 Å²	26	56.9 Å²	56.9	10%	0.098	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-4	172.3	51.3	80.3	0	0	0	113.9	F351 A355 S370 I371 F459 I461	F351-W353 HydrophobicContact CB-CD2 3.9Å; F351-W353 VanDerWaalsContact CB-CE2 3.4Å; F351-W353 HydrophobicContact CB-CG 4.24Å; F351-W353 HydrophobicContact CB-CH2 4.36Å; F351-W353 HydrophobicContact CB-CZ2 3.68Å; F351-W353 AromaticContact CD1-CH2 3.96Å; F351-W353 HydrophobicContact CD1-CH2 3.96Å; F351-W353 AromaticContact CD1-CZ2 3.55Å; F351-W353 HydrophobicContact CD1-CZ2 3.55Å; F351-W353 HydrophobicContact CD2-CZ2 4.21Å; F351-W353 AromaticContact CD2-NE1 4Å; F351-W353 HydrophobicContact CE1-CZ2 4.27Å; F351-W353 AromaticContact CG-CE2 3.72Å; F351-W353 HydrophobicContact CG-CH2 4.32Å; F351-W353 AromaticContact CG-CZ2 3.54Å; F351-W353 HydrophobicContact CG-CZ2 3.54Å; F351-W353 AromaticContact CG-NE1 3.8Å; F351-W353 PolarHBondContact O-N 3Å; W353-A355 PolarHBondContact O-N 3.18Å; W353-S370 CarbonylContact O-C 3.56Å; W353-S370 VanDerWaalsContact O-CA 3.28Å; W353-S370 WeakPolarHBondContact O-CA 3.31Å; W353-I371 PolarHBondContact O-N 2.96Å; W353-F459 WeakPolarHBondContact CA-O 3.3Å; W353-F459 VanDerWaalsContact CB-O 3.28Å; W353-F459 WeakPolarHBondContact CB-O 3.35Å; W353-F459 HydrophobicContact CE3-CD2 4.11Å; W353-F459 AromaticContact CE3-CE2 3.47Å; W353-F459 HydrophobicContact CE3-CE2 3.47Å; W353-F459 VanDerWaalsContact CE3-CE2 3.47Å; W353-F459 HydrophobicContact CE3-CZ 4.02Å; W353-F459 AromaticContact CZ3-CE2 3.52Å; W353-F459 HydrophobicContact CZ3-CE2 3.52Å; W353-F459 AromaticContact CZ3-CZ 3.8Å; W353-F459 HydrophobicContact CZ3-CZ 3.8Å; W353-I461 HydrophobicContact CB-CB 3.87Å; W353-I461 HydrophobicContact CD2-CB 4.04Å; W353-I461 HydrophobicContact CD2-CD1 4.34Å; W353-I461 HydrophobicContact CD2-CG1 4.15Å; W353-I461 HydrophobicContact CG-CB 3.73Å; W353-I461 HydrophobicContact CG-CD1 4.33Å; W353-I461 HydrophobicContact CG-CG1 4.25Å
354	N	94.7	Very high	84	Confident	10 Å²	10	57.6 Å²	57.6	5%	0.053	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	130.9	179.2	-72.6	-26.6	0	0	0	111.4	F351 P352 S479 I486	F351-N354 PolarHBondContact N-ND2 3.03Å; F351-N354 WeakPolarHBondContact O-CB 3.1Å; F351-N354 VanDerWaalsContact O-CG 3.29Å; F351-N354 PolarHBondContact O-N 3.07Å; F351-N354 PolarHBondContact O-ND2 3.41Å; P352-N354 VanDerWaalsContact C-N 3.26Å; P352-N354 PolarHBondContact O-N 3.23Å; N354-S479 PolarHBondContact ND2-OG 3.07Å; N354-S479 WeakPolarHBondContact OD1-CB 3.21Å; N354-S479 PolarHBondContact OD1-OG 3.33Å; N354-I486 HydrophobicContact CB-CD1 4.41Å
355	A	95.1	Very high	85.2	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	140.1	171.3	0	0	0	0	0	109.8	W353 L368 G369 I371 I383 V405 H406	W353-A355 PolarHBondContact O-N 3.18Å; A355-L368 CarbonylContact O-C 3.53Å; A355-L368 WeakPolarHBondContact O-CA 3.35Å; A355-G369 PolarHBondContact N-O 3.41Å; A355-G369 PolarHBondContact O-N 3.3Å; A355-I371 HydrophobicContact CB-CG1 4.48Å; A355-I383 HydrophobicContact CB-CD1 3.91Å; A355-I383 HydrophobicContact CB-CG1 4.47Å; A355-I383 HydrophobicContact CB-CG2 3.8Å; A355-V405 HydrophobicContact CB-CG1 3.76Å; A355-H406 CarbonylContact C-O 3.52Å; A355-H406 WeakPolarHBondContact CA-O 3.16Å
356	V	94.8	Very high	86.4	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	122.8	177.5	-174.6	0	0	0	0	109.4	V365 L368 V405 H406 V412 I486	V356-V365 HydrophobicContact CG1-CB 4.08Å; V356-V365 HydrophobicContact CG1-CG1 3.53Å; V356-V365 HydrophobicContact CG1-CG2 3.46Å; V356-V365 VanDerWaalsContact CG1-CG2 3.46Å; V356-L368 HydrophobicContact CB-CD2 4.48Å; V356-L368 HydrophobicContact CG1-CD2 4.46Å; V356-L368 HydrophobicContact CG2-CD2 3.9Å; V356-V405 CarbonylContact O-C 3.51Å; V356-V405 WeakPolarHBondContact O-CA 3.5Å; V356-H406 HydrophobicContact CB-CB 4.25Å; V356-H406 PolarHBondContact N-O 3.44Å; V356-H406 PolarHBondContact O-N 3.45Å; V356-V412 HydrophobicContact CB-CG2 4.01Å; V356-V412 HydrophobicContact CG1-CB 4.11Å; V356-V412 HydrophobicContact CG1-CG1 4.04Å; V356-V412 HydrophobicContact CG1-CG2 4.01Å; V356-V412 HydrophobicContact CG2-CG2 3.88Å; V356-I486 HydrophobicContact CG2-CD1 3.3Å; V356-I486 HydrophobicContact CG2-CG1 4.1Å
357	I	94.2	Very high	87.7	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	118.9	178	-58.1	153.8	0	0	0	107.6	I366 C367 T385 L403 V405 L446	I357-I366 PolarHBondContact O-N 2.84Å; I357-C367 HydrophobicContact CB-CB 4.33Å; I357-C367 HydrophobicContact CD1-CB 3.97Å; I357-C367 PolarHBondContact N-O 3.39Å; I357-C367 PolarHBondContact O-N 2.97Å; I357-T385 HydrophobicContact CD1-CG2 3.84Å; I357-T385 WeakPolarHBondContact CD1-OG1 3.37Å; I357-L403 HydrophobicContact CG2-CD1 4.43Å; I357-V405 HydrophobicContact CG1-CG2 4.29Å; I357-L446 HydrophobicContact CD1-CD1 3.57Å; I357-L446 HydrophobicContact CG1-CD1 3.79Å
358	S	92.6	Very high	88.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	160.3	-176.2	77.6	0	0	0	0	112.6	K360 H364 L403 Q404 H406	S358-K360 PolarHBondContact O-N 3.33Å; S358-H364 CarbonylContact C-O 3.57Å; S358-H364 WeakPolarHBondContact CA-O 3.44Å; S358-H364 WeakPolarHBondContact CB-O 3.47Å; S358-L403 WeakPolarHBondContact O-CA 3.13Å; S358-Q404 PolarHBondContact N-O 3.17Å; S358-Q404 PolarHBondContact O-N 2.94Å; S358-Q404 WeakPolarHBondContact OG-CG 3.39Å; S358-H406 PolarHBondContact OG-CD2 3.29Å; S358-H406 PolarHBondContact OG-NE2 2.95Å
359	L	88.5	Confident	90	Very high	40 Å²	40	35.3 Å²	35.3	21%	0.209	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	123.3	167.3	-68.4	175.3	0	0	0	109.6	V361 I362 N363 H364 I366 V402 L403	L359-V361 VanDerWaalsContact C-N 3.25Å; L359-V361 PolarHBondContact O-N 2.93Å; L359-V361 VanDerWaalsContact O-N 3.16Å; L359-I362 HydrophobicContact CB-CG1 3.83Å; L359-I362 HydrophobicContact CD1-CD1 3.76Å; L359-I362 HydrophobicContact CD1-CG1 3.93Å; L359-I362 PolarHBondContact O-N 3.25Å; L359-N363 WeakPolarHBondContact O-CA 3.35Å; L359-N363 PolarHBondContact O-N 3.41Å; L359-H364 HydrophobicContact CB-CB 4.48Å; L359-H364 HydrophobicContact CD1-CB 4.18Å; L359-H364 PolarHBondContact N-O 3.3Å; L359-I366 HydrophobicContact CD2-CD1 3.71Å; L359-I366 HydrophobicContact CG-CD1 3.83Å; L359-I366 HydrophobicContact CG-CG1 4.12Å; L359-V402 HydrophobicContact CD2-CG1 3.45Å; L359-V402 VanDerWaalsContact CD2-CG1 3.45Å; L359-L403 HydrophobicContact CD2-CD2 3.84Å
360	K	86.6	Confident	90.7	Very high	94 Å²	94	29.8 Å²	29.8	41%	0.409	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-36.8	-177.9	-178.2	-175.2	176.3	-161.9	0	114	S358 V402	S358-K360 PolarHBondContact O-N 3.33Å; K360-V402 VanDerWaalsContact CB-O 3.32Å; K360-V402 WeakPolarHBondContact CB-O 3.35Å; K360-V402 PolarHBondContact N-O 3.48Å
361	V	81.9	Confident	91.3	Very high	129 Å²	129	28 Å²	28	78%	0.782	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-41.8	-172.3	-178.3	0	0	0	0	112.1	L359	L359-V361 VanDerWaalsContact C-N 3.25Å; L359-V361 PolarHBondContact O-N 2.93Å; L359-V361 VanDerWaalsContact O-N 3.16Å
362	I	84.5	Confident	91.4	Very high	90 Å²	90	28.7 Å²	28.7	46%	0.462	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.8	3.1	-172.4	61	168.7	0	0	0	113.5	L359 H364 P414	L359-I362 HydrophobicContact CB-CG1 3.83Å; L359-I362 HydrophobicContact CD1-CD1 3.76Å; L359-I362 HydrophobicContact CD1-CG1 3.93Å; L359-I362 PolarHBondContact O-N 3.25Å; I362-H364 HydrophobicContact CD1-CB 3.54Å; I362-H364 HydrophobicContact CG1-CB 3.63Å; I362-H364 PolarHBondContact O-N 3.08Å; I362-P414 WeakPolarHBondContact O-CA 3.5Å
363	N	85	Confident	91.3	Very high	22 Å²	22	30.4 Å²	30.4	12%	0.118	16%	0.161	C	C	.	.			trans	47.3	26.3	-173.2	-62.8	-41.7	0	0	0	114.1	L359 V365 Q404 G413	L359-N363 WeakPolarHBondContact O-CA 3.35Å; L359-N363 PolarHBondContact O-N 3.41Å; N363-V365 PolarHBondContact O-N 3.07Å; N363-Q404 PolarHBondContact OD1-NE2 2.83Å; N363-G413 VanDerWaalsContact CB-O 3.24Å; N363-G413 WeakPolarHBondContact CB-O 3.22Å
364	H	86.4	Confident	90.7	Very high	92 Å²	92	32.4 Å²	32.4	43%	0.426	17%	0.173	S	C	.	.			trans	-74	119.4	177.1	179.9	74.2	0	0	0	108.7	S358 L359 I362 I366	S358-H364 CarbonylContact C-O 3.57Å; S358-H364 WeakPolarHBondContact CA-O 3.44Å; S358-H364 WeakPolarHBondContact CB-O 3.47Å; L359-H364 HydrophobicContact CB-CB 4.48Å; L359-H364 HydrophobicContact CD1-CB 4.18Å; L359-H364 PolarHBondContact N-O 3.3Å; I362-H364 HydrophobicContact CD1-CB 3.54Å; I362-H364 HydrophobicContact CG1-CB 3.63Å; I362-H364 PolarHBondContact O-N 3.08Å; H364-I366 PolarHBondContact O-N 3.11Å
365	V	90.6	Very high	89.6	Confident	8 Å²	8	36.3 Å²	36.3	5%	0.048	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	124.2	179.5	177.3	0	0	0	0	109.3	V356 N363 V412 Y481	V356-V365 HydrophobicContact CG1-CB 4.08Å; V356-V365 HydrophobicContact CG1-CG1 3.53Å; V356-V365 HydrophobicContact CG1-CG2 3.46Å; V356-V365 VanDerWaalsContact CG1-CG2 3.46Å; N363-V365 PolarHBondContact O-N 3.07Å; V365-V412 HydrophobicContact CG2-CB 3.92Å; V365-V412 HydrophobicContact CG2-CG1 3.52Å; V365-Y481 HydrophobicContact CB-CD1 4.15Å; V365-Y481 HydrophobicContact CB-CE1 3.77Å; V365-Y481 HydrophobicContact CB-CE2 4.3Å; V365-Y481 HydrophobicContact CG1-CD1 4.06Å; V365-Y481 HydrophobicContact CG1-CD2 4.42Å; V365-Y481 HydrophobicContact CG1-CE1 4.21Å; V365-Y481 HydrophobicContact CG1-CG 4.15Å; V365-Y481 HydrophobicContact CG2-CD2 4.28Å; V365-Y481 HydrophobicContact CG2-CE1 3.95Å; V365-Y481 HydrophobicContact CG2-CE2 3.65Å; V365-Y481 VanDerWaalsContact CG2-CZ 3.44Å
366	I	89.9	Confident	88.6	Confident	23 Å²	23	40.9 Å²	40.9	12%	0.118	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-45.9	176.9	-55.4	-177.2	0	0	0	109.6	I357 L359 H364 L403 Y538	I357-I366 PolarHBondContact O-N 2.84Å; L359-I366 HydrophobicContact CD2-CD1 3.71Å; L359-I366 HydrophobicContact CG-CD1 3.83Å; L359-I366 HydrophobicContact CG-CG1 4.12Å; H364-I366 PolarHBondContact O-N 3.11Å; I366-L403 HydrophobicContact CD1-CD2 3.25Å; I366-Y538 WeakPolarHBondContact O-CD1 3.36Å
367	C	93.7	Very high	87.7	Confident	14 Å²	14	43.5 Å²	43.5	10%	0.095	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	164	-172.5	-88	0	0	0	0	112	I357 C389	I357-C367 HydrophobicContact CB-CB 4.33Å; I357-C367 HydrophobicContact CD1-CB 3.97Å; I357-C367 PolarHBondContact N-O 3.39Å; I357-C367 PolarHBondContact O-N 2.97Å; C367-C389 HydrophobicContact CB-CB 3.77Å; C367-C389 WeakPolarHBondContact CB-SG 3.45Å; C367-C389 WeakPolarHBondContact SG-CA 3.48Å; C367-C389 WeakPolarHBondContact SG-CB 3.21Å; C367-C389 CovalentContact SG-SG 2.02Å; C367-C389 PolarHBondContact SG-SG 3.31Å
368	L	94.7	Very high	87.5	Confident	8 Å²	8	49 Å²	49	4%	0.042	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	162.7	164.4	-63.1	177.6	0	0	0	110.4	A355 V356 T385 S479 L543	A355-L368 CarbonylContact O-C 3.53Å; A355-L368 WeakPolarHBondContact O-CA 3.35Å; V356-L368 HydrophobicContact CB-CD2 4.48Å; V356-L368 HydrophobicContact CG1-CD2 4.46Å; V356-L368 HydrophobicContact CG2-CD2 3.9Å; L368-T385 PolarHBondContact O-OG1 3.23Å; L368-S479 WeakPolarHBondContact CD1-O 3.45Å; L368-L543 WeakPolarHBondContact O-CD1 3.2Å
369	G	95.6	Very high	87.3	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	171.1	177.9	0	0	0	0	0	110.4	A355 L384	A355-G369 PolarHBondContact N-O 3.41Å; A355-G369 PolarHBondContact O-N 3.3Å; G369-L384 CarbonylContact C-O 3.48Å; G369-L384 WeakPolarHBondContact CA-O 3.31Å
370	S	95.6	Very high	87.5	Confident	15 Å²	15	48.3 Å²	48.3	11%	0.105	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	133.4	175.8	-54.2	0	0	0	0	110.2	W353 I372 I383 L384	W353-S370 CarbonylContact O-C 3.56Å; W353-S370 VanDerWaalsContact O-CA 3.28Å; W353-S370 WeakPolarHBondContact O-CA 3.31Å; S370-I372 PolarHBondContact O-N 3.16Å; S370-I383 CarbonylContact O-C 3.32Å; S370-I383 WeakPolarHBondContact O-CA 3.41Å; S370-L384 PolarHBondContact N-O 3.09Å; S370-L384 PolarHBondContact O-N 3.39Å
371	I	95.4	Very high	87.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	120.6	172.2	-58	158.8	0	0	0	107.3	W353 A355 I383 F407 V452 F454 A458 A460 I461	W353-I371 PolarHBondContact O-N 2.96Å; A355-I371 HydrophobicContact CB-CG1 4.48Å; I371-I383 HydrophobicContact CB-CD1 4.11Å; I371-I383 HydrophobicContact CG1-CD1 3.51Å; I371-I383 HydrophobicContact CG2-CD1 4.45Å; I371-F407 HydrophobicContact CD1-CB 4.19Å; I371-V452 HydrophobicContact CD1-CG1 3.88Å; I371-V452 HydrophobicContact CD1-CG2 4.42Å; I371-V452 HydrophobicContact CG1-CG2 4.37Å; I371-V452 HydrophobicContact CG2-CB 4.46Å; I371-F454 HydrophobicContact CG2-CE1 4.1Å; I371-A458 HydrophobicContact CD1-CB 4.1Å; I371-A460 HydrophobicContact CG2-CB 3.97Å; I371-A460 CarbonylContact O-C 3.55Å; I371-A460 VanDerWaalsContact O-CA 3.23Å; I371-A460 WeakPolarHBondContact O-CA 3.22Å; I371-I461 PolarHBondContact O-N 2.83Å
372	I	93.7	Very high	88.4	Confident	21 Å²	21	39.3 Å²	39.3	11%	0.108	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	150.9	177.6	54	165.9	0	0	0	110	S370 D374 S380 A382 L384 I445 I461	S370-I372 PolarHBondContact O-N 3.16Å; I372-D374 PolarHBondContact O-N 3.48Å; I372-S380 VanDerWaalsContact O-CB 3.25Å; I372-S380 WeakPolarHBondContact O-CB 3.31Å; I372-S380 PolarHBondContact O-OG 3.32Å; I372-A382 HydrophobicContact CD1-CB 3.93Å; I372-A382 HydrophobicContact CG1-CB 3.64Å; I372-A382 WeakPolarHBondContact CG1-O 3.49Å; I372-A382 PolarHBondContact N-O 2.73Å; I372-A382 VanDerWaalsContact N-O 3.1Å; I372-L384 HydrophobicContact CD1-CB 4.22Å; I372-L384 HydrophobicContact CG1-CB 4.39Å; I372-L384 HydrophobicContact CG2-CB 3.64Å; I372-L384 HydrophobicContact CG2-CD2 4.22Å; I372-I445 HydrophobicContact CD1-CG1 4.47Å; I372-I445 HydrophobicContact CD1-CG2 4.41Å; I372-I461 HydrophobicContact CG2-CG2 4.21Å
373	P	89	Confident	88.9	Confident	44 Å²	44	35 Å²	35	29%	0.286	18%	0.181	S	C	.	.			trans	-68.5	123.3	176.6	28	-33.2	0	0	0	109.2	A460 I461 T463	P373-A460 HydrophobicContact CB-CB 4.3Å; P373-I461 VanDerWaalsContact CD-O 3.28Å; P373-I461 WeakPolarHBondContact CD-O 3.23Å; P373-T463 HydrophobicContact CG-CG2 4.44Å
374	D	81.4	Confident	89.4	Confident	68 Å²	68	35.4 Å²	35.4	36%	0.364	18%	0.182	S	C	.	.	S	Bend	trans	-82	-35.5	169.6	-177.8	36.2	0	0	0	110.1	I372 A382	I372-D374 PolarHBondContact O-N 3.48Å; D374-A382 HydrophobicContact CB-CB 4.29Å
375	R	71.8	Confident	89.8	Confident	93 Å²	93	31 Å²	31	35%	0.351	16%	0.162	S	C	.	.	S	Bend	trans	-157.9	166.5	-169.9	-66.5	-170	-170.5	-157.4	-2.2	110.5	Y377	R375-Y377 HydrophobicContact CB-CD2 3.36Å; R375-Y377 HydrophobicContact CB-CE2 3.7Å; R375-Y377 HydrophobicContact CB-CG 4.24Å; R375-Y377 VanDerWaalsContact CD-CE2 3.48Å; R375-Y377 HydrophobicContact CG-CD2 4.2Å; R375-Y377 HydrophobicContact CG-CE2 4.18Å; R375-Y377 PolarHBondContact O-N 3.38Å
376	P	75	Confident	89.7	Confident	95 Å²	95	30.9 Å²	30.9	62%	0.617	16%	0.162	S	C	*	.	S	Bend	trans	-73.8	49.5	174.7	33.6	-38.8	0	0	0	112.2
377	Y	76.7	Confident	89.6	Confident	56 Å²	56	29.9 Å²	29.9	22%	0.22	16%	0.157	C	C	.	.	S	Bend	trans	-118.8	159.6	178.6	-61.2	-52.3	0	0	0	110.5	I193 R375 Y379 F454	I193-Y377 WeakPolarHBondContact CG2-OH 3.48Å; R375-Y377 HydrophobicContact CB-CD2 3.36Å; R375-Y377 HydrophobicContact CB-CE2 3.7Å; R375-Y377 HydrophobicContact CB-CG 4.24Å; R375-Y377 VanDerWaalsContact CD-CE2 3.48Å; R375-Y377 HydrophobicContact CG-CD2 4.2Å; R375-Y377 HydrophobicContact CG-CE2 4.18Å; R375-Y377 PolarHBondContact O-N 3.38Å; Y377-Y379 HydrophobicContact CD2-CE1 4.04Å; Y377-Y379 HydrophobicContact CD2-CE2 4.24Å; Y377-Y379 AromaticContact CD2-CZ 3.61Å; Y377-Y379 VanDerWaalsContact CD2-OH 3.26Å; Y377-Y379 WeakPolarHBondContact CD2-OH 3.29Å; Y377-Y379 AromaticContact CG-CE1 3.83Å; Y377-Y379 HydrophobicContact CG-CE1 3.83Å; Y377-Y379 AromaticContact CG-CZ 3.91Å; Y377-Y379 PolarHBondContact O-N 3.07Å; Y377-F454 WeakPolarHBondContact O-CE2 3.25Å
378	N	88.2	Confident	89.3	Confident	116 Å²	116	34.4 Å²	34.4	62%	0.62	18%	0.175	S	C	*	.	S	Bend	trans	-74.6	30.5	175.1	-64.3	-11.6	0	0	0	112.8	F454	N378-F454 WeakPolarHBondContact O-CB 3.26Å; N378-F454 PolarHBondContact O-N 3.49Å
379	Y	88.8	Confident	89	Confident	25 Å²	25	34.6 Å²	34.6	10%	0.098	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	158.3	176.8	66.6	-98	0	0	0	111.3	A242 Y377 F381 P451 V452 F454	A242-Y379 HydrophobicContact CB-CD1 4.39Å; A242-Y379 HydrophobicContact CB-CE1 3.88Å; Y377-Y379 HydrophobicContact CD2-CE1 4.04Å; Y377-Y379 HydrophobicContact CD2-CE2 4.24Å; Y377-Y379 AromaticContact CD2-CZ 3.61Å; Y377-Y379 VanDerWaalsContact CD2-OH 3.26Å; Y377-Y379 WeakPolarHBondContact CD2-OH 3.29Å; Y377-Y379 AromaticContact CG-CE1 3.83Å; Y377-Y379 HydrophobicContact CG-CE1 3.83Å; Y377-Y379 AromaticContact CG-CZ 3.91Å; Y377-Y379 PolarHBondContact O-N 3.07Å; Y379-F381 HydrophobicContact CD2-CD2 4.05Å; Y379-F381 AromaticContact CD2-CE2 3.84Å; Y379-F381 HydrophobicContact CD2-CE2 3.84Å; Y379-F381 AromaticContact CE2-CD2 3.81Å; Y379-F381 HydrophobicContact CE2-CD2 3.81Å; Y379-F381 AromaticContact CE2-CE2 3.41Å; Y379-F381 HydrophobicContact CE2-CE2 3.41Å; Y379-F381 VanDerWaalsContact CE2-CE2 3.41Å; Y379-F381 HydrophobicContact CE2-CZ 4.43Å; Y379-P451 HydrophobicContact CD2-CB 3.75Å; Y379-P451 HydrophobicContact CD2-CG 4.39Å; Y379-P451 HydrophobicContact CG-CB 4.21Å; Y379-V452 CarbonylContact C-O 3.52Å; Y379-V452 WeakPolarHBondContact CA-O 3.34Å; Y379-V452 VanDerWaalsContact CB-O 3.29Å; Y379-V452 WeakPolarHBondContact CB-O 3.05Å; Y379-F454 VanDerWaalsContact C-CZ 3.48Å
380	S	92.4	Very high	88.5	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	139.4	172.7	177.2	0	0	0	0	112.8	I372 A382 P451 V452	I372-S380 VanDerWaalsContact O-CB 3.25Å; I372-S380 WeakPolarHBondContact O-CB 3.31Å; I372-S380 PolarHBondContact O-OG 3.32Å; S380-A382 PolarHBondContact OG-N 2.58Å; S380-A382 PolarHBondContact OG-O 2.84Å; S380-P451 CarbonylContact O-C 3.48Å; S380-P451 WeakPolarHBondContact O-CA 3.47Å; S380-V452 PolarHBondContact N-O 3.09Å; S380-V452 PolarHBondContact O-N 2.95Å
381	F	93.2	Very high	87.4	Confident	31 Å²	31	36.5 Å²	36.5	14%	0.136	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-4.4	168.3	-73.7	-80.1	0	0	0	113.3	I238 Y379 L447 L448 P451	I238-F381 HydrophobicContact CD1-CZ 4.46Å; I238-F381 HydrophobicContact CG2-CZ 4.15Å; Y379-F381 HydrophobicContact CD2-CD2 4.05Å; Y379-F381 AromaticContact CD2-CE2 3.84Å; Y379-F381 HydrophobicContact CD2-CE2 3.84Å; Y379-F381 AromaticContact CE2-CD2 3.81Å; Y379-F381 HydrophobicContact CE2-CD2 3.81Å; Y379-F381 AromaticContact CE2-CE2 3.41Å; Y379-F381 HydrophobicContact CE2-CE2 3.41Å; Y379-F381 VanDerWaalsContact CE2-CE2 3.41Å; Y379-F381 HydrophobicContact CE2-CZ 4.43Å; F381-L447 CarbonylContact O-C 3.51Å; F381-L447 WeakPolarHBondContact O-CA 3.45Å; F381-L448 WeakPolarHBondContact O-CG 3.29Å; F381-L448 PolarHBondContact O-N 3.46Å; F381-P451 HydrophobicContact CD1-CB 3.84Å; F381-P451 HydrophobicContact CD2-CB 4.14Å; F381-P451 HydrophobicContact CE1-CB 3.6Å; F381-P451 VanDerWaalsContact CE1-CD 3.41Å; F381-P451 HydrophobicContact CE1-CG 3.81Å; F381-P451 HydrophobicContact CE2-CB 3.92Å; F381-P451 HydrophobicContact CE2-CG 4.33Å; F381-P451 HydrophobicContact CG-CB 4.11Å; F381-P451 HydrophobicContact CZ-CB 3.63Å; F381-P451 HydrophobicContact CZ-CG 3.68Å
382	A	94.8	Very high	86.3	Confident	4 Å²	4	45.4 Å²	45.4	3%	0.033	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	128.1	-165.1	0	0	0	0	0	111.7	I372 D374 S380 I445 L446 L447	I372-A382 HydrophobicContact CD1-CB 3.93Å; I372-A382 HydrophobicContact CG1-CB 3.64Å; I372-A382 WeakPolarHBondContact CG1-O 3.49Å; I372-A382 PolarHBondContact N-O 2.73Å; I372-A382 VanDerWaalsContact N-O 3.1Å; D374-A382 HydrophobicContact CB-CB 4.29Å; S380-A382 PolarHBondContact OG-N 2.58Å; S380-A382 PolarHBondContact OG-O 2.84Å; A382-I445 HydrophobicContact CB-CG2 4.16Å; A382-L446 WeakPolarHBondContact CA-O 2.93Å; A382-L447 HydrophobicContact CB-CD2 4.42Å
383	I	95.4	Very high	84.8	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	124.1	170.9	-55	-63.3	0	0	0	107.9	A355 S370 I371 V405 I445 L446 L448 V452	A355-I383 HydrophobicContact CB-CD1 3.91Å; A355-I383 HydrophobicContact CB-CG1 4.47Å; A355-I383 HydrophobicContact CB-CG2 3.8Å; S370-I383 CarbonylContact O-C 3.32Å; S370-I383 WeakPolarHBondContact O-CA 3.41Å; I371-I383 HydrophobicContact CB-CD1 4.11Å; I371-I383 HydrophobicContact CG1-CD1 3.51Å; I371-I383 HydrophobicContact CG2-CD1 4.45Å; I383-V405 HydrophobicContact CD1-CG1 4.47Å; I383-V405 HydrophobicContact CG1-CG1 4.17Å; I383-I445 CarbonylContact O-C 3.5Å; I383-I445 WeakPolarHBondContact O-CA 3.28Å; I383-L446 HydrophobicContact CB-CB 4.16Å; I383-L446 HydrophobicContact CB-CD1 4.41Å; I383-L446 HydrophobicContact CB-CG 4.44Å; I383-L446 HydrophobicContact CG2-CD1 4.34Å; I383-L446 PolarHBondContact N-O 3.07Å; I383-L446 PolarHBondContact O-N 2.86Å; I383-L448 HydrophobicContact CD1-CD1 4.15Å; I383-L448 HydrophobicContact CG1-CD1 3.91Å; I383-L448 HydrophobicContact CG1-CD2 4.06Å; I383-L448 HydrophobicContact CG1-CG 4.07Å; I383-V452 HydrophobicContact CD1-CG2 4.41Å
384	L	94.9	Very high	83.6	Confident	29 Å²	29	56 Å²	56	15%	0.152	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	132.6	169.3	-169.5	64.6	0	0	0	108.8	G369 S370 I372 P443 A444 I445 L543	G369-L384 CarbonylContact C-O 3.48Å; G369-L384 WeakPolarHBondContact CA-O 3.31Å; S370-L384 PolarHBondContact N-O 3.09Å; S370-L384 PolarHBondContact O-N 3.39Å; I372-L384 HydrophobicContact CD1-CB 4.22Å; I372-L384 HydrophobicContact CG1-CB 4.39Å; I372-L384 HydrophobicContact CG2-CB 3.64Å; I372-L384 HydrophobicContact CG2-CD2 4.22Å; L384-P443 HydrophobicContact CD1-CB 3.9Å; L384-A444 CarbonylContact C-O 3.49Å; L384-I445 HydrophobicContact CD1-CG1 3.96Å; L384-L543 HydrophobicContact CB-CD2 4.29Å; L384-L543 HydrophobicContact CD2-CD2 4.34Å; L384-L543 HydrophobicContact CG-CD2 3.77Å; L384-L543 WeakPolarHBondContact O-CD2 3.33Å
385	T	94.4	Very high	82.8	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	171.2	173.9	-168.3	0	0	0	0	111.7	I357 L368 F390 A444 L446	I357-T385 HydrophobicContact CD1-CG2 3.84Å; I357-T385 WeakPolarHBondContact CD1-OG1 3.37Å; L368-T385 PolarHBondContact O-OG1 3.23Å; T385-F390 HydrophobicContact CG2-CE2 3.48Å; T385-F390 VanDerWaalsContact CG2-CE2 3.48Å; T385-F390 HydrophobicContact CG2-CZ 3.85Å; T385-A444 HydrophobicContact CG2-CB 4Å; T385-A444 PolarHBondContact N-O 2.67Å; T385-A444 PolarHBondContact O-N 3.25Å; T385-A444 VanDerWaalsContact O-O 3.06Å; T385-L446 HydrophobicContact CG2-CD1 3.89Å; T385-L446 HydrophobicContact CG2-CD2 3.83Å; T385-L446 HydrophobicContact CG2-CG 3.8Å
386	S	90.1	Very high	82.4	Confident	6 Å²	6	52.3 Å²	52.3	4%	0.042	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	138.5	174.4	172.1	0	0	0	0	109.9	K388 C389 E542	S386-K388 PolarHBondContact O-N 3.23Å; S386-K388 VanDerWaalsContact OG-CB 3.29Å; S386-K388 WeakPolarHBondContact OG-CB 3.38Å; S386-K388 PolarHBondContact OG-N 2.81Å; S386-K388 VanDerWaalsContact OG-N 3.11Å; S386-C389 WeakPolarHBondContact O-CB 3.19Å; S386-C389 PolarHBondContact O-N 3.25Å; S386-C389 PolarHBondContact O-SG 2.81Å; S386-E542 WeakPolarHBondContact CB-OE2 3.16Å; S386-E542 PolarHBondContact OG-OE2 3.14Å
387	G	87.4	Confident	82.1	Confident	2 Å²	2	56.4 Å²	56.4	2%	0.021	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-64.1	-23	172.3	0	0	0	0	0	112.8	C389 F390 R442	G387-C389 PolarHBondContact O-N 2.97Å; G387-F390 PolarHBondContact O-N 2.76Å; G387-R442 WeakPolarHBondContact CA-O 3.23Å; G387-R442 PolarHBondContact N-O 3.45Å
388	K	86	Confident	82.1	Confident	108 Å²	108	57.5 Å²	57.5	47%	0.47	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-60	-28.1	174.4	-157.2	175.6	-174.9	179	0	112.8	S386 F390 S391 L440 E542	S386-K388 PolarHBondContact O-N 3.23Å; S386-K388 VanDerWaalsContact OG-CB 3.29Å; S386-K388 WeakPolarHBondContact OG-CB 3.38Å; S386-K388 PolarHBondContact OG-N 2.81Å; S386-K388 VanDerWaalsContact OG-N 3.11Å; K388-F390 PolarHBondContact O-N 2.88Å; K388-F390 VanDerWaalsContact O-N 3.09Å; K388-S391 WeakPolarHBondContact O-CB 3.33Å; K388-S391 PolarHBondContact O-N 2.98Å; K388-S391 VanDerWaalsContact O-N 3.07Å; K388-S391 PolarHBondContact O-OG 2.02Å; K388-L440 VanDerWaalsContact CB-O 3.27Å; K388-L440 WeakPolarHBondContact CB-O 3.1Å; K388-L440 PolarHBondContact N-O 3.35Å; K388-E542 VanDerWaalsContact CB-OE2 3.27Å; K388-E542 WeakPolarHBondContact CB-OE2 3.49Å; K388-E542 WeakPolarHBondContact CD-OE1 3.48Å; K388-E542 VanDerWaalsContact CD-OE2 3.24Å; K388-E542 WeakPolarHBondContact CD-OE2 3.48Å; K388-E542 WeakPolarHBondContact CE-OE1 3.19Å; K388-E542 IonicContact NZ-OE1 2.67Å; K388-E542 PolarHBondContact NZ-OE1 2.73Å
389	C	88.9	Confident	81.5	Confident	12 Å²	12	52 Å²	52	8%	0.081	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-57.1	-23.6	174.4	-61.8	0	0	0	0	113.2	C367 S386 G387	C367-C389 HydrophobicContact CB-CB 3.77Å; C367-C389 WeakPolarHBondContact CB-SG 3.45Å; C367-C389 WeakPolarHBondContact SG-CA 3.48Å; C367-C389 WeakPolarHBondContact SG-CB 3.21Å; C367-C389 CovalentContact SG-SG 2.02Å; C367-C389 PolarHBondContact SG-SG 3.31Å; S386-C389 WeakPolarHBondContact O-CB 3.19Å; S386-C389 PolarHBondContact O-N 3.25Å; S386-C389 PolarHBondContact O-SG 2.81Å; G387-C389 PolarHBondContact O-N 2.97Å
390	F	85.6	Confident	80.8	Confident	5 Å²	5	52.5 Å²	52.5	2%	0.022	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-116.6	18.3	-178.9	-45.7	-72.9	0	0	0	112.8	T385 G387 K388 W392 D396 L403 I427 F429 A444 L446	T385-F390 HydrophobicContact CG2-CE2 3.48Å; T385-F390 VanDerWaalsContact CG2-CE2 3.48Å; T385-F390 HydrophobicContact CG2-CZ 3.85Å; G387-F390 PolarHBondContact O-N 2.76Å; K388-F390 PolarHBondContact O-N 2.88Å; K388-F390 VanDerWaalsContact O-N 3.09Å; F390-W392 PolarHBondContact O-N 3.19Å; F390-D396 VanDerWaalsContact CB-OD1 3.23Å; F390-D396 WeakPolarHBondContact CB-OD1 3.1Å; F390-L403 HydrophobicContact CD1-CD1 4.03Å; F390-L403 HydrophobicContact CE1-CD1 3.56Å; F390-I427 HydrophobicContact CD1-CD1 3.57Å; F390-I427 HydrophobicContact CD2-CD1 4.32Å; F390-I427 HydrophobicContact CD2-CG2 4.15Å; F390-I427 HydrophobicContact CE1-CD1 3.46Å; F390-I427 VanDerWaalsContact CE1-CD1 3.46Å; F390-I427 HydrophobicContact CE2-CD1 4.22Å; F390-I427 HydrophobicContact CE2-CG2 4.19Å; F390-I427 HydrophobicContact CG-CD1 4.02Å; F390-I427 HydrophobicContact CZ-CD1 3.83Å; F390-F429 HydrophobicContact CB-CE1 4.44Å; F390-F429 HydrophobicContact CB-CZ 4.06Å; F390-F429 HydrophobicContact CD2-CE1 4.21Å; F390-F429 HydrophobicContact CD2-CZ 4.29Å; F390-A444 HydrophobicContact CD2-CB 3.99Å; F390-A444 HydrophobicContact CE2-CB 3.79Å; F390-L446 HydrophobicContact CE1-CD2 4.27Å; F390-L446 HydrophobicContact CE2-CD2 3.55Å; F390-L446 HydrophobicContact CZ-CD1 4.11Å; F390-L446 HydrophobicContact CZ-CD2 3.29Å; F390-L446 HydrophobicContact CZ-CG 4.28Å
391	S	73.2	Confident	80.2	Confident	52 Å²	52	59.3 Å²	59.3	36%	0.364	28%	0.281	S	S	.	.			trans	-53	-24.7	179	54.1	0	0	0	0	114.2	K388 K393	K388-S391 WeakPolarHBondContact O-CB 3.33Å; K388-S391 PolarHBondContact O-N 2.98Å; K388-S391 VanDerWaalsContact O-N 3.07Å; K388-S391 PolarHBondContact O-OG 2.02Å; S391-K393 PolarHBondContact O-N 3.25Å
392	W	72.2	Confident	79.9	Confident	186 Å²	186	60.1 Å²	60.1	71%	0.705	29%	0.288	S	S	*	.	S	Bend	trans	-79.9	111	176.6	-66.1	35.8	0	0	0	108.5	F390 I394 L395	F390-W392 PolarHBondContact O-N 3.19Å; W392-I394 PolarHBondContact O-N 2.69Å; W392-L395 HydrophobicContact CB-CB 4.45Å; W392-L395 HydrophobicContact CB-CD1 3.92Å; W392-L395 HydrophobicContact CB-CG 4.03Å; W392-L395 HydrophobicContact CG-CD1 4.34Å; W392-L395 WeakPolarHBondContact O-CB 3.31Å; W392-L395 PolarHBondContact O-N 2.85Å
393	K	62.1	Low	79.7	Confident	168 Å²	168	60 Å²	60	73%	0.73	29%	0.287	S	S	*	.	H	α-helix	trans	-47.3	-24.2	180	-69.3	-174.8	177.8	-177.1	0	115	S391	S391-K393 PolarHBondContact O-N 3.25Å
394	I	62.8	Low	79.6	Confident	119 Å²	119	60.7 Å²	60.7	61%	0.61	29%	0.29	S	S	*	.	H	α-helix	trans	-76	-35.4	178.5	-63.8	170.4	0	0	0	111.1	W392 L398	W392-I394 PolarHBondContact O-N 2.69Å; I394-L398 HydrophobicContact CG2-CD1 3.7Å; I394-L398 WeakPolarHBondContact O-CB 3.34Å; I394-L398 PolarHBondContact O-N 3.23Å
395	L	65.6	Low	79.6	Confident	27 Å²	27	59.3 Å²	59.3	14%	0.141	28%	0.283	C	S	.	.	H	α-helix	trans	-67.2	-39.7	-179.6	-71.3	175	0	0	0	111.9	W392 K397 L398 A399 L403	W392-L395 HydrophobicContact CB-CB 4.45Å; W392-L395 HydrophobicContact CB-CD1 3.92Å; W392-L395 HydrophobicContact CB-CG 4.03Å; W392-L395 HydrophobicContact CG-CD1 4.34Å; W392-L395 WeakPolarHBondContact O-CB 3.31Å; W392-L395 PolarHBondContact O-N 2.85Å; L395-K397 VanDerWaalsContact C-N 3.32Å; L395-K397 PolarHBondContact O-N 3.23Å; L395-L398 CarbonylContact O-C 3.52Å; L395-L398 PolarHBondContact O-N 2.91Å; L395-A399 WeakPolarHBondContact O-CA 3.47Å; L395-A399 WeakPolarHBondContact O-CB 2.98Å; L395-A399 PolarHBondContact O-N 2.75Å; L395-L403 HydrophobicContact CD2-CD2 4.4Å
396	D	62.5	Low	79.6	Confident	58 Å²	58	59.3 Å²	59.3	31%	0.31	28%	0.283	S	S	.	.	H	α-helix	trans	-55.3	-44.8	179.7	-81.5	-13.3	0	0	0	113.2	F390 F429	F390-D396 VanDerWaalsContact CB-OD1 3.23Å; F390-D396 WeakPolarHBondContact CB-OD1 3.1Å; D396-F429 WeakPolarHBondContact OD1-CZ 3.4Å
397	K	68.2	Low	79.6	Confident	180 Å²	180	59.1 Å²	59.1	78%	0.783	28%	0.281	S	S	*	.	H	α-helix	trans	-79	-30.2	-177.9	-70.2	-172.8	176.6	-173.9	0	113	L395	L395-K397 VanDerWaalsContact C-N 3.32Å; L395-K397 PolarHBondContact O-N 3.23Å
398	L	78	Confident	79.6	Confident	79 Å²	79	60.9 Å²	60.9	41%	0.414	29%	0.289	S	S	.	.	H	α-helix	trans	-101.1	-1.5	-176.6	-63.7	179.5	0	0	0	113.2	I394 L395 S400 F401 V402	I394-L398 HydrophobicContact CG2-CD1 3.7Å; I394-L398 WeakPolarHBondContact O-CB 3.34Å; I394-L398 PolarHBondContact O-N 3.23Å; L395-L398 CarbonylContact O-C 3.52Å; L395-L398 PolarHBondContact O-N 2.91Å; L398-S400 VanDerWaalsContact C-N 3.29Å; L398-S400 PolarHBondContact O-N 2.9Å; L398-F401 WeakPolarHBondContact O-CA 3.24Å; L398-F401 WeakPolarHBondContact O-CB 3.24Å; L398-F401 PolarHBondContact O-N 3.49Å; L398-V402 HydrophobicContact CB-CG2 3.87Å; L398-V402 WeakPolarHBondContact O-CB 3.27Å; L398-V402 WeakPolarHBondContact O-CG2 3.38Å; L398-V402 PolarHBondContact O-N 3.31Å
399	A	74.4	Confident	79.5	Confident	2 Å²	2	56.3 Å²	56.3	2%	0.017	27%	0.27	C	S	.	.	H	α-helix	trans	-56.2	-43.7	-172.6	0	0	0	0	0	112.3	L395 F401 V402 L403 I427	L395-A399 WeakPolarHBondContact O-CA 3.47Å; L395-A399 WeakPolarHBondContact O-CB 2.98Å; L395-A399 PolarHBondContact O-N 2.75Å; A399-F401 PolarHBondContact O-N 2.77Å; A399-V402 PolarHBondContact O-N 2.75Å; A399-L403 HydrophobicContact CB-CD1 3.8Å; A399-L403 HydrophobicContact CB-CG 4.32Å; A399-L403 WeakPolarHBondContact O-CA 3.29Å; A399-L403 VanDerWaalsContact O-CB 3.23Å; A399-L403 WeakPolarHBondContact O-CB 3.21Å; A399-L403 PolarHBondContact O-N 2.91Å; A399-I427 HydrophobicContact CB-CD1 3.32Å; A399-I427 HydrophobicContact CB-CG1 4.21Å
400	S	75	Confident	79.2	Confident	34 Å²	34	58.7 Å²	58.7	24%	0.238	28%	0.282	C	S	.	.	H	α-helix	trans	-65.7	-18.5	179.5	62.6	0	0	0	0	113.9	L398 I424	L398-S400 VanDerWaalsContact C-N 3.29Å; L398-S400 PolarHBondContact O-N 2.9Å; S400-I424 WeakPolarHBondContact CA-O 3.41Å; S400-I424 VanDerWaalsContact CB-O 3.32Å; S400-I424 WeakPolarHBondContact CB-O 3.44Å
401	F	79.8	Confident	79	Confident	144 Å²	144	62.8 Å²	62.8	63%	0.632	30%	0.3	S	S	*	.	H	α-helix	trans	-99.7	-38.4	179.5	-63.2	-78.3	0	0	0	112.9	L398 A399	L398-F401 WeakPolarHBondContact O-CA 3.24Å; L398-F401 WeakPolarHBondContact O-CB 3.24Å; L398-F401 PolarHBondContact O-N 3.49Å; A399-F401 PolarHBondContact O-N 2.77Å
402	V	86.2	Confident	79.2	Confident	48 Å²	48	60.3 Å²	60.3	29%	0.291	28%	0.283	S	S	.	.	H	α-helix	trans	-100.8	-24.6	-168.3	179.9	0	0	0	0	112	L359 K360 L398 A399	L359-V402 HydrophobicContact CD2-CG1 3.45Å; L359-V402 VanDerWaalsContact CD2-CG1 3.45Å; K360-V402 VanDerWaalsContact CB-O 3.32Å; K360-V402 WeakPolarHBondContact CB-O 3.35Å; K360-V402 PolarHBondContact N-O 3.48Å; L398-V402 HydrophobicContact CB-CG2 3.87Å; L398-V402 WeakPolarHBondContact O-CB 3.27Å; L398-V402 WeakPolarHBondContact O-CG2 3.38Å; L398-V402 PolarHBondContact O-N 3.31Å; A399-V402 PolarHBondContact O-N 2.75Å
403	L	91.1	Very high	79.2	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	148.9	-175.4	-53.7	-178.3	0	0	0	112.5	I357 S358 L359 I366 F390 L395 A399 I424	I357-L403 HydrophobicContact CG2-CD1 4.43Å; S358-L403 WeakPolarHBondContact O-CA 3.13Å; L359-L403 HydrophobicContact CD2-CD2 3.84Å; I366-L403 HydrophobicContact CD1-CD2 3.25Å; F390-L403 HydrophobicContact CD1-CD1 4.03Å; F390-L403 HydrophobicContact CE1-CD1 3.56Å; L395-L403 HydrophobicContact CD2-CD2 4.4Å; A399-L403 HydrophobicContact CB-CD1 3.8Å; A399-L403 HydrophobicContact CB-CG 4.32Å; A399-L403 WeakPolarHBondContact O-CA 3.29Å; A399-L403 VanDerWaalsContact O-CB 3.23Å; A399-L403 WeakPolarHBondContact O-CB 3.21Å; A399-L403 PolarHBondContact O-N 2.91Å; L403-I424 HydrophobicContact CB-CD1 3.7Å; L403-I424 HydrophobicContact CB-CG1 4.48Å; L403-I424 HydrophobicContact CD1-CD1 4.15Å
404	Q	93.5	Very high	79.4	Confident	14 Å²	14	47.5 Å²	47.5	7%	0.065	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	155.6	168.9	68.6	-171.2	10.2	0	0	109.7	S358 N363 H406	S358-Q404 PolarHBondContact N-O 3.17Å; S358-Q404 PolarHBondContact O-N 2.94Å; S358-Q404 WeakPolarHBondContact OG-CG 3.39Å; N363-Q404 PolarHBondContact OD1-NE2 2.83Å; Q404-H406 PolarHBondContact NE2-CE1 3.23Å; Q404-H406 PolarHBondContact NE2-NE2 3.08Å
405	V	94.7	Very high	79.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	130.5	175.6	-176.7	0	0	0	0	108.5	A355 V356 I357 I383 F407 R421 S422 I424 L446 L448	A355-V405 HydrophobicContact CB-CG1 3.76Å; V356-V405 CarbonylContact O-C 3.51Å; V356-V405 WeakPolarHBondContact O-CA 3.5Å; I357-V405 HydrophobicContact CG1-CG2 4.29Å; I383-V405 HydrophobicContact CD1-CG1 4.47Å; I383-V405 HydrophobicContact CG1-CG1 4.17Å; V405-F407 HydrophobicContact CG1-CD1 4.45Å; V405-R421 CarbonylContact O-C 3.52Å; V405-R421 WeakPolarHBondContact O-CA 3.16Å; V405-S422 PolarHBondContact N-O 2.84Å; V405-S422 PolarHBondContact O-N 2.81Å; V405-I424 HydrophobicContact CG2-CD1 4.28Å; V405-I424 HydrophobicContact CG2-CG1 3.94Å; V405-L446 HydrophobicContact CG2-CD1 4.13Å; V405-L448 HydrophobicContact CB-CD2 3.92Å; V405-L448 HydrophobicContact CG2-CD2 3.69Å
406	H	93.7	Very high	79.5	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	141.5	170.6	-55.6	-112.4	0	0	0	109.6	A355 V356 S358 Q404 T409 V412 S417 M420 R421	A355-H406 CarbonylContact C-O 3.52Å; A355-H406 WeakPolarHBondContact CA-O 3.16Å; V356-H406 HydrophobicContact CB-CB 4.25Å; V356-H406 PolarHBondContact N-O 3.44Å; V356-H406 PolarHBondContact O-N 3.45Å; S358-H406 PolarHBondContact OG-CD2 3.29Å; S358-H406 PolarHBondContact OG-NE2 2.95Å; Q404-H406 PolarHBondContact NE2-CE1 3.23Å; Q404-H406 PolarHBondContact NE2-NE2 3.08Å; H406-T409 HydrophobicContact CB-CG2 3.87Å; H406-V412 HydrophobicContact CB-CG2 4.29Å; H406-S417 PolarHBondContact ND1-OG 2.93Å; H406-M420 VanDerWaalsContact CA-O 3.3Å; H406-M420 WeakPolarHBondContact CA-O 2.91Å; H406-R421 PolarHBondContact CE1-NE 2.71Å
407	F	91.1	Very high	79.8	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.009	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	165.6	175.2	45.6	-84.6	0	0	0	108.7	I371 V405 T409 G419 M420 V452 A458	I371-F407 HydrophobicContact CD1-CB 4.19Å; V405-F407 HydrophobicContact CG1-CD1 4.45Å; F407-T409 VanDerWaalsContact C-N 3.32Å; F407-G419 CarbonylContact O-C 3.43Å; F407-G419 WeakPolarHBondContact O-CA 2.94Å; F407-M420 HydrophobicContact CD2-CB 3.62Å; F407-M420 HydrophobicContact CD2-SD 4.46Å; F407-M420 HydrophobicContact CE1-CB 4.31Å; F407-M420 HydrophobicContact CE2-CB 3.19Å; F407-M420 HydrophobicContact CE2-CE 4.1Å; F407-M420 HydrophobicContact CE2-CG 4.02Å; F407-M420 HydrophobicContact CE2-SD 3.74Å; F407-M420 HydrophobicContact CG-CB 4.35Å; F407-M420 HydrophobicContact CZ-CB 3.58Å; F407-M420 HydrophobicContact CZ-CE 4.43Å; F407-M420 PolarHBondContact N-O 3.27Å; F407-M420 PolarHBondContact O-N 2.92Å; F407-V452 HydrophobicContact CD1-CG2 3.86Å; F407-V452 HydrophobicContact CD2-CB 4.26Å; F407-V452 HydrophobicContact CD2-CG1 3.64Å; F407-V452 HydrophobicContact CD2-CG2 3.94Å; F407-V452 HydrophobicContact CE1-CG2 3.84Å; F407-V452 HydrophobicContact CE2-CB 4.11Å; F407-V452 HydrophobicContact CE2-CG1 3.83Å; F407-V452 HydrophobicContact CE2-CG2 3.89Å; F407-V452 HydrophobicContact CG-CG1 4.24Å; F407-V452 HydrophobicContact CG-CG2 3.93Å; F407-V452 HydrophobicContact CZ-CB 4.43Å; F407-V452 HydrophobicContact CZ-CG2 3.86Å; F407-A458 HydrophobicContact CD2-CB 4.5Å
408	Q	87	Confident	79.9	Confident	39 Å²	39	47 Å²	47	18%	0.182	24%	0.244	C	C	.	.	S	Bend	trans	59.5	39.8	-171.3	-54.2	174	8.5	0	0	112.9	G419 M420 N455 K457 A458	Q408-G419 WeakPolarHBondContact O-CA 3.48Å; Q408-M420 PolarHBondContact NE2-SD 2.86Å; Q408-M420 VanDerWaalsContact NE2-SD 3.37Å; Q408-N455 PolarHBondContact NE2-ND2 3.16Å; Q408-N455 PolarHBondContact NE2-OD1 3.03Å; Q408-K457 HydrophobicContact CB-CB 4Å; Q408-K457 HydrophobicContact CG-CB 3.88Å; Q408-A458 HydrophobicContact CG-CB 3.32Å
409	T	84.1	Confident	80.1	Confident	12 Å²	12	45.1 Å²	45.1	7%	0.074	24%	0.244	C	C	.	.			trans	-141.7	135.8	-175.6	-178.4	0	0	0	0	112.4	H406 F407 K411 V412 S418 I486	H406-T409 HydrophobicContact CB-CG2 3.87Å; F407-T409 VanDerWaalsContact C-N 3.32Å; T409-K411 PolarHBondContact OG1-N 3.11Å; T409-K411 VanDerWaalsContact OG1-N 3.12Å; T409-K411 PolarHBondContact OG1-O 3.46Å; T409-V412 HydrophobicContact CG2-CG2 3.57Å; T409-S418 WeakPolarHBondContact CB-O 3.47Å; T409-S418 WeakPolarHBondContact CB-OG 3.47Å; T409-S418 PolarHBondContact OG1-O 3.24Å; T409-S418 VanDerWaalsContact OG1-O 3.12Å; T409-S418 PolarHBondContact OG1-OG 2.88Å; T409-I486 WeakPolarHBondContact O-CD1 3.41Å
410	D	82.8	Confident	80.8	Confident	63 Å²	63	48.9 Å²	48.9	34%	0.337	26%	0.262	S	S	.	.	S	Bend	trans	-93.2	-17.9	168.5	65.6	-33.8	0	0	0	112.3	P350 S418 K485 I486	P350-D410 HydrophobicContact CG-CB 3.78Å; D410-S418 PolarHBondContact OD1-OG 3.45Å; D410-S418 VanDerWaalsContact OD1-OG 3.09Å; D410-K485 VanDerWaalsContact O-CA 3.24Å; D410-K485 WeakPolarHBondContact O-CA 3.38Å; D410-I486 PolarHBondContact O-N 3.43Å; D410-I486 VanDerWaalsContact O-N 3.1Å
411	K	82.2	Confident	81.6	Confident	90 Å²	90	53 Å²	53	39%	0.391	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-131.4	113.1	-170.6	-70.9	170.3	-167.3	172	0	111.4	T409 I416 S417 S418 G484 K485	T409-K411 PolarHBondContact OG1-N 3.11Å; T409-K411 VanDerWaalsContact OG1-N 3.12Å; T409-K411 PolarHBondContact OG1-O 3.46Å; K411-I416 HydrophobicContact CB-CG2 4.26Å; K411-S417 WeakPolarHBondContact O-CA 3.09Å; K411-S418 PolarHBondContact O-N 2.75Å; K411-S418 VanDerWaalsContact O-N 3.14Å; K411-G484 VanDerWaalsContact CA-O 3.27Å; K411-G484 WeakPolarHBondContact CA-O 3.4Å; K411-K485 HydrophobicContact CG-CG 4.21Å
412	V	76	Confident	82.2	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	133.9	170.4	-174	0	0	0	0	107.6	V356 V365 H406 T409 I416 Y481 G484	V356-V412 HydrophobicContact CB-CG2 4.01Å; V356-V412 HydrophobicContact CG1-CB 4.11Å; V356-V412 HydrophobicContact CG1-CG1 4.04Å; V356-V412 HydrophobicContact CG1-CG2 4.01Å; V356-V412 HydrophobicContact CG2-CG2 3.88Å; V365-V412 HydrophobicContact CG2-CB 3.92Å; V365-V412 HydrophobicContact CG2-CG1 3.52Å; H406-V412 HydrophobicContact CB-CG2 4.29Å; T409-V412 HydrophobicContact CG2-CG2 3.57Å; V412-I416 CarbonylContact C-O 3.55Å; V412-I416 WeakPolarHBondContact CA-O 3.48Å; V412-Y481 HydrophobicContact CB-CE2 4.32Å; V412-Y481 VanDerWaalsContact O-CE2 3.27Å; V412-Y481 WeakPolarHBondContact O-CE2 3.35Å; V412-Y481 PolarHBondContact O-OH 2.78Å; V412-G484 PolarHBondContact N-O 3.43Å; V412-G484 CarbonylContact O-C 3.54Å; V412-G484 WeakPolarHBondContact O-CA 3.34Å; V412-G484 VanDerWaalsContact O-O 3.07Å
413	G	73.5	Confident	82.5	Confident	6 Å²	6	50.2 Å²	50.2	6%	0.062	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.2	174.2	-179.7	0	0	0	0	0	110.8	N363 F415 I416	N363-G413 VanDerWaalsContact CB-O 3.24Å; N363-G413 WeakPolarHBondContact CB-O 3.22Å; G413-F415 PolarHBondContact O-N 3.19Å; G413-I416 PolarHBondContact N-O 3.35Å; G413-I416 PolarHBondContact O-N 3.35Å; G413-I416 VanDerWaalsContact O-O 3.09Å
414	P	65	Low	82.5	Confident	78 Å²	78	50.2 Å²	50.2	51%	0.506	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-29.9	-170.8	-26.6	34.2	0	0	0	114.6	I362	I362-P414 WeakPolarHBondContact O-CA 3.5Å
415	F	66.3	Low	82.4	Confident	198 Å²	198	55.5 Å²	55.5	87%	0.868	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.7	-1.3	-177.5	-53.9	-68.9	0	0	0	114.2	G413	G413-F415 PolarHBondContact O-N 3.19Å
416	I	65	Low	82.1	Confident	110 Å²	110	59.3 Å²	59.3	56%	0.564	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.9	115.7	-173	-55.7	174.2	0	0	0	107	K411 V412 G413	K411-I416 HydrophobicContact CB-CG2 4.26Å; V412-I416 CarbonylContact C-O 3.55Å; V412-I416 WeakPolarHBondContact CA-O 3.48Å; G413-I416 PolarHBondContact N-O 3.35Å; G413-I416 PolarHBondContact O-N 3.35Å; G413-I416 VanDerWaalsContact O-O 3.09Å
417	S	68.3	Low	81.8	Confident	24 Å²	24	60.7 Å²	60.7	17%	0.168	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	118.9	156.6	97.3	0	0	0	0	108.3	H406 K411 R421	H406-S417 PolarHBondContact ND1-OG 2.93Å; K411-S417 WeakPolarHBondContact O-CA 3.09Å; S417-R421 PolarHBondContact OG-NE 3.14Å; S417-R421 PolarHBondContact OG-NH2 3.09Å
418	S	71.1	Confident	81.7	Confident	41 Å²	41	62.2 Å²	62.2	29%	0.287	31%	0.306	S	S	.	.			trans	-77	169.4	159.7	56.1	0	0	0	0	109.2	T409 D410 K411	T409-S418 WeakPolarHBondContact CB-O 3.47Å; T409-S418 WeakPolarHBondContact CB-OG 3.47Å; T409-S418 PolarHBondContact OG1-O 3.24Å; T409-S418 VanDerWaalsContact OG1-O 3.12Å; T409-S418 PolarHBondContact OG1-OG 2.88Å; D410-S418 PolarHBondContact OD1-OG 3.45Å; D410-S418 VanDerWaalsContact OD1-OG 3.09Å; K411-S418 PolarHBondContact O-N 2.75Å; K411-S418 VanDerWaalsContact O-N 3.14Å
419	G	82.3	Confident	81.6	Confident	41 Å²	41	62.3 Å²	62.3	42%	0.423	31%	0.305	S	S	.	.	S	Bend	trans	85.8	-177.5	170.6	0	0	0	0	0	117.3	F407 Q408	F407-G419 CarbonylContact O-C 3.43Å; F407-G419 WeakPolarHBondContact O-CA 2.94Å; Q408-G419 WeakPolarHBondContact O-CA 3.48Å
420	M	88	Confident	81.3	Confident	81 Å²	81	63.7 Å²	63.7	40%	0.399	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	151	-178.8	-70.6	-176	75.1	0	0	110.9	H406 F407 Q408	H406-M420 VanDerWaalsContact CA-O 3.3Å; H406-M420 WeakPolarHBondContact CA-O 2.91Å; F407-M420 HydrophobicContact CD2-CB 3.62Å; F407-M420 HydrophobicContact CD2-SD 4.46Å; F407-M420 HydrophobicContact CE1-CB 4.31Å; F407-M420 HydrophobicContact CE2-CB 3.19Å; F407-M420 HydrophobicContact CE2-CE 4.1Å; F407-M420 HydrophobicContact CE2-CG 4.02Å; F407-M420 HydrophobicContact CE2-SD 3.74Å; F407-M420 HydrophobicContact CG-CB 4.35Å; F407-M420 HydrophobicContact CZ-CB 3.58Å; F407-M420 HydrophobicContact CZ-CE 4.43Å; F407-M420 PolarHBondContact N-O 3.27Å; F407-M420 PolarHBondContact O-N 2.92Å; Q408-M420 PolarHBondContact NE2-SD 2.86Å; Q408-M420 VanDerWaalsContact NE2-SD 3.37Å
421	R	91.7	Very high	80.6	Confident	120 Å²	120	65.2 Å²	65.2	45%	0.453	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	135.7	-179.9	-51.6	-174.3	-168.7	158.8	3.7	110.6	V405 H406 S417	V405-R421 CarbonylContact O-C 3.52Å; V405-R421 WeakPolarHBondContact O-CA 3.16Å; H406-R421 PolarHBondContact CE1-NE 2.71Å; S417-R421 PolarHBondContact OG-NE 3.14Å; S417-R421 PolarHBondContact OG-NH2 3.09Å
422	S	92.7	Very high	79.4	Confident	4 Å²	4	66.9 Å²	66.9	3%	0.028	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	144.9	171.6	-167.6	0	0	0	0	110.9	V405 R450	V405-S422 PolarHBondContact N-O 2.84Å; V405-S422 PolarHBondContact O-N 2.81Å; S422-R450 WeakPolarHBondContact CB-O 3.49Å; S422-R450 PolarHBondContact OG-N 2.91Å; S422-R450 VanDerWaalsContact OG-N 3.08Å; S422-R450 PolarHBondContact OG-O 2.94Å
423	R	92.7	Very high	78.5	Confident	130 Å²	130	73.4 Å²	73.4	49%	0.491	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	149.9	176.2	-61.1	-174.3	-141.9	172.4	8.1	109.5	R425 L448 K449	R423-R425 PolarHBondContact O-N 2.72Å; R423-L448 CarbonylContact O-C 3.44Å; R423-K449 HydrophobicContact CB-CB 4.42Å; R423-K449 HydrophobicContact CB-CD 4.03Å; R423-K449 HydrophobicContact CB-CG 4.27Å; R423-K449 PolarHBondContact O-N 3.24Å
424	I	92.1	Very high	77.3	Confident	1 Å²	1	82.9 Å²	82.9	1%	0.005	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	126.8	173	-55.5	178.9	0	0	0	108.9	S400 L403 V405 I427 L446	S400-I424 WeakPolarHBondContact CA-O 3.41Å; S400-I424 VanDerWaalsContact CB-O 3.32Å; S400-I424 WeakPolarHBondContact CB-O 3.44Å; L403-I424 HydrophobicContact CB-CD1 3.7Å; L403-I424 HydrophobicContact CB-CG1 4.48Å; L403-I424 HydrophobicContact CD1-CD1 4.15Å; V405-I424 HydrophobicContact CG2-CD1 4.28Å; V405-I424 HydrophobicContact CG2-CG1 3.94Å; I424-I427 HydrophobicContact CG2-CD1 4.48Å; I424-I427 HydrophobicContact CG2-CG1 3.79Å; I424-L446 HydrophobicContact CD1-CD1 3.91Å; I424-L446 HydrophobicContact CD1-CD2 4.43Å; I424-L446 HydrophobicContact CG2-CB 4.4Å
425	R	89.4	Confident	76.7	Confident	125 Å²	125	82.9 Å²	82.9	47%	0.472	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-51.1	171	-177.5	-179.5	176.7	165.7	2.7	110.5	H188 R423 L447 K449	H188-R425 PolarHBondContact CE1-NH2 2.99Å; H188-R425 PolarHBondContact NE2-NH2 3.31Å; H188-R425 VanDerWaalsContact NE2-NH2 3.12Å; R423-R425 PolarHBondContact O-N 2.72Å; R425-L447 WeakPolarHBondContact CA-O 3.47Å; R425-L447 VanDerWaalsContact CB-O 3.31Å; R425-L447 WeakPolarHBondContact CB-O 3.28Å; R425-L447 PolarHBondContact N-O 3.21Å; R425-K449 HydrophobicContact CB-CG 3.78Å; R425-K449 HydrophobicContact CG-CG 4.44Å
426	K	88.9	Confident	76.2	Confident	79 Å²	79	79.7 Å²	79.7	34%	0.343	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	148.5	-173.9	-179.9	178.1	173	-172.2	0	109.5	E101 L447	E101-K426 IonicContact OE1-NZ 2.79Å; E101-K426 PolarHBondContact OE1-NZ 2.96Å; K426-L447 HydrophobicContact CB-CB 4.29Å; K426-L447 HydrophobicContact CB-CD1 4.28Å; K426-L447 HydrophobicContact CD-CD1 4.25Å; K426-L447 PolarHBondContact N-O 3.01Å; K426-L447 PolarHBondContact O-N 3.07Å
427	I	88.7	Confident	75.6	Confident	30 Å²	30	78.8 Å²	78.8	15%	0.154	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.4	170.8	-56.8	-175.8	0	0	0	107.5	F390 A399 I424 F429 A444 L446	F390-I427 HydrophobicContact CD1-CD1 3.57Å; F390-I427 HydrophobicContact CD2-CD1 4.32Å; F390-I427 HydrophobicContact CD2-CG2 4.15Å; F390-I427 HydrophobicContact CE1-CD1 3.46Å; F390-I427 VanDerWaalsContact CE1-CD1 3.46Å; F390-I427 HydrophobicContact CE2-CD1 4.22Å; F390-I427 HydrophobicContact CE2-CG2 4.19Å; F390-I427 HydrophobicContact CG-CD1 4.02Å; F390-I427 HydrophobicContact CZ-CD1 3.83Å; A399-I427 HydrophobicContact CB-CD1 3.32Å; A399-I427 HydrophobicContact CB-CG1 4.21Å; I424-I427 HydrophobicContact CG2-CD1 4.48Å; I424-I427 HydrophobicContact CG2-CG1 3.79Å; I427-F429 HydrophobicContact CG2-CE2 4.03Å; I427-F429 HydrophobicContact CG2-CZ 4.06Å; I427-A444 HydrophobicContact CG2-CB 4.17Å; I427-L446 HydrophobicContact CB-CD2 4.28Å; I427-L446 HydrophobicContact CD1-CD2 4.02Å; I427-L446 HydrophobicContact CG1-CD2 3.73Å; I427-L446 HydrophobicContact CG2-CD2 3.92Å
428	T	87.4	Confident	74.9	Confident	34 Å²	34	79.7 Å²	79.7	21%	0.209	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	126.4	177.4	-58.4	0	0	0	0	108.8	A444 I445	T428-A444 CarbonylContact O-C 3.49Å; T428-A444 WeakPolarHBondContact O-CA 3.39Å; T428-I445 PolarHBondContact N-O 3.28Å; T428-I445 PolarHBondContact O-N 3.39Å
429	F	85.1	Confident	74.2	Confident	40 Å²	40	84 Å²	84	18%	0.175	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	133.9	175.3	-60.9	-90.6	0	0	0	110.1	F390 D396 I427 P443 A444	F390-F429 HydrophobicContact CB-CE1 4.44Å; F390-F429 HydrophobicContact CB-CZ 4.06Å; F390-F429 HydrophobicContact CD2-CE1 4.21Å; F390-F429 HydrophobicContact CD2-CZ 4.29Å; D396-F429 WeakPolarHBondContact OD1-CZ 3.4Å; I427-F429 HydrophobicContact CG2-CE2 4.03Å; I427-F429 HydrophobicContact CG2-CZ 4.06Å; F429-P443 WeakPolarHBondContact CA-O 3.35Å; F429-A444 HydrophobicContact CD1-CB 3.9Å; F429-A444 HydrophobicContact CE1-CB 3.99Å
430	V	78.7	Confident	73	Confident	41 Å²	41	86 Å²	86	25%	0.248	40%	0.401	C	S	.	.	S	Bend	trans	-71.8	131.2	178	-179.1	0	0	0	0	109	P443 I445	V430-P443 HydrophobicContact CB-CB 4.11Å; V430-P443 HydrophobicContact CB-CG 4.25Å; V430-P443 HydrophobicContact CG2-CB 3.86Å; V430-P443 HydrophobicContact CG2-CG 4.43Å; V430-P443 PolarHBondContact N-O 2.96Å; V430-I445 HydrophobicContact CG2-CD1 3.88Å; V430-I445 HydrophobicContact CG2-CG1 4.01Å
431	N	67.9	Low	72	Confident	95 Å²	95	85.5 Å²	85.5	51%	0.508	40%	0.403	S	S	.	.			trans	62.2	101.1	-174.1	-164.6	-19.8	0	0	0	114.1	E433 R442	N431-E433 PolarHBondContact O-N 3.11Å; N431-E433 PolarHBondContact OD1-N 3.28Å; N431-R442 PolarHBondContact O-NH1 3.02Å
432	K	55.7	Low	71.3	Confident	125 Å²	125	81.6 Å²	81.6	54%	0.543	39%	0.388	S	S	.	.			trans	-89	11.4	-173.7	-86.3	178.4	-174.4	160.5	0	115.1	R434	K432-R434 PolarHBondContact O-N 2.86Å
433	E	57.3	Low	71	Confident	138 Å²	138	81.7 Å²	81.7	65%	0.645	39%	0.388	S	S	*	.			trans	-55.9	130.6	178.1	-75.1	-171.1	172.1	0	0	111.1	N431 V435 R442	N431-E433 PolarHBondContact O-N 3.11Å; N431-E433 PolarHBondContact OD1-N 3.28Å; E433-V435 PolarHBondContact O-N 2.73Å; E433-R442 PolarHBondContact O-NH1 2.8Å
434	R	48.5	Very low	70.9	Confident	206 Å²	206	75.5 Å²	75.5	78%	0.777	37%	0.365	S	S	*	.	S	Bend	trans	-66.2	8.4	-150.2	-69.8	-176.4	-172.9	-174.3	1.3	116.7	K432 I436	K432-R434 PolarHBondContact O-N 2.86Å; R434-I436 PolarHBondContact O-N 2.89Å
435	V	52.6	Low	70.9	Confident	78 Å²	78	77.4 Å²	77.4	47%	0.473	38%	0.375	S	S	.	.			trans	-80.4	110.6	-174.1	-166.6	0	0	0	0	109.5	E433 S437 T438	E433-V435 PolarHBondContact O-N 2.73Å; V435-S437 VanDerWaalsContact CG1-OG 3.26Å; V435-S437 WeakPolarHBondContact CG1-OG 3.43Å; V435-S437 PolarHBondContact O-N 3.22Å; V435-T438 HydrophobicContact CB-CG2 4.3Å; V435-T438 HydrophobicContact CG1-CG2 4.32Å; V435-T438 PolarHBondContact O-N 2.93Å; V435-T438 PolarHBondContact O-OG1 3.42Å
436	I	55.9	Low	71.2	Confident	131 Å²	131	71.5 Å²	71.5	67%	0.672	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-60.4	-31	-176.9	-65.7	168	0	0	0	111.5	R434 T438	R434-I436 PolarHBondContact O-N 2.89Å; I436-T438 VanDerWaalsContact C-N 3.31Å; I436-T438 PolarHBondContact O-N 3.25Å
437	S	52	Low	71.4	Confident	91 Å²	91	69.7 Å²	69.7	64%	0.636	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-70.2	-24.3	-179.1	57.8	0	0	0	0	113.7	V435	V435-S437 VanDerWaalsContact CG1-OG 3.26Å; V435-S437 WeakPolarHBondContact CG1-OG 3.43Å; V435-S437 PolarHBondContact O-N 3.22Å
438	T	54.9	Low	71.6	Confident	43 Å²	43	68.3 Å²	68.3	26%	0.264	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-90.9	1.3	-177.4	55.6	0	0	0	0	113.3	V435 I436 L440 T441 R442	V435-T438 HydrophobicContact CB-CG2 4.3Å; V435-T438 HydrophobicContact CG1-CG2 4.32Å; V435-T438 PolarHBondContact O-N 2.93Å; V435-T438 PolarHBondContact O-OG1 3.42Å; I436-T438 VanDerWaalsContact C-N 3.31Å; I436-T438 PolarHBondContact O-N 3.25Å; T438-L440 VanDerWaalsContact C-N 3.27Å; T438-L440 PolarHBondContact O-N 2.92Å; T438-T441 PolarHBondContact O-OG1 2.81Å; T438-R442 VanDerWaalsContact O-CD 3.31Å; T438-R442 WeakPolarHBondContact O-CD 3.32Å; T438-R442 VanDerWaalsContact O-CG 3.25Å; T438-R442 WeakPolarHBondContact O-CG 3.46Å; T438-R442 PolarHBondContact O-NE 3.15Å; T438-R442 PolarHBondContact OG1-NH2 2.9Å
439	R	54.7	Low	71.8	Confident	132 Å²	132	72 Å²	72	50%	0.498	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-67.8	-28.2	178.1	-72.2	-169.8	-178	-172.3	0.7	113.2	T441	R439-T441 VanDerWaalsContact C-N 3.3Å; R439-T441 PolarHBondContact O-N 3Å
440	L	59.1	Low	72.1	Confident	82 Å²	82	78.3 Å²	78.3	43%	0.429	38%	0.375	S	S	.	.	G	3₁₀ helix	trans	-74.2	-20.5	-171.8	-65.8	174.4	0	0	0	113.5	K388 T438	K388-L440 VanDerWaalsContact CB-O 3.27Å; K388-L440 WeakPolarHBondContact CB-O 3.1Å; K388-L440 PolarHBondContact N-O 3.35Å; T438-L440 VanDerWaalsContact C-N 3.27Å; T438-L440 PolarHBondContact O-N 2.92Å
441	T	66.2	Low	72.7	Confident	71 Å²	71	77.2 Å²	77.2	44%	0.436	37%	0.369	S	S	.	.	S	Bend	trans	-104.4	-7.5	-176.9	52.8	0	0	0	0	113.2	T438 R439 Y546	T438-T441 PolarHBondContact O-OG1 2.81Å; R439-T441 VanDerWaalsContact C-N 3.3Å; R439-T441 PolarHBondContact O-N 3Å; T441-Y546 WeakPolarHBondContact O-CE2 3.22Å; T441-Y546 VanDerWaalsContact O-CZ 3.27Å; T441-Y546 PolarHBondContact O-OH 3.35Å
442	R	76.4	Confident	73.8	Confident	37 Å²	37	72.7 Å²	72.7	14%	0.14	35%	0.345	C	S	.	.	S	Bend	trans	-87.5	154.4	-172.2	-74.3	173.3	-178.5	175.8	1.2	112.6	G387 N431 E433 T438	G387-R442 WeakPolarHBondContact CA-O 3.23Å; G387-R442 PolarHBondContact N-O 3.45Å; N431-R442 PolarHBondContact O-NH1 3.02Å; E433-R442 PolarHBondContact O-NH1 2.8Å; T438-R442 VanDerWaalsContact O-CD 3.31Å; T438-R442 WeakPolarHBondContact O-CD 3.32Å; T438-R442 VanDerWaalsContact O-CG 3.25Å; T438-R442 WeakPolarHBondContact O-CG 3.46Å; T438-R442 PolarHBondContact O-NE 3.15Å; T438-R442 PolarHBondContact OG1-NH2 2.9Å
443	P	86.9	Confident	75.5	Confident	6 Å²	6	69.3 Å²	69.3	4%	0.039	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	148.8	170.4	-18.6	31.5	0	0	0	112.2	L384 F429 V430 Y546	L384-P443 HydrophobicContact CD1-CB 3.9Å; F429-P443 WeakPolarHBondContact CA-O 3.35Å; V430-P443 HydrophobicContact CB-CB 4.11Å; V430-P443 HydrophobicContact CB-CG 4.25Å; V430-P443 HydrophobicContact CG2-CB 3.86Å; V430-P443 HydrophobicContact CG2-CG 4.43Å; V430-P443 PolarHBondContact N-O 2.96Å; P443-Y546 HydrophobicContact CB-CD2 4.48Å; P443-Y546 HydrophobicContact CB-CG 4.45Å; P443-Y546 HydrophobicContact CG-CD1 3.51Å; P443-Y546 HydrophobicContact CG-CD2 3.29Å; P443-Y546 HydrophobicContact CG-CE1 4.05Å; P443-Y546 HydrophobicContact CG-CE2 3.83Å; P443-Y546 HydrophobicContact CG-CG 3.08Å
444	A	90.3	Very high	77.1	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	137.2	166.6	0	0	0	0	0	109.7	L384 T385 F390 I427 T428 F429	L384-A444 CarbonylContact C-O 3.49Å; T385-A444 HydrophobicContact CG2-CB 4Å; T385-A444 PolarHBondContact N-O 2.67Å; T385-A444 PolarHBondContact O-N 3.25Å; T385-A444 VanDerWaalsContact O-O 3.06Å; F390-A444 HydrophobicContact CD2-CB 3.99Å; F390-A444 HydrophobicContact CE2-CB 3.79Å; I427-A444 HydrophobicContact CG2-CB 4.17Å; T428-A444 CarbonylContact O-C 3.49Å; T428-A444 WeakPolarHBondContact O-CA 3.39Å; F429-A444 HydrophobicContact CD1-CB 3.9Å; F429-A444 HydrophobicContact CE1-CB 3.99Å
445	I	93.1	Very high	79	Confident	42 Å²	42	57.7 Å²	57.7	22%	0.215	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	121.8	170.8	-59.9	173.2	0	0	0	107.4	I372 A382 I383 L384 T428 V430 L447	I372-I445 HydrophobicContact CD1-CG1 4.47Å; I372-I445 HydrophobicContact CD1-CG2 4.41Å; A382-I445 HydrophobicContact CB-CG2 4.16Å; I383-I445 CarbonylContact O-C 3.5Å; I383-I445 WeakPolarHBondContact O-CA 3.28Å; L384-I445 HydrophobicContact CD1-CG1 3.96Å; T428-I445 PolarHBondContact N-O 3.28Å; T428-I445 PolarHBondContact O-N 3.39Å; V430-I445 HydrophobicContact CG2-CD1 3.88Å; V430-I445 HydrophobicContact CG2-CG1 4.01Å; I445-L447 HydrophobicContact CG2-CD2 4.18Å
446	L	94.2	Very high	80.6	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	118.3	173.2	-40.2	178.3	0	0	0	108.3	I357 A382 I383 T385 F390 V405 I424 I427	I357-L446 HydrophobicContact CD1-CD1 3.57Å; I357-L446 HydrophobicContact CG1-CD1 3.79Å; A382-L446 WeakPolarHBondContact CA-O 2.93Å; I383-L446 HydrophobicContact CB-CB 4.16Å; I383-L446 HydrophobicContact CB-CD1 4.41Å; I383-L446 HydrophobicContact CB-CG 4.44Å; I383-L446 HydrophobicContact CG2-CD1 4.34Å; I383-L446 PolarHBondContact N-O 3.07Å; I383-L446 PolarHBondContact O-N 2.86Å; T385-L446 HydrophobicContact CG2-CD1 3.89Å; T385-L446 HydrophobicContact CG2-CD2 3.83Å; T385-L446 HydrophobicContact CG2-CG 3.8Å; F390-L446 HydrophobicContact CE1-CD2 4.27Å; F390-L446 HydrophobicContact CE2-CD2 3.55Å; F390-L446 HydrophobicContact CZ-CD1 4.11Å; F390-L446 HydrophobicContact CZ-CD2 3.29Å; F390-L446 HydrophobicContact CZ-CG 4.28Å; V405-L446 HydrophobicContact CG2-CD1 4.13Å; I424-L446 HydrophobicContact CD1-CD1 3.91Å; I424-L446 HydrophobicContact CD1-CD2 4.43Å; I424-L446 HydrophobicContact CG2-CB 4.4Å; I427-L446 HydrophobicContact CB-CD2 4.28Å; I427-L446 HydrophobicContact CD1-CD2 4.02Å; I427-L446 HydrophobicContact CG1-CD2 3.73Å; I427-L446 HydrophobicContact CG2-CD2 3.92Å
447	L	93.3	Very high	82.2	Confident	41 Å²	41	59.6 Å²	59.6	22%	0.215	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	126.9	169.5	-59.9	-178.8	0	0	0	108.5	F381 A382 R425 K426 I445	F381-L447 CarbonylContact O-C 3.51Å; F381-L447 WeakPolarHBondContact O-CA 3.45Å; A382-L447 HydrophobicContact CB-CD2 4.42Å; R425-L447 WeakPolarHBondContact CA-O 3.47Å; R425-L447 VanDerWaalsContact CB-O 3.31Å; R425-L447 WeakPolarHBondContact CB-O 3.28Å; R425-L447 PolarHBondContact N-O 3.21Å; K426-L447 HydrophobicContact CB-CB 4.29Å; K426-L447 HydrophobicContact CB-CD1 4.28Å; K426-L447 HydrophobicContact CD-CD1 4.25Å; K426-L447 PolarHBondContact N-O 3.01Å; K426-L447 PolarHBondContact O-N 3.07Å; I445-L447 HydrophobicContact CG2-CD2 4.18Å
448	L	94.2	Very high	84.1	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.01	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	153.1	-177.8	-60.7	-179.3	0	0	0	111.7	F381 I383 V405 R423 R450 V452	F381-L448 WeakPolarHBondContact O-CG 3.29Å; F381-L448 PolarHBondContact O-N 3.46Å; I383-L448 HydrophobicContact CD1-CD1 4.15Å; I383-L448 HydrophobicContact CG1-CD1 3.91Å; I383-L448 HydrophobicContact CG1-CD2 4.06Å; I383-L448 HydrophobicContact CG1-CG 4.07Å; V405-L448 HydrophobicContact CB-CD2 3.92Å; V405-L448 HydrophobicContact CG2-CD2 3.69Å; R423-L448 CarbonylContact O-C 3.44Å; L448-R450 VanDerWaalsContact CB-O 3.26Å; L448-R450 WeakPolarHBondContact CB-O 3.16Å; L448-V452 HydrophobicContact CD1-CG2 3.69Å
449	K	90.5	Very high	85.8	Confident	110 Å²	110	54.8 Å²	54.8	48%	0.478	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	-35.8	171.5	-70.7	-167.8	-179.3	-177.9	0	112.2	R423 R425	R423-K449 HydrophobicContact CB-CB 4.42Å; R423-K449 HydrophobicContact CB-CD 4.03Å; R423-K449 HydrophobicContact CB-CG 4.27Å; R423-K449 PolarHBondContact O-N 3.24Å; R425-K449 HydrophobicContact CB-CG 3.78Å; R425-K449 HydrophobicContact CG-CG 4.44Å
450	R	91.1	Very high	87.6	Confident	174 Å²	174	49.3 Å²	49.3	66%	0.657	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	135.2	172.4	-65.8	179.8	179.7	167.2	-4.2	108.7	S422 L448	S422-R450 WeakPolarHBondContact CB-O 3.49Å; S422-R450 PolarHBondContact OG-N 2.91Å; S422-R450 VanDerWaalsContact OG-N 3.08Å; S422-R450 PolarHBondContact OG-O 2.94Å; L448-R450 VanDerWaalsContact CB-O 3.26Å; L448-R450 WeakPolarHBondContact CB-O 3.16Å
451	P	92.2	Very high	89.2	Confident	18 Å²	18	47 Å²	47	12%	0.117	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	154.4	-179.4	30.5	-31.7	0	0	0	110.8	Y379 S380 F381 V453	Y379-P451 HydrophobicContact CD2-CB 3.75Å; Y379-P451 HydrophobicContact CD2-CG 4.39Å; Y379-P451 HydrophobicContact CG-CB 4.21Å; S380-P451 CarbonylContact O-C 3.48Å; S380-P451 WeakPolarHBondContact O-CA 3.47Å; F381-P451 HydrophobicContact CD1-CB 3.84Å; F381-P451 HydrophobicContact CD2-CB 4.14Å; F381-P451 HydrophobicContact CE1-CB 3.6Å; F381-P451 VanDerWaalsContact CE1-CD 3.41Å; F381-P451 HydrophobicContact CE1-CG 3.81Å; F381-P451 HydrophobicContact CE2-CB 3.92Å; F381-P451 HydrophobicContact CE2-CG 4.33Å; F381-P451 HydrophobicContact CG-CB 4.11Å; F381-P451 HydrophobicContact CZ-CB 3.63Å; F381-P451 HydrophobicContact CZ-CG 3.68Å; P451-V453 PolarHBondContact O-N 2.65Å
452	V	91.7	Very high	90.2	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	111.3	162.7	-177.5	0	0	0	0	107.1	I371 Y379 S380 I383 F407 L448 A458	I371-V452 HydrophobicContact CD1-CG1 3.88Å; I371-V452 HydrophobicContact CD1-CG2 4.42Å; I371-V452 HydrophobicContact CG1-CG2 4.37Å; I371-V452 HydrophobicContact CG2-CB 4.46Å; Y379-V452 CarbonylContact C-O 3.52Å; Y379-V452 WeakPolarHBondContact CA-O 3.34Å; Y379-V452 VanDerWaalsContact CB-O 3.29Å; Y379-V452 WeakPolarHBondContact CB-O 3.05Å; S380-V452 PolarHBondContact N-O 3.09Å; S380-V452 PolarHBondContact O-N 2.95Å; I383-V452 HydrophobicContact CD1-CG2 4.41Å; F407-V452 HydrophobicContact CD1-CG2 3.86Å; F407-V452 HydrophobicContact CD2-CB 4.26Å; F407-V452 HydrophobicContact CD2-CG1 3.64Å; F407-V452 HydrophobicContact CD2-CG2 3.94Å; F407-V452 HydrophobicContact CE1-CG2 3.84Å; F407-V452 HydrophobicContact CE2-CB 4.11Å; F407-V452 HydrophobicContact CE2-CG1 3.83Å; F407-V452 HydrophobicContact CE2-CG2 3.89Å; F407-V452 HydrophobicContact CG-CG1 4.24Å; F407-V452 HydrophobicContact CG-CG2 3.93Å; F407-V452 HydrophobicContact CZ-CB 4.43Å; F407-V452 HydrophobicContact CZ-CG2 3.86Å; L448-V452 HydrophobicContact CD1-CG2 3.69Å; V452-A458 HydrophobicContact CG1-CB 3.86Å
453	V	91	Very high	90.5	Very high	53 Å²	53	48.9 Å²	48.9	32%	0.321	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	128	172.7	-178.7	0	0	0	0	108.1	P451	P451-V453 PolarHBondContact O-N 2.65Å
454	F	90.5	Very high	90.3	Very high	38 Å²	38	50.5 Å²	50.5	17%	0.167	26%	0.26	C	S	.	.			trans	-72.2	134	-175.9	-59.7	-20	0	0	0	111.6	I371 Y377 N378 Y379 A458 F459 A460	I371-F454 HydrophobicContact CG2-CE1 4.1Å; Y377-F454 WeakPolarHBondContact O-CE2 3.25Å; N378-F454 WeakPolarHBondContact O-CB 3.26Å; N378-F454 PolarHBondContact O-N 3.49Å; Y379-F454 VanDerWaalsContact C-CZ 3.48Å; F454-A458 CarbonylContact C-O 3.6Å; F454-A458 WeakPolarHBondContact CA-O 3.38Å; F454-F459 HydrophobicContact CB-CB 4.41Å; F454-F459 HydrophobicContact CG-CB 4.4Å; F454-A460 HydrophobicContact CE1-CB 4Å; F454-A460 HydrophobicContact CE2-CB 4.34Å; F454-A460 HydrophobicContact CZ-CB 3.61Å
455	N	88.8	Confident	89.6	Confident	62 Å²	62	57.2 Å²	57.2	33%	0.332	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-151.9	-171.4	174.5	64.7	11.7	0	0	0	110.2	Q408 K457 A458	Q408-N455 PolarHBondContact NE2-ND2 3.16Å; Q408-N455 PolarHBondContact NE2-OD1 3.03Å; N455-K457 PolarHBondContact O-N 3.29Å; N455-K457 WeakPolarHBondContact OD1-CA 3.18Å; N455-K457 PolarHBondContact OD1-N 2.69Å; N455-A458 PolarHBondContact N-O 3.05Å; N455-A458 CarbonylContact O-C 3.56Å; N455-A458 PolarHBondContact O-N 2.74Å; N455-A458 VanDerWaalsContact O-O 3.13Å; N455-A458 PolarHBondContact OD1-N 2.91Å
456	D	86.5	Confident	88.8	Confident	123 Å²	123	59 Å²	59	66%	0.658	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-25.7	175.7	60.2	-35.4	0	0	0	114.2
457	K	89.2	Confident	88.1	Confident	127 Å²	127	63.3 Å²	63.3	55%	0.552	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-13.3	-175.7	-63.7	-179.3	-175.5	-179.3	0	114.5	Q408 N455	Q408-K457 HydrophobicContact CB-CB 4Å; Q408-K457 HydrophobicContact CG-CB 3.88Å; N455-K457 PolarHBondContact O-N 3.29Å; N455-K457 WeakPolarHBondContact OD1-CA 3.18Å; N455-K457 PolarHBondContact OD1-N 2.69Å
458	A	91.1	Very high	87.5	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-149.8	121.9	174.7	0	0	0	0	0	111.5	P352 I371 F407 Q408 V452 F454 N455	P352-A458 VanDerWaalsContact O-CA 3.29Å; P352-A458 WeakPolarHBondContact O-CA 3.19Å; I371-A458 HydrophobicContact CD1-CB 4.1Å; F407-A458 HydrophobicContact CD2-CB 4.5Å; Q408-A458 HydrophobicContact CG-CB 3.32Å; V452-A458 HydrophobicContact CG1-CB 3.86Å; F454-A458 CarbonylContact C-O 3.6Å; F454-A458 WeakPolarHBondContact CA-O 3.38Å; N455-A458 PolarHBondContact N-O 3.05Å; N455-A458 CarbonylContact O-C 3.56Å; N455-A458 PolarHBondContact O-N 2.74Å; N455-A458 VanDerWaalsContact O-O 3.13Å; N455-A458 PolarHBondContact OD1-N 2.91Å
459	F	91.2	Very high	87	Confident	33 Å²	33	75.5 Å²	75.5	15%	0.145	39%	0.387	C	S	.	.			trans	-147.6	164.6	169.7	58.7	-100.6	0	0	0	109.5	H344 P352 W353 F454	H344-F459 AromaticContact CD2-CZ 3.94Å; H344-F459 AromaticContact NE2-CE1 3.72Å; H344-F459 AromaticContact NE2-CZ 3.69Å; P352-F459 HydrophobicContact CB-CD1 3.57Å; P352-F459 HydrophobicContact CB-CE1 3.51Å; P352-F459 HydrophobicContact CB-CG 4.27Å; P352-F459 HydrophobicContact CB-CZ 4.12Å; P352-F459 HydrophobicContact CG-CD1 3.57Å; P352-F459 HydrophobicContact CG-CD2 4.38Å; P352-F459 HydrophobicContact CG-CE1 2.98Å; P352-F459 HydrophobicContact CG-CE2 3.88Å; P352-F459 HydrophobicContact CG-CG 4.26Å; P352-F459 HydrophobicContact CG-CZ 3.15Å; W353-F459 WeakPolarHBondContact CA-O 3.3Å; W353-F459 VanDerWaalsContact CB-O 3.28Å; W353-F459 WeakPolarHBondContact CB-O 3.35Å; W353-F459 HydrophobicContact CE3-CD2 4.11Å; W353-F459 AromaticContact CE3-CE2 3.47Å; W353-F459 HydrophobicContact CE3-CE2 3.47Å; W353-F459 VanDerWaalsContact CE3-CE2 3.47Å; W353-F459 HydrophobicContact CE3-CZ 4.02Å; W353-F459 AromaticContact CZ3-CE2 3.52Å; W353-F459 HydrophobicContact CZ3-CE2 3.52Å; W353-F459 AromaticContact CZ3-CZ 3.8Å; W353-F459 HydrophobicContact CZ3-CZ 3.8Å; F454-F459 HydrophobicContact CB-CB 4.41Å; F454-F459 HydrophobicContact CG-CB 4.4Å
460	A	92.6	Very high	86.7	Confident	17 Å²	17	73.6 Å²	73.6	14%	0.14	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-77.7	144	-177.2	0	0	0	0	0	112.4	I371 P373 F454	I371-A460 HydrophobicContact CG2-CB 3.97Å; I371-A460 CarbonylContact O-C 3.55Å; I371-A460 VanDerWaalsContact O-CA 3.23Å; I371-A460 WeakPolarHBondContact O-CA 3.22Å; P373-A460 HydrophobicContact CB-CB 4.3Å; F454-A460 HydrophobicContact CE1-CB 4Å; F454-A460 HydrophobicContact CE2-CB 4.34Å; F454-A460 HydrophobicContact CZ-CB 3.61Å
461	I	91.8	Very high	86.5	Confident	33 Å²	33	72.3 Å²	72.3	17%	0.169	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-70.6	143.2	169.6	-165	170.5	0	0	0	110.2	W353 I371 I372 P373	W353-I461 HydrophobicContact CB-CB 3.87Å; W353-I461 HydrophobicContact CD2-CB 4.04Å; W353-I461 HydrophobicContact CD2-CD1 4.34Å; W353-I461 HydrophobicContact CD2-CG1 4.15Å; W353-I461 HydrophobicContact CG-CB 3.73Å; W353-I461 HydrophobicContact CG-CD1 4.33Å; W353-I461 HydrophobicContact CG-CG1 4.25Å; I371-I461 PolarHBondContact O-N 2.83Å; I372-I461 HydrophobicContact CG2-CG2 4.21Å; P373-I461 VanDerWaalsContact CD-O 3.28Å; P373-I461 WeakPolarHBondContact CD-O 3.23Å
462	C	87.8	Confident	86.1	Confident	71 Å²	71	75.6 Å²	75.6	48%	0.48	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-63.7	143.1	171.1	-56.5	0	0	0	0	110.4	C336	C336-C462 WeakPolarHBondContact CB-SG 3.39Å; C336-C462 WeakPolarHBondContact SG-CB 3.34Å; C336-C462 CovalentContact SG-SG 2.04Å; C336-C462 PolarHBondContact SG-SG 3.23Å
463	T	83.1	Confident	85.9	Confident	76 Å²	76	81.5 Å²	81.5	47%	0.466	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-94.3	136.6	172.5	54.6	0	0	0	0	109.4	P373	P373-T463 HydrophobicContact CG-CG2 4.44Å
464	A	81.8	Confident	85.7	Confident	40 Å²	40	83 Å²	83	33%	0.331	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-77	148.8	176.1	0	0	0	0	0	110.9	L468 A547	A464-L468 HydrophobicContact CB-CB 4.39Å; A464-L468 HydrophobicContact CB-CD2 3.65Å; A464-A547 HydrophobicContact CB-CB 3.99Å
465	W	77	Confident	85.6	Confident	142 Å²	142	84.9 Å²	84.9	54%	0.538	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-67.1	147.7	170.3	-64.3	65	0	0	0	109.6	S467 L468 W556	W465-S467 PolarHBondContact O-N 2.83Å; W465-S467 VanDerWaalsContact O-N 3.09Å; W465-L468 WeakPolarHBondContact O-CB 3.25Å; W465-L468 PolarHBondContact O-N 2.93Å; W465-W556 HydrophobicContact CH2-CB 3.89Å; W465-W556 HydrophobicContact CH2-CG 4.46Å
466	S	75.4	Confident	85.6	Confident	78 Å²	78	83.4 Å²	83.4	55%	0.545	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.1	178.7	56.2	0	0	0	0	113.5	L548	S466-L548 VanDerWaalsContact CB-O 3.24Å; S466-L548 WeakPolarHBondContact CB-O 3.43Å
467	S	79.6	Confident	85.7	Confident	92 Å²	92	80 Å²	80	64%	0.643	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-1	179.3	59	0	0	0	0	114.8	W465 K469	W465-S467 PolarHBondContact O-N 2.83Å; W465-S467 VanDerWaalsContact O-N 3.09Å; S467-K469 PolarHBondContact O-N 3.47Å
468	L	81.1	Confident	85.8	Confident	110 Å²	110	74.3 Å²	74.3	58%	0.576	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-64.9	120.4	-178.5	-175.9	68.7	0	0	0	110.2	A464 W465 L470	A464-L468 HydrophobicContact CB-CB 4.39Å; A464-L468 HydrophobicContact CB-CD2 3.65Å; W465-L468 WeakPolarHBondContact O-CB 3.25Å; W465-L468 PolarHBondContact O-N 2.93Å; L468-L470 HydrophobicContact CD2-CD2 4.46Å
469	K	83.2	Confident	85.8	Confident	189 Å²	189	74.5 Å²	74.5	82%	0.822	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-95.6	119.7	172.6	-66.6	-175.8	179.1	-178.7	0	109.2	S467	S467-K469 PolarHBondContact O-N 3.47Å
470	L	83.8	Confident	85.8	Confident	69 Å²	69	73.8 Å²	73.8	36%	0.361	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-74.5	138.4	171.7	-63.9	176.1	0	0	0	109.5	L468 I493 F512	L468-L470 HydrophobicContact CD2-CD2 4.46Å; L470-I493 HydrophobicContact CB-CD1 4.08Å; L470-I493 HydrophobicContact CB-CG2 4.27Å; L470-I493 HydrophobicContact CD1-CD1 4.12Å; L470-I493 HydrophobicContact CD2-CD1 3.93Å; L470-I493 HydrophobicContact CG-CD1 4.26Å; L470-F512 HydrophobicContact CD1-CB 3.91Å; L470-F512 HydrophobicContact CD1-CD1 3.52Å; L470-F512 HydrophobicContact CD1-CD2 3.91Å; L470-F512 HydrophobicContact CD1-CE1 3.88Å; L470-F512 HydrophobicContact CD1-CE2 4.25Å; L470-F512 HydrophobicContact CD1-CG 3.51Å; L470-F512 HydrophobicContact CD1-CZ 4.21Å
471	Q	86.3	Confident	85.7	Confident	147 Å²	147	75.2 Å²	75.2	69%	0.687	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-91.9	148.1	175	-63.2	-176.6	22.8	0	0	110	Q474	Q471-Q474 HydrophobicContact CB-CB 4.49Å; Q471-Q474 WeakPolarHBondContact O-CB 3.4Å; Q471-Q474 PolarHBondContact O-N 2.71Å
472	D	85.6	Confident	85.6	Confident	87 Å²	87	78.7 Å²	78.7	47%	0.465	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	151	171.8	-61.8	-42.4	0	0	0	110.9	Q474 T495	D472-Q474 PolarHBondContact O-N 2.98Å; D472-T495 HydrophobicContact CB-CG2 4.49Å; D472-T495 WeakPolarHBondContact OD1-CA 3.37Å; D472-T495 WeakPolarHBondContact OD1-CG2 3.01Å; D472-T495 PolarHBondContact OD1-N 2.78Å; D472-T495 WeakPolarHBondContact OD2-CG2 3.37Å
473	D	86.8	Confident	85.5	Confident	125 Å²	125	83.4 Å²	83.4	67%	0.668	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	5.4	-176.2	-59.8	-43.4	0	0	0	114.8	L475 I493	D473-L475 PolarHBondContact O-N 2.84Å; D473-I493 PolarHBondContact N-O 3.2Å
474	Q	87.5	Confident	85.7	Confident	85 Å²	85	80.8 Å²	80.8	40%	0.397	41%	0.413	S	S	.	.			trans	-65.5	125.6	173.6	-177.3	178	-4.6	0	0	110.1	Q471 D472 C476 I493	Q471-Q474 HydrophobicContact CB-CB 4.49Å; Q471-Q474 WeakPolarHBondContact O-CB 3.4Å; Q471-Q474 PolarHBondContact O-N 2.71Å; D472-Q474 PolarHBondContact O-N 2.98Å; Q474-C476 PolarHBondContact O-N 2.89Å; Q474-I493 HydrophobicContact CB-CB 4.44Å; Q474-I493 HydrophobicContact CB-CD1 3.82Å; Q474-I493 HydrophobicContact CG-CD1 4.08Å; Q474-I493 PolarHBondContact O-N 2.82Å
475	L	86.6	Confident	86.1	Confident	76 Å²	76	84.2 Å²	84.2	40%	0.398	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	128	177.4	-162.3	73.7	0	0	0	110.2	D473 Y477 P490 M491 K492	D473-L475 PolarHBondContact O-N 2.84Å; L475-Y477 HydrophobicContact CD2-CE2 3.99Å; L475-Y477 HydrophobicContact CG-CE2 4.23Å; L475-P490 HydrophobicContact CD1-CB 4.02Å; L475-P490 HydrophobicContact CG-CB 4.43Å; L475-M491 CarbonylContact C-O 3.29Å; L475-M491 WeakPolarHBondContact CA-O 3.31Å; L475-K492 HydrophobicContact CD1-CG 4.18Å
476	C	89.5	Confident	86.7	Confident	31 Å²	31	77.7 Å²	77.7	21%	0.209	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	167.8	173.7	-77.6	0	0	0	0	109.9	Q474 P490 M491 I493	Q474-C476 PolarHBondContact O-N 2.89Å; C476-P490 CarbonylContact O-C 3.45Å; C476-P490 WeakPolarHBondContact O-CA 3.29Å; C476-M491 PolarHBondContact N-O 3.41Å; C476-M491 PolarHBondContact O-N 3.25Å; C476-M491 VanDerWaalsContact O-O 3.14Å; C476-I493 HydrophobicContact CB-CG1 4.44Å; C476-I493 WeakPolarHBondContact SG-CD1 3.28Å
477	Y	89.8	Confident	87.3	Confident	52 Å²	52	76.8 Å²	76.8	20%	0.204	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	144.2	179	-65.1	-106.9	0	0	0	110.3	L345 F351 L475 K489 P490	L345-Y477 HydrophobicContact CB-CD2 4.43Å; L345-Y477 HydrophobicContact CB-CE1 4.19Å; L345-Y477 HydrophobicContact CB-CE2 3.84Å; L345-Y477 HydrophobicContact CD1-CD2 4.14Å; L345-Y477 HydrophobicContact CD1-CE2 3.7Å; L345-Y477 HydrophobicContact CD2-CD1 4.33Å; L345-Y477 HydrophobicContact CD2-CD2 3.43Å; L345-Y477 VanDerWaalsContact CD2-CD2 3.43Å; L345-Y477 HydrophobicContact CD2-CE2 3.7Å; L345-Y477 HydrophobicContact CD2-CG 3.8Å; L345-Y477 HydrophobicContact CG-CD2 4.18Å; L345-Y477 HydrophobicContact CG-CE2 3.92Å; L345-Y477 WeakPolarHBondContact O-CE1 3.46Å; F351-Y477 HydrophobicContact CZ-CD1 4.17Å; F351-Y477 HydrophobicContact CZ-CG 4.04Å; L475-Y477 HydrophobicContact CD2-CE2 3.99Å; L475-Y477 HydrophobicContact CG-CE2 4.23Å; Y477-K489 WeakPolarHBondContact CA-O 3.5Å; Y477-P490 HydrophobicContact CD1-CB 4.4Å; Y477-P490 HydrophobicContact CE1-CB 4.18Å
478	T	90.4	Very high	87.8	Confident	8 Å²	8	73.8 Å²	73.8	5%	0.049	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	155.9	174.3	-166.9	0	0	0	0	110.2	I480 A488 K489 M491 W541	T478-I480 HydrophobicContact CG2-CD1 4.2Å; T478-I480 HydrophobicContact CG2-CG1 3.97Å; T478-A488 CarbonylContact O-C 3.51Å; T478-A488 VanDerWaalsContact O-CA 3.28Å; T478-A488 WeakPolarHBondContact O-CA 3.42Å; T478-K489 HydrophobicContact CG2-CB 4.05Å; T478-K489 PolarHBondContact N-O 3.01Å; T478-K489 PolarHBondContact O-N 2.88Å; T478-M491 HydrophobicContact CG2-CE 3.52Å; T478-M491 HydrophobicContact CG2-CG 4.14Å; T478-W541 HydrophobicContact CG2-CE3 4Å; T478-W541 HydrophobicContact CG2-CH2 3.77Å; T478-W541 HydrophobicContact CG2-CZ3 3.47Å; T478-W541 VanDerWaalsContact CG2-CZ3 3.47Å
479	S	91.6	Very high	88.1	Confident	4 Å²	4	72 Å²	72	3%	0.028	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	131.8	170.1	-62.1	0	0	0	0	110	F351 N354 L368 S540	F351-S479 WeakPolarHBondContact CD2-OG 3.41Å; N354-S479 PolarHBondContact ND2-OG 3.07Å; N354-S479 WeakPolarHBondContact OD1-CB 3.21Å; N354-S479 PolarHBondContact OD1-OG 3.33Å; L368-S479 WeakPolarHBondContact CD1-O 3.45Å; S479-S540 WeakPolarHBondContact O-CB 3.46Å; S479-S540 PolarHBondContact O-N 2.75Å
480	I	90.5	Very high	88.3	Confident	18 Å²	18	65.3 Å²	65.3	9%	0.092	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	137.7	176.5	-54.4	177.4	0	0	0	108.3	T478 I486 I487 K489 W541	T478-I480 HydrophobicContact CG2-CD1 4.2Å; T478-I480 HydrophobicContact CG2-CG1 3.97Å; I480-I486 CarbonylContact O-C 3.49Å; I480-I486 WeakPolarHBondContact O-CA 3.43Å; I480-I487 HydrophobicContact CB-CG1 4.07Å; I480-I487 PolarHBondContact N-O 3.42Å; I480-I487 PolarHBondContact O-N 2.82Å; I480-K489 HydrophobicContact CD1-CB 4.22Å; I480-K489 HydrophobicContact CD1-CD 3.55Å; I480-K489 HydrophobicContact CD1-CG 3.8Å; I480-W541 HydrophobicContact CD1-CH2 4.43Å; I480-W541 HydrophobicContact CD1-CZ2 4.11Å
481	Y	89.9	Confident	88.5	Confident	47 Å²	47	62.2 Å²	62.2	18%	0.184	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	116.1	171.2	176.2	-97.6	0	0	0	109.5	V365 V412 G484 K485 I486	V365-Y481 HydrophobicContact CB-CD1 4.15Å; V365-Y481 HydrophobicContact CB-CE1 3.77Å; V365-Y481 HydrophobicContact CB-CE2 4.3Å; V365-Y481 HydrophobicContact CG1-CD1 4.06Å; V365-Y481 HydrophobicContact CG1-CD2 4.42Å; V365-Y481 HydrophobicContact CG1-CE1 4.21Å; V365-Y481 HydrophobicContact CG1-CG 4.15Å; V365-Y481 HydrophobicContact CG2-CD2 4.28Å; V365-Y481 HydrophobicContact CG2-CE1 3.95Å; V365-Y481 HydrophobicContact CG2-CE2 3.65Å; V365-Y481 VanDerWaalsContact CG2-CZ 3.44Å; V412-Y481 HydrophobicContact CB-CE2 4.32Å; V412-Y481 VanDerWaalsContact O-CE2 3.27Å; V412-Y481 WeakPolarHBondContact O-CE2 3.35Å; V412-Y481 PolarHBondContact O-OH 2.78Å; Y481-G484 WeakPolarHBondContact OH-CA 3.46Å; Y481-K485 CarbonylContact C-O 3.39Å; Y481-K485 WeakPolarHBondContact CA-O 3.41Å; Y481-I486 HydrophobicContact CD2-CG1 4.36Å
482	K	89.5	Confident	88.7	Confident	105 Å²	105	58.2 Å²	58.2	46%	0.457	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	133	178.8	-174	173.1	179.7	175	0	109.9	G484 K485 I487	K482-G484 VanDerWaalsContact C-N 3.26Å; K482-G484 PolarHBondContact O-N 3.05Å; K482-K485 PolarHBondContact N-O 2.86Å; K482-K485 PolarHBondContact O-N 2.82Å; K482-K485 VanDerWaalsContact O-O 3.07Å; K482-I487 HydrophobicContact CB-CD1 4.36Å
483	E	87.1	Confident	88.9	Confident	170 Å²	170	54.3 Å²	54.3	79%	0.794	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	40.5	174.6	-66.9	166.2	-149.9	0	0	114.2	K485	E483-K485 PolarHBondContact O-N 3.44Å
484	G	86.5	Confident	89	Confident	21 Å²	21	49.1 Å²	49.1	22%	0.216	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	5.5	179.4	0	0	0	0	0	114.8	K411 V412 Y481 K482	K411-G484 VanDerWaalsContact CA-O 3.27Å; K411-G484 WeakPolarHBondContact CA-O 3.4Å; V412-G484 PolarHBondContact N-O 3.43Å; V412-G484 CarbonylContact O-C 3.54Å; V412-G484 WeakPolarHBondContact O-CA 3.34Å; V412-G484 VanDerWaalsContact O-O 3.07Å; Y481-G484 WeakPolarHBondContact OH-CA 3.46Å; K482-G484 VanDerWaalsContact C-N 3.26Å; K482-G484 PolarHBondContact O-N 3.05Å
485	K	90	Very high	88.9	Confident	112 Å²	112	47.4 Å²	47.4	49%	0.487	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	149.2	179.5	-66.4	179.9	-177.2	174.7	0	111.9	D410 K411 Y481 K482 E483	D410-K485 VanDerWaalsContact O-CA 3.24Å; D410-K485 WeakPolarHBondContact O-CA 3.38Å; K411-K485 HydrophobicContact CG-CG 4.21Å; Y481-K485 CarbonylContact C-O 3.39Å; Y481-K485 WeakPolarHBondContact CA-O 3.41Å; K482-K485 PolarHBondContact N-O 2.86Å; K482-K485 PolarHBondContact O-N 2.82Å; K482-K485 VanDerWaalsContact O-O 3.07Å; E483-K485 PolarHBondContact O-N 3.44Å
486	I	89.5	Confident	88.7	Confident	6 Å²	6	48.4 Å²	48.4	3%	0.031	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	125.8	168.1	-50.6	171.3	0	0	0	108	P350 N354 V356 T409 D410 I480 Y481	P350-I486 HydrophobicContact CB-CB 4.11Å; P350-I486 HydrophobicContact CB-CG2 4.2Å; N354-I486 HydrophobicContact CB-CD1 4.41Å; V356-I486 HydrophobicContact CG2-CD1 3.3Å; V356-I486 HydrophobicContact CG2-CG1 4.1Å; T409-I486 WeakPolarHBondContact O-CD1 3.41Å; D410-I486 PolarHBondContact O-N 3.43Å; D410-I486 VanDerWaalsContact O-N 3.1Å; I480-I486 CarbonylContact O-C 3.49Å; I480-I486 WeakPolarHBondContact O-CA 3.43Å; Y481-I486 HydrophobicContact CD2-CG1 4.36Å
487	I	89	Confident	88.5	Confident	58 Å²	58	52 Å²	52	30%	0.297	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.7	177.4	59.1	175.8	0	0	0	109.8	I480 K482	I480-I487 HydrophobicContact CB-CG1 4.07Å; I480-I487 PolarHBondContact N-O 3.42Å; I480-I487 PolarHBondContact O-N 2.82Å; K482-I487 HydrophobicContact CB-CD1 4.36Å
488	A	88.7	Confident	88.4	Confident	29 Å²	29	53.6 Å²	53.6	24%	0.24	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	140.2	170.6	0	0	0	0	0	110	F351 T478	F351-A488 HydrophobicContact CD2-CB 4.48Å; F351-A488 HydrophobicContact CE1-CB 4.48Å; F351-A488 HydrophobicContact CE2-CB 3.68Å; F351-A488 HydrophobicContact CZ-CB 3.67Å; T478-A488 CarbonylContact O-C 3.51Å; T478-A488 VanDerWaalsContact O-CA 3.28Å; T478-A488 WeakPolarHBondContact O-CA 3.42Å
489	K	88.5	Confident	88.1	Confident	72 Å²	72	54.1 Å²	54.1	31%	0.313	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	136.5	171.9	-71.2	-154.4	179.5	-171.9	0	111.8	Y477 T478 I480 M491	Y477-K489 WeakPolarHBondContact CA-O 3.5Å; T478-K489 HydrophobicContact CG2-CB 4.05Å; T478-K489 PolarHBondContact N-O 3.01Å; T478-K489 PolarHBondContact O-N 2.88Å; I480-K489 HydrophobicContact CD1-CB 4.22Å; I480-K489 HydrophobicContact CD1-CD 3.55Å; I480-K489 HydrophobicContact CD1-CG 3.8Å; K489-M491 HydrophobicContact CB-CE 3.45Å; K489-M491 VanDerWaalsContact CB-CE 3.45Å; K489-M491 HydrophobicContact CD-CE 4.33Å
490	P	87.7	Confident	87.9	Confident	49 Å²	49	55.8 Å²	55.8	32%	0.318	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	146.4	173.3	31.5	-34.1	0	0	0	111.4	L475 C476 Y477	L475-P490 HydrophobicContact CD1-CB 4.02Å; L475-P490 HydrophobicContact CG-CB 4.43Å; C476-P490 CarbonylContact O-C 3.45Å; C476-P490 WeakPolarHBondContact O-CA 3.29Å; Y477-P490 HydrophobicContact CD1-CB 4.4Å; Y477-P490 HydrophobicContact CE1-CB 4.18Å
491	M	88.5	Confident	87.8	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.02	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	148	-178.4	-59.2	-63.6	148.9	0	0	109.3	L475 C476 T478 K489 V514 H516 W541	L475-M491 CarbonylContact C-O 3.29Å; L475-M491 WeakPolarHBondContact CA-O 3.31Å; C476-M491 PolarHBondContact N-O 3.41Å; C476-M491 PolarHBondContact O-N 3.25Å; C476-M491 VanDerWaalsContact O-O 3.14Å; T478-M491 HydrophobicContact CG2-CE 3.52Å; T478-M491 HydrophobicContact CG2-CG 4.14Å; K489-M491 HydrophobicContact CB-CE 3.45Å; K489-M491 VanDerWaalsContact CB-CE 3.45Å; K489-M491 HydrophobicContact CD-CE 4.33Å; M491-V514 HydrophobicContact CB-CB 4.08Å; M491-V514 HydrophobicContact CB-CG2 4.46Å; M491-H516 HydrophobicContact CE-CB 4.43Å; M491-H516 VanDerWaalsContact SD-CA 3.57Å; M491-H516 HydrophobicContact SD-CB 3.9Å; M491-W541 HydrophobicContact CE-CH2 3.1Å; M491-W541 HydrophobicContact CE-CZ2 4.28Å; M491-W541 HydrophobicContact CE-CZ3 3.47Å; M491-W541 VanDerWaalsContact CE-CZ3 3.47Å; M491-W541 HydrophobicContact CG-CH2 4.3Å; M491-W541 HydrophobicContact CG-CZ3 3.72Å; M491-W541 HydrophobicContact SD-CH2 3.41Å; M491-W541 WeakPolarHBondContact SD-CH2 3.19Å; M491-W541 HydrophobicContact SD-CZ3 3.38Å; M491-W541 WeakPolarHBondContact SD-CZ3 3.47Å
492	K	90.3	Very high	87.5	Confident	64 Å²	64	68.1 Å²	68.1	28%	0.278	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	133.4	172.7	-67.7	-177.9	-176.6	171.2	0	109.9	L475 V514 T515 E517	L475-K492 HydrophobicContact CD1-CG 4.18Å; K492-V514 CarbonylContact O-C 3.55Å; K492-V514 WeakPolarHBondContact O-CA 3.41Å; K492-T515 PolarHBondContact N-O 3.48Å; K492-T515 PolarHBondContact O-N 2.92Å; K492-E517 VanDerWaalsContact CE-CD 3.42Å; K492-E517 VanDerWaalsContact CE-OE1 3.31Å; K492-E517 WeakPolarHBondContact CE-OE1 3.36Å; K492-E517 VanDerWaalsContact CE-OE2 3.28Å; K492-E517 WeakPolarHBondContact CE-OE2 3.27Å; K492-E517 VanDerWaalsContact NZ-CD 3.3Å; K492-E517 IonicContact NZ-OE1 3.63Å; K492-E517 PolarHBondContact NZ-OE1 2.94Å; K492-E517 IonicContact NZ-OE2 2.75Å
493	I	88.7	Confident	87	Confident	4 Å²	4	66.5 Å²	66.5	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	138	170.9	-66.8	163.4	0	0	0	108.9	L470 D473 Q474 C476 C513 V514	L470-I493 HydrophobicContact CB-CD1 4.08Å; L470-I493 HydrophobicContact CB-CG2 4.27Å; L470-I493 HydrophobicContact CD1-CD1 4.12Å; L470-I493 HydrophobicContact CD2-CD1 3.93Å; L470-I493 HydrophobicContact CG-CD1 4.26Å; D473-I493 PolarHBondContact N-O 3.2Å; Q474-I493 HydrophobicContact CB-CB 4.44Å; Q474-I493 HydrophobicContact CB-CD1 3.82Å; Q474-I493 HydrophobicContact CG-CD1 4.08Å; Q474-I493 PolarHBondContact O-N 2.82Å; C476-I493 HydrophobicContact CB-CG1 4.44Å; C476-I493 WeakPolarHBondContact SG-CD1 3.28Å; I493-C513 WeakPolarHBondContact CA-O 3.07Å; I493-V514 HydrophobicContact CG1-CG1 4.25Å
494	V	89	Confident	86.7	Confident	17 Å²	17	64.3 Å²	64.3	10%	0.103	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	141.9	-176.6	174.4	0	0	0	0	109.8	H498 C513 T515	V494-H498 HydrophobicContact CG1-CB 3.41Å; V494-H498 VanDerWaalsContact CG1-CB 3.41Å; V494-H498 WeakPolarHBondContact CG1-CD2 3.41Å; V494-C513 PolarHBondContact N-O 2.97Å; V494-T515 HydrophobicContact CB-CG2 4.4Å; V494-T515 HydrophobicContact CG2-CG2 3.65Å; V494-T515 WeakPolarHBondContact CG2-OG1 3.21Å
495	T	84.8	Confident	86.2	Confident	48 Å²	48	67.8 Å²	67.8	29%	0.294	34%	0.341	S	S	.	.			trans	-49.8	147.3	177.9	52.9	0	0	0	0	112.3	D472 D497 H498 C499	D472-T495 HydrophobicContact CB-CG2 4.49Å; D472-T495 WeakPolarHBondContact OD1-CA 3.37Å; D472-T495 WeakPolarHBondContact OD1-CG2 3.01Å; D472-T495 PolarHBondContact OD1-N 2.78Å; D472-T495 WeakPolarHBondContact OD2-CG2 3.37Å; T495-D497 PolarHBondContact O-N 3.37Å; T495-H498 PolarHBondContact O-N 3.06Å; T495-H498 VanDerWaalsContact OG1-CB 3.26Å; T495-H498 WeakPolarHBondContact OG1-CB 3.41Å; T495-H498 PolarHBondContact OG1-N 3.01Å; T495-H498 VanDerWaalsContact OG1-N 3.09Å; T495-C499 PolarHBondContact O-N 2.96Å
496	K	83.7	Confident	85.4	Confident	97 Å²	97	64.5 Å²	64.5	42%	0.422	33%	0.328	S	S	.	.	H	α-helix	trans	-54.3	-39.5	168.6	-161.6	-176	-173.1	-129.1	0	111.4	H498 C499 E500 K507	K496-H498 PolarHBondContact O-N 3.3Å; K496-C499 VanDerWaalsContact O-CB 3.31Å; K496-C499 WeakPolarHBondContact O-CB 3.37Å; K496-C499 PolarHBondContact O-N 3.05Å; K496-C499 VanDerWaalsContact O-N 3.12Å; K496-E500 WeakPolarHBondContact CD-OE1 3.28Å; K496-E500 WeakPolarHBondContact CE-OE1 3.41Å; K496-E500 HydrophobicContact CG-CG 4.23Å; K496-E500 IonicContact NZ-OE1 3.25Å; K496-E500 PolarHBondContact NZ-OE1 3.09Å; K496-E500 WeakPolarHBondContact O-CB 3.32Å; K496-E500 VanDerWaalsContact O-CG 3.31Å; K496-E500 WeakPolarHBondContact O-CG 3.21Å; K496-E500 PolarHBondContact O-N 3.2Å; K496-K507 PolarHBondContact NZ-O 3.22Å
497	D	85.8	Confident	84.5	Confident	108 Å²	108	69.4 Å²	69.4	58%	0.578	35%	0.349	S	S	*	.	H	α-helix	trans	-62.4	-39.6	179.8	-68.4	-9.8	0	0	0	113.2	T495 C499 K501	T495-D497 PolarHBondContact O-N 3.37Å; D497-C499 VanDerWaalsContact C-N 3.33Å; D497-K501 VanDerWaalsContact O-CG 3.3Å; D497-K501 WeakPolarHBondContact O-CG 3.15Å; D497-K501 PolarHBondContact O-N 2.84Å
498	H	86.9	Confident	83.7	Confident	85 Å²	85	78 Å²	78	39%	0.394	38%	0.378	S	S	.	.	H	α-helix	trans	-66.6	-39.6	174.4	178.9	105.9	0	0	0	110.9	V494 T495 K496 K501 E502	V494-H498 HydrophobicContact CG1-CB 3.41Å; V494-H498 VanDerWaalsContact CG1-CB 3.41Å; V494-H498 WeakPolarHBondContact CG1-CD2 3.41Å; T495-H498 PolarHBondContact O-N 3.06Å; T495-H498 VanDerWaalsContact OG1-CB 3.26Å; T495-H498 WeakPolarHBondContact OG1-CB 3.41Å; T495-H498 PolarHBondContact OG1-N 3.01Å; T495-H498 VanDerWaalsContact OG1-N 3.09Å; K496-H498 PolarHBondContact O-N 3.3Å; H498-K501 WeakPolarHBondContact O-CB 3.49Å; H498-K501 PolarHBondContact O-N 3.3Å; H498-E502 PolarHBondContact O-N 3.07Å
499	C	84.8	Confident	82.7	Confident	19 Å²	19	81 Å²	81	13%	0.128	39%	0.387	C	S	.	.	H	α-helix	trans	-66.1	-42.4	177.6	-129.2	0	0	0	0	114	T495 K496 D497 K501 E502 D503 L506 C513	T495-C499 PolarHBondContact O-N 2.96Å; K496-C499 VanDerWaalsContact O-CB 3.31Å; K496-C499 WeakPolarHBondContact O-CB 3.37Å; K496-C499 PolarHBondContact O-N 3.05Å; K496-C499 VanDerWaalsContact O-N 3.12Å; D497-C499 VanDerWaalsContact C-N 3.33Å; C499-K501 PolarHBondContact O-N 3.29Å; C499-E502 PolarHBondContact O-N 2.97Å; C499-E502 VanDerWaalsContact O-N 3.14Å; C499-D503 PolarHBondContact O-N 2.74Å; C499-L506 HydrophobicContact CB-CD1 4.32Å; C499-L506 VanDerWaalsContact SG-CD1 3.57Å; C499-C513 HydrophobicContact CB-CB 3.6Å; C499-C513 WeakPolarHBondContact CB-SG 3.2Å; C499-C513 WeakPolarHBondContact SG-CB 3.39Å; C499-C513 CovalentContact SG-SG 1.98Å; C499-C513 PolarHBondContact SG-SG 3.1Å
500	E	85.9	Confident	81.8	Confident	39 Å²	39	81.4 Å²	81.4	18%	0.182	40%	0.399	C	S	.	.	H	α-helix	trans	-68.4	-19	178.5	-71.3	-175.5	-177.9	0	0	113	K496 K507	K496-E500 WeakPolarHBondContact CD-OE1 3.28Å; K496-E500 WeakPolarHBondContact CE-OE1 3.41Å; K496-E500 HydrophobicContact CG-CG 4.23Å; K496-E500 IonicContact NZ-OE1 3.25Å; K496-E500 PolarHBondContact NZ-OE1 3.09Å; K496-E500 WeakPolarHBondContact O-CB 3.32Å; K496-E500 VanDerWaalsContact O-CG 3.31Å; K496-E500 WeakPolarHBondContact O-CG 3.21Å; K496-E500 PolarHBondContact O-N 3.2Å; E500-K507 HydrophobicContact CB-CG 4.1Å; E500-K507 HydrophobicContact CG-CG 3.61Å; E500-K507 VanDerWaalsContact OE2-CE 3.31Å; E500-K507 WeakPolarHBondContact OE2-CE 3.4Å
501	K	88	Confident	81.3	Confident	172 Å²	172	81 Å²	81	75%	0.748	40%	0.404	S	S	*	.	H	α-helix	trans	-75.7	-37	171	-74.1	170.5	-175.4	176.5	0	111.9	D497 H498 C499	D497-K501 VanDerWaalsContact O-CG 3.3Å; D497-K501 WeakPolarHBondContact O-CG 3.15Å; D497-K501 PolarHBondContact O-N 2.84Å; H498-K501 WeakPolarHBondContact O-CB 3.49Å; H498-K501 PolarHBondContact O-N 3.3Å; C499-K501 PolarHBondContact O-N 3.29Å
502	E	83.8	Confident	80.7	Confident	152 Å²	152	83.2 Å²	83.2	71%	0.71	41%	0.413	S	S	*	.	H	α-helix	trans	-77.7	-43.4	179	-68	-64.1	147.7	0	0	112	H498 C499	H498-E502 PolarHBondContact O-N 3.07Å; C499-E502 PolarHBondContact O-N 2.97Å; C499-E502 VanDerWaalsContact O-N 3.14Å
503	D	80.5	Confident	80.6	Confident	70 Å²	70	80.7 Å²	80.7	37%	0.374	40%	0.404	S	S	.	.			trans	-141.2	111	178.5	-170	-16.2	0	0	0	112.4	C499 T505 L506	C499-D503 PolarHBondContact O-N 2.74Å; D503-T505 PolarHBondContact O-N 2.88Å; D503-T505 VanDerWaalsContact OD1-CB 3.3Å; D503-T505 WeakPolarHBondContact OD1-CB 3.33Å; D503-T505 WeakPolarHBondContact OD1-CG2 3.43Å; D503-T505 PolarHBondContact OD1-N 2.83Å; D503-T505 PolarHBondContact OD1-OG1 3.32Å; D503-T505 PolarHBondContact OD2-OG1 2.95Å; D503-T505 VanDerWaalsContact OD2-OG1 3.09Å; D503-L506 HydrophobicContact CB-CD1 3.92Å; D503-L506 HydrophobicContact CB-CG 4.01Å; D503-L506 WeakPolarHBondContact O-CB 3.36Å; D503-L506 PolarHBondContact O-N 2.98Å
504	I	79	Confident	80.5	Confident	125 Å²	125	82.7 Å²	82.7	64%	0.641	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-61.8	-25.4	-179.8	-59.8	171.7	0	0	0	111.7	L506 K507	I504-L506 PolarHBondContact O-N 2.82Å; I504-K507 HydrophobicContact CG2-CD 4.2Å; I504-K507 WeakPolarHBondContact O-CB 3.34Å; I504-K507 WeakPolarHBondContact O-CG 3.3Å; I504-K507 PolarHBondContact O-N 3.42Å
505	T	77.1	Confident	80.4	Confident	94 Å²	94	84.6 Å²	84.6	58%	0.577	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-66.8	-26.9	-179.6	66.8	0	0	0	0	112.4	D503 K507 R508	D503-T505 PolarHBondContact O-N 2.88Å; D503-T505 VanDerWaalsContact OD1-CB 3.3Å; D503-T505 WeakPolarHBondContact OD1-CB 3.33Å; D503-T505 WeakPolarHBondContact OD1-CG2 3.43Å; D503-T505 PolarHBondContact OD1-N 2.83Å; D503-T505 PolarHBondContact OD1-OG1 3.32Å; D503-T505 PolarHBondContact OD2-OG1 2.95Å; D503-T505 VanDerWaalsContact OD2-OG1 3.09Å; T505-K507 PolarHBondContact O-N 2.75Å; T505-R508 PolarHBondContact O-N 3.16Å
506	L	72.6	Confident	80.4	Confident	43 Å²	43	86.4 Å²	86.4	23%	0.225	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-68.5	-14.4	178	-61.1	176.5	0	0	0	113.3	C499 D503 I504 R508 E509	C499-L506 HydrophobicContact CB-CD1 4.32Å; C499-L506 VanDerWaalsContact SG-CD1 3.57Å; D503-L506 HydrophobicContact CB-CD1 3.92Å; D503-L506 HydrophobicContact CB-CG 4.01Å; D503-L506 WeakPolarHBondContact O-CB 3.36Å; D503-L506 PolarHBondContact O-N 2.98Å; I504-L506 PolarHBondContact O-N 2.82Å; L506-R508 PolarHBondContact O-N 3.44Å; L506-R508 VanDerWaalsContact O-N 3.15Å; L506-E509 PolarHBondContact O-N 2.81Å
507	K	72.1	Confident	80	Confident	108 Å²	108	86.1 Å²	86.1	47%	0.47	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-55.3	-34.2	176	-74.7	-170.2	173.1	-175	0	113.4	K496 E500 I504 T505	K496-K507 PolarHBondContact NZ-O 3.22Å; E500-K507 HydrophobicContact CB-CG 4.1Å; E500-K507 HydrophobicContact CG-CG 3.61Å; E500-K507 VanDerWaalsContact OE2-CE 3.31Å; E500-K507 WeakPolarHBondContact OE2-CE 3.4Å; I504-K507 HydrophobicContact CG2-CD 4.2Å; I504-K507 WeakPolarHBondContact O-CB 3.34Å; I504-K507 WeakPolarHBondContact O-CG 3.3Å; I504-K507 PolarHBondContact O-N 3.42Å; T505-K507 PolarHBondContact O-N 2.75Å
508	R	71.7	Confident	79	Confident	238 Å²	238	88.8 Å²	88.8	90%	0.898	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-91.1	-10.3	-174.6	-68.8	-175.1	178.4	176.7	0.8	113.6	T505 L506	T505-R508 PolarHBondContact O-N 3.16Å; L506-R508 PolarHBondContact O-N 3.44Å; L506-R508 VanDerWaalsContact O-N 3.15Å
509	E	67.7	Low	77.2	Confident	93 Å²	93	93.2 Å²	93.2	44%	0.435	46%	0.462	S	S	.	.	S	Bend	trans	-91.9	141.1	-177.6	-59.4	-161.7	157.5	0	0	110.5	L506	L506-E509 PolarHBondContact O-N 2.81Å
510	S	70.4	Confident	74.8	Confident	81 Å²	81	97 Å²	97	57%	0.566	49%	0.49	S	S	*	.			trans	-84.2	124.6	171.2	53.9	0	0	0	0	109
511	G	76.1	Confident	72.2	Confident	40 Å²	40	103.5 Å²	103.5	41%	0.412	52%	0.519	S	S	.	.	S	Bend	trans	162.9	-169.7	177.4	0	0	0	0	0	114.4
512	F	76.8	Confident	69.6	Low	50 Å²	50	104.2 Å²	104.2	22%	0.219	53%	0.525	C	S	.	.			trans	-124.6	155.1	172.9	56	-91.9	0	0	0	109.4	L470 V514 H544 W545	L470-F512 HydrophobicContact CD1-CB 3.91Å; L470-F512 HydrophobicContact CD1-CD1 3.52Å; L470-F512 HydrophobicContact CD1-CD2 3.91Å; L470-F512 HydrophobicContact CD1-CE1 3.88Å; L470-F512 HydrophobicContact CD1-CE2 4.25Å; L470-F512 HydrophobicContact CD1-CG 3.51Å; L470-F512 HydrophobicContact CD1-CZ 4.21Å; F512-V514 HydrophobicContact CD2-CG1 3.9Å; F512-V514 HydrophobicContact CE2-CG1 3.91Å; F512-H544 WeakPolarHBondContact CE1-O 3.49Å; F512-H544 HydrophobicContact CZ-CB 3.97Å; F512-H544 WeakPolarHBondContact CZ-O 3.34Å; F512-W545 WeakPolarHBondContact O-CH2 3.24Å; F512-W545 WeakPolarHBondContact O-CZ2 3.24Å; F512-W545 WeakPolarHBondContact O-CZ3 3.27Å
513	C	86.5	Confident	67.1	Low	12 Å²	12	103.9 Å²	103.9	8%	0.081	53%	0.528	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	147.4	-178.6	-75.8	0	0	0	0	112	I493 V494 C499	I493-C513 WeakPolarHBondContact CA-O 3.07Å; V494-C513 PolarHBondContact N-O 2.97Å; C499-C513 HydrophobicContact CB-CB 3.6Å; C499-C513 WeakPolarHBondContact CB-SG 3.2Å; C499-C513 WeakPolarHBondContact SG-CB 3.39Å; C499-C513 CovalentContact SG-SG 1.98Å; C499-C513 PolarHBondContact SG-SG 3.1Å
514	V	87.8	Confident	64.6	Low	46 Å²	46	107.2 Å²	107.2	28%	0.279	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.8	138.7	175.2	-61.8	0	0	0	0	109.9	M491 K492 I493 F512 W541	M491-V514 HydrophobicContact CB-CB 4.08Å; M491-V514 HydrophobicContact CB-CG2 4.46Å; K492-V514 CarbonylContact O-C 3.55Å; K492-V514 WeakPolarHBondContact O-CA 3.41Å; I493-V514 HydrophobicContact CG1-CG1 4.25Å; F512-V514 HydrophobicContact CD2-CG1 3.9Å; F512-V514 HydrophobicContact CE2-CG1 3.91Å; V514-W541 HydrophobicContact CG2-CE3 4.39Å; V514-W541 HydrophobicContact CG2-CZ3 4.37Å
515	T	87.6	Confident	62.4	Low	56 Å²	56	106.2 Å²	106.2	34%	0.344	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.2	137.3	172.7	53.7	0	0	0	0	109.5	K492 V494 E517	K492-T515 PolarHBondContact N-O 3.48Å; K492-T515 PolarHBondContact O-N 2.92Å; V494-T515 HydrophobicContact CB-CG2 4.4Å; V494-T515 HydrophobicContact CG2-CG2 3.65Å; V494-T515 WeakPolarHBondContact CG2-OG1 3.21Å; T515-E517 PolarHBondContact O-N 3.4Å
516	H	83.7	Confident	60.3	Low	86 Å²	86	109.4 Å²	109.4	40%	0.398	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70	128.2	168.3	-179.9	-112.4	0	0	0	108.4	M491 E518	M491-H516 HydrophobicContact CE-CB 4.43Å; M491-H516 VanDerWaalsContact SD-CA 3.57Å; M491-H516 HydrophobicContact SD-CB 3.9Å; H516-E518 VanDerWaalsContact C-N 3.25Å; H516-E518 PolarHBondContact O-N 3.25Å
517	E	75.4	Confident	58.3	Low	91 Å²	91	110.9 Å²	110.9	43%	0.425	59%	0.59	S	S	.	*			trans	-70.3	93.2	166.7	-170.5	160.6	-148.7	0	0	106.7	K492 T515 Q519	K492-E517 VanDerWaalsContact CE-CD 3.42Å; K492-E517 VanDerWaalsContact CE-OE1 3.31Å; K492-E517 WeakPolarHBondContact CE-OE1 3.36Å; K492-E517 VanDerWaalsContact CE-OE2 3.28Å; K492-E517 WeakPolarHBondContact CE-OE2 3.27Å; K492-E517 VanDerWaalsContact NZ-CD 3.3Å; K492-E517 IonicContact NZ-OE1 3.63Å; K492-E517 PolarHBondContact NZ-OE1 2.94Å; K492-E517 IonicContact NZ-OE2 2.75Å; T515-E517 PolarHBondContact O-N 3.4Å; E517-Q519 PolarHBondContact O-N 3.39Å
518	E	64.3	Low	56.3	Low	164 Å²	164	116 Å²	116	77%	0.766	61%	0.612	S	S	*	*			trans	-60.4	107.8	173.9	-151.3	170.7	-148.9	0	0	106.5	H516 S520	H516-E518 VanDerWaalsContact C-N 3.25Å; H516-E518 PolarHBondContact O-N 3.25Å; E518-S520 PolarHBondContact O-N 3.19Å
519	Q	50.1	Low	54.2	Low	178 Å²	178	108.1 Å²	108.1	83%	0.832	61%	0.605	S	S	*	*			trans	-64.1	87.4	168.9	-77.4	-174.8	-11.3	0	0	106.9	E517 H521	E517-Q519 PolarHBondContact O-N 3.39Å; Q519-H521 VanDerWaalsContact C-N 3.3Å; Q519-H521 PolarHBondContact O-N 3.12Å
520	S	33.6	Very low	52.3	Low	100 Å²	100	109.5 Å²	109.5	70%	0.699	62%	0.622	S	S	*	*	S	Bend	trans	-57.3	97.4	164.4	54.5	0	0	0	0	106.8	E518	E518-S520 PolarHBondContact O-N 3.19Å
521	H	32.6	Very low	50.3	Low	174 Å²	174	113.1 Å²	113.1	81%	0.806	63%	0.634	S	S	*	*			trans	160	43.9	154.1	-85.2	-65.3	0	0	0	114.1	Q519	Q519-H521 VanDerWaalsContact C-N 3.3Å; Q519-H521 PolarHBondContact O-N 3.12Å
522	E	32.5	Very low	47.7	Very low	187 Å²	187	116.4 Å²	116.4	87%	0.874	66%	0.658	S	S	*	*			trans	-109.2	87.4	156.3	-142.1	170.8	-161.5	0	0	109.4	V524	E522-V524 PolarHBondContact O-N 2.68Å
523	L	30.4	Very low	45.3	Very low	145 Å²	145	120 Å²	120	76%	0.759	68%	0.684	S	S	*	*			trans	-55.7	106.3	170.2	-96.8	142.5	0	0	0	109.2	T525	L523-T525 PolarHBondContact O-N 3.12Å; L523-T525 VanDerWaalsContact O-N 3.12Å
524	V	29	Very low	42.3	Very low	140 Å²	140	125.5 Å²	125.5	85%	0.848	72%	0.717	S	S	*	*			trans	-57.4	109	162	175.2	0	0	0	0	108.3	E522	E522-V524 PolarHBondContact O-N 2.68Å
525	T	32.7	Very low	39.2	Very low	105 Å²	105	130.5 Å²	130.5	64%	0.644	74%	0.738	S	S	*	*			trans	-126.6	121	156.8	53.2	0	0	0	0	109.9	L523	L523-T525 PolarHBondContact O-N 3.12Å; L523-T525 VanDerWaalsContact O-N 3.12Å
526	N	32.7	Very low	36.3	Very low	160 Å²	160	133.3 Å²	133.3	86%	0.856	75%	0.75	S	S	*	*			trans	87.7	112.7	156	-54.7	-33.3	0	0	0	118.5
527	G	30.7	Very low	33.6	Very low	75 Å²	75	133.9 Å²	133.9	77%	0.773	76%	0.76	S	S	*	*			trans	144.1	71.2	139.3	0	0	0	0	0	118.1
528	K	31.1	Very low	31.6	Very low	216 Å²	216	134.7 Å²	134.7	94%	0.939	76%	0.759	S	S	*	*			trans	23.3	121.9	145.2	-69	177.6	176.7	176.7	0	119.6
529	G	27.3	Very low	29.9	Very low	72 Å²	72	128.1 Å²	128.1	74%	0.742	73%	0.731	S	S	*	*				115.7	143.5	128	0	0	0	0	0	116.4
530	P	27.4	Very low	29.2	Very low	122 Å²	122	120 Å²	120	79%	0.792	70%	0.695	S	S	*	*			trans	-95.3	124.3	-147.6	34.9	-27.6	0	0	0	111.6
531	N	27.6	Very low	29.2	Very low	156 Å²	156	119.8 Å²	119.8	83%	0.834	68%	0.679	S	S	*	*			trans	-148.7	102.5	153.5	-86.7	-39.5	0	0	0	108.1	V533	N531-V533 PolarHBondContact O-N 2.87Å
532	A	22.9	Very low	29.3	Very low	110 Å²	110	114.7 Å²	114.7	91%	0.909	66%	0.655	S	S	*	*			trans	-61	99.2	172.3	0	0	0	0	0	109.4
533	V	24.5	Very low	29.4	Very low	126 Å²	126	106.5 Å²	106.5	76%	0.764	62%	0.617	S	S	*	*			trans	-105.3	107.8	163.3	-179.2	0	0	0	0	105.9	N531 E535	N531-V533 PolarHBondContact O-N 2.87Å; V533-E535 PolarHBondContact O-N 3.13Å
534	T	23.5	Very low	29.6	Very low	127 Å²	127	103.9 Å²	103.9	78%	0.779	60%	0.601	S	S	*	*			trans	-47.9	109.2	175.3	37.1	0	0	0	0	110.7	L536	T534-L536 PolarHBondContact O-N 2.87Å; T534-L536 VanDerWaalsContact O-N 3.13Å
535	E	23.5	Very low	29.9	Very low	151 Å²	151	100.1 Å²	100.1	71%	0.706	57%	0.572	S	S	*	*			trans	-69.7	100.6	176.4	-160.3	174.7	-171.3	0	0	108.5	V533 T537	V533-E535 PolarHBondContact O-N 3.13Å; E535-T537 VanDerWaalsContact C-N 3.3Å; E535-T537 HydrophobicContact CG-CG2 4.32Å; E535-T537 PolarHBondContact O-N 2.85Å; E535-T537 VanDerWaalsContact O-N 3.07Å
536	L	25.7	Very low	29.9	Very low	115 Å²	115	98.1 Å²	98.1	60%	0.602	55%	0.553	S	S	*	*			trans	-79.1	82.6	171.4	-77.6	165	0	0	0	108.6	T534 Y538	T534-L536 PolarHBondContact O-N 2.87Å; T534-L536 VanDerWaalsContact O-N 3.13Å; L536-Y538 VanDerWaalsContact C-N 3.26Å; L536-Y538 HydrophobicContact CB-CD2 3.92Å; L536-Y538 HydrophobicContact CB-CE2 3.84Å; L536-Y538 HydrophobicContact CD1-CE2 4.11Å; L536-Y538 HydrophobicContact CD2-CD2 4.46Å; L536-Y538 HydrophobicContact CD2-CE2 3.66Å; L536-Y538 HydrophobicContact CG-CE2 4.07Å; L536-Y538 PolarHBondContact O-N 2.93Å
537	T	27	Very low	29.7	Very low	98 Å²	98	93.4 Å²	93.4	60%	0.601	54%	0.536	S	S	*	.			trans	-72.3	80.8	166.1	33.4	0	0	0	0	109.6	E535 S539	E535-T537 VanDerWaalsContact C-N 3.3Å; E535-T537 HydrophobicContact CG-CG2 4.32Å; E535-T537 PolarHBondContact O-N 2.85Å; E535-T537 VanDerWaalsContact O-N 3.07Å; T537-S539 PolarHBondContact O-N 3.17Å
538	Y	34.2	Very low	29.8	Very low	107 Å²	107	93 Å²	93	42%	0.42	52%	0.516	S	S	.	.			trans	-82.2	86.4	164.1	-73.6	-78.8	0	0	0	109.1	I366 L536	I366-Y538 WeakPolarHBondContact O-CD1 3.36Å; L536-Y538 VanDerWaalsContact C-N 3.26Å; L536-Y538 HydrophobicContact CB-CD2 3.92Å; L536-Y538 HydrophobicContact CB-CE2 3.84Å; L536-Y538 HydrophobicContact CD1-CE2 4.11Å; L536-Y538 HydrophobicContact CD2-CD2 4.46Å; L536-Y538 HydrophobicContact CD2-CE2 3.66Å; L536-Y538 HydrophobicContact CG-CE2 4.07Å; L536-Y538 PolarHBondContact O-N 2.93Å
539	S	29.8	Very low	29.6	Very low	26 Å²	26	89.9 Å²	89.9	18%	0.182	51%	0.51	C	S	.	.	B	Isolated β-bridge	trans	-93.5	147.1	175.9	35.6	0	0	0	0	109.8	T537 W541	T537-S539 PolarHBondContact O-N 3.17Å; S539-W541 PolarHBondContact O-N 2.98Å; S539-W541 VanDerWaalsContact OG-CG 3.32Å; S539-W541 PolarHBondContact OG-NE1 3.22Å
540	S	35	Very low	29.8	Very low	9 Å²	9	92.2 Å²	92.2	6%	0.063	50%	0.504	C	S	.	.	G	3₁₀ helix	trans	-64.8	17	172.7	-172.5	0	0	0	0	113.4	S479 E542 L543	S479-S540 WeakPolarHBondContact O-CB 3.46Å; S479-S540 PolarHBondContact O-N 2.75Å; S540-E542 VanDerWaalsContact C-N 3.32Å; S540-E542 PolarHBondContact O-N 3.04Å; S540-L543 PolarHBondContact O-N 2.88Å
541	W	32.7	Very low	30	Very low	94 Å²	94	94.1 Å²	94.1	36%	0.356	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-52.4	-53	-176.2	-57.6	143.3	0	0	0	109.6	T478 I480 M491 V514 S539 L543 W545	T478-W541 HydrophobicContact CG2-CE3 4Å; T478-W541 HydrophobicContact CG2-CH2 3.77Å; T478-W541 HydrophobicContact CG2-CZ3 3.47Å; T478-W541 VanDerWaalsContact CG2-CZ3 3.47Å; I480-W541 HydrophobicContact CD1-CH2 4.43Å; I480-W541 HydrophobicContact CD1-CZ2 4.11Å; M491-W541 HydrophobicContact CE-CH2 3.1Å; M491-W541 HydrophobicContact CE-CZ2 4.28Å; M491-W541 HydrophobicContact CE-CZ3 3.47Å; M491-W541 VanDerWaalsContact CE-CZ3 3.47Å; M491-W541 HydrophobicContact CG-CH2 4.3Å; M491-W541 HydrophobicContact CG-CZ3 3.72Å; M491-W541 HydrophobicContact SD-CH2 3.41Å; M491-W541 WeakPolarHBondContact SD-CH2 3.19Å; M491-W541 HydrophobicContact SD-CZ3 3.38Å; M491-W541 WeakPolarHBondContact SD-CZ3 3.47Å; V514-W541 HydrophobicContact CG2-CE3 4.39Å; V514-W541 HydrophobicContact CG2-CZ3 4.37Å; S539-W541 PolarHBondContact O-N 2.98Å; S539-W541 VanDerWaalsContact OG-CG 3.32Å; S539-W541 PolarHBondContact OG-NE1 3.22Å; W541-L543 PolarHBondContact O-N 3.09Å; W541-W545 VanDerWaalsContact C-CD1 3.47Å; W541-W545 VanDerWaalsContact C-NE1 3.32Å; W541-W545 PolarHBondContact O-NE1 3.02Å
542	E	34.2	Very low	30.1	Very low	67 Å²	67	94.5 Å²	94.5	31%	0.313	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-65.3	-5.6	-171.6	-68.6	-173.5	175	0	0	115.8	S386 K388 S540	S386-E542 WeakPolarHBondContact CB-OE2 3.16Å; S386-E542 PolarHBondContact OG-OE2 3.14Å; K388-E542 VanDerWaalsContact CB-OE2 3.27Å; K388-E542 WeakPolarHBondContact CB-OE2 3.49Å; K388-E542 WeakPolarHBondContact CD-OE1 3.48Å; K388-E542 VanDerWaalsContact CD-OE2 3.24Å; K388-E542 WeakPolarHBondContact CD-OE2 3.48Å; K388-E542 WeakPolarHBondContact CE-OE1 3.19Å; K388-E542 IonicContact NZ-OE1 2.67Å; K388-E542 PolarHBondContact NZ-OE1 2.73Å; S540-E542 VanDerWaalsContact C-N 3.32Å; S540-E542 PolarHBondContact O-N 3.04Å
543	L	34.7	Very low	30.3	Very low	16 Å²	16	97.3 Å²	97.3	8%	0.084	49%	0.491	C	S	.	.	G	3₁₀ helix	trans	-102.3	-25.7	-170.2	-98.5	157.2	0	0	0	116.1	L368 L384 S540 W541 W545	L368-L543 WeakPolarHBondContact O-CD1 3.2Å; L384-L543 HydrophobicContact CB-CD2 4.29Å; L384-L543 HydrophobicContact CD2-CD2 4.34Å; L384-L543 HydrophobicContact CG-CD2 3.77Å; L384-L543 WeakPolarHBondContact O-CD2 3.33Å; S540-L543 PolarHBondContact O-N 2.88Å; W541-L543 PolarHBondContact O-N 3.09Å; L543-W545 PolarHBondContact O-N 2.72Å
544	H	34.6	Very low	30.5	Very low	90 Å²	90	96.9 Å²	96.9	42%	0.417	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-8.4	168.9	-107	135.2	0	0	0	112.1	F512 Y546	F512-H544 WeakPolarHBondContact CE1-O 3.49Å; F512-H544 HydrophobicContact CZ-CB 3.97Å; F512-H544 WeakPolarHBondContact CZ-O 3.34Å; H544-Y546 PolarHBondContact O-N 2.98Å; H544-Y546 VanDerWaalsContact O-N 3.14Å
545	W	36.3	Very low	30.5	Very low	60 Å²	60	100.1 Å²	100.1	23%	0.227	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-8.8	-173	-71.7	70.6	0	0	0	115.6	F512 W541 L543	F512-W545 WeakPolarHBondContact O-CH2 3.24Å; F512-W545 WeakPolarHBondContact O-CZ2 3.24Å; F512-W545 WeakPolarHBondContact O-CZ3 3.27Å; W541-W545 VanDerWaalsContact C-CD1 3.47Å; W541-W545 VanDerWaalsContact C-NE1 3.32Å; W541-W545 PolarHBondContact O-NE1 3.02Å; L543-W545 PolarHBondContact O-N 2.72Å
546	Y	32.7	Very low	30.6	Very low	63 Å²	63	99.6 Å²	99.6	25%	0.247	48%	0.484	C	S	.	.			trans	-134.1	74.6	-170.6	-70.2	-87.9	0	0	0	112.2	T441 P443 H544	T441-Y546 WeakPolarHBondContact O-CE2 3.22Å; T441-Y546 VanDerWaalsContact O-CZ 3.27Å; T441-Y546 PolarHBondContact O-OH 3.35Å; P443-Y546 HydrophobicContact CB-CD2 4.48Å; P443-Y546 HydrophobicContact CB-CG 4.45Å; P443-Y546 HydrophobicContact CG-CD1 3.51Å; P443-Y546 HydrophobicContact CG-CD2 3.29Å; P443-Y546 HydrophobicContact CG-CE1 4.05Å; P443-Y546 HydrophobicContact CG-CE2 3.83Å; P443-Y546 HydrophobicContact CG-CG 3.08Å; H544-Y546 PolarHBondContact O-N 2.98Å; H544-Y546 VanDerWaalsContact O-N 3.14Å
547	A	28.8	Very low	30.5	Very low	61 Å²	61	101.6 Å²	101.6	50%	0.504	50%	0.495	S	S	.	.			trans	-69.3	125	149	0	0	0	0	0	108	A464 N549	A464-A547 HydrophobicContact CB-CB 3.99Å; A547-N549 PolarHBondContact O-N 3.12Å
548	L	31.6	Very low	30.6	Very low	66 Å²	66	102.9 Å²	102.9	35%	0.346	51%	0.506	S	S	.	.			trans	-63.7	126.2	-165.3	-78	140.9	0	0	0	113	S466 L550	S466-L548 VanDerWaalsContact CB-O 3.24Å; S466-L548 WeakPolarHBondContact CB-O 3.43Å; L548-L550 VanDerWaalsContact C-N 3.28Å; L548-L550 HydrophobicContact CB-CD1 4.1Å; L548-L550 HydrophobicContact CB-CG 4.24Å; L548-L550 HydrophobicContact CD1-CD1 4.24Å; L548-L550 HydrophobicContact CD2-CD1 3.83Å; L548-L550 HydrophobicContact CD2-CG 4.06Å; L548-L550 HydrophobicContact CG-CD1 4.28Å; L548-L550 PolarHBondContact O-N 3.03Å
549	N	26.8	Very low	30.2	Very low	152 Å²	152	104.3 Å²	104.3	81%	0.813	53%	0.526	S	S	*	.			trans	-84.3	77.5	157	-152.9	7.5	0	0	0	107.7	A547	A547-N549 PolarHBondContact O-N 3.12Å
550	L	32.5	Very low	29.9	Very low	120 Å²	120	108.5 Å²	108.5	63%	0.628	56%	0.556	S	S	*	*			trans	-96.9	109.3	168.5	-86.7	163.4	0	0	0	107.5	L548	L548-L550 VanDerWaalsContact C-N 3.28Å; L548-L550 HydrophobicContact CB-CD1 4.1Å; L548-L550 HydrophobicContact CB-CG 4.24Å; L548-L550 HydrophobicContact CD1-CD1 4.24Å; L548-L550 HydrophobicContact CD2-CD1 3.83Å; L548-L550 HydrophobicContact CD2-CG 4.06Å; L548-L550 HydrophobicContact CG-CD1 4.28Å; L548-L550 PolarHBondContact O-N 3.03Å
551	E	31.1	Very low	29.5	Very low	163 Å²	163	114.6 Å²	114.6	76%	0.762	59%	0.593	S	S	*	*			trans	-86.5	140.9	-178.6	-145.2	-177.1	-150.8	0	0	110.6
552	K	30.5	Very low	29.2	Very low	163 Å²	163	122.7 Å²	122.7	71%	0.709	63%	0.634	S	S	*	*	S	Bend	trans	98.5	105	159.8	-61.8	-171	-178.1	177.8	0	119.4
553	H	26.5	Very low	29	Very low	169 Å²	169	125.5 Å²	125.5	78%	0.782	65%	0.65	S	S	*	*			trans	74.7	88.6	151.5	-55.7	-63.9	0	0	0	118.3
554	T	28.4	Very low	28.7	Very low	118 Å²	118	131.2 Å²	131.2	72%	0.724	68%	0.68	S	S	*	*			trans	-175.3	141	132.2	21.5	0	0	0	0	109.6
555	K	23.4	Very low	28.4	Very low	194 Å²	194	133.5 Å²	133.5	84%	0.843	69%	0.694	S	S	*	*			trans	-110.9	120.2	-169.8	-176	-173.7	-175.1	-172.9	0	107.9
556	W	26.2	Very low	27.9	Very low	141 Å²	141	137.8 Å²	137.8	53%	0.534	72%	0.722	S	S	.	*			trans	-147	136.3	175.5	-52.8	98.4	0	0	0	110.9	E331 W465	E331-W556 VanDerWaalsContact CD-CH2 3.41Å; E331-W556 HydrophobicContact CG-CH2 3.94Å; E331-W556 HydrophobicContact CG-CZ2 4.44Å; E331-W556 WeakPolarHBondContact OE1-CH2 3.39Å; E331-W556 WeakPolarHBondContact OE1-CZ3 3.4Å; W465-W556 HydrophobicContact CH2-CB 3.89Å; W465-W556 HydrophobicContact CH2-CG 4.46Å
557	D	24.4	Very low	27.6	Very low	157 Å²	157	142.5 Å²	142.5	84%	0.84	75%	0.751	S	S	*	*			trans	-99.1	136.1	178.9	-84.4	-41.4	0	0	0	110.6
558	C	27.6	Very low	27.5	Very low	124 Å²	124	147.9 Å²	147.9	84%	0.838	77%	0.768	S	S	*	*			trans	-110.3	111.6	162.6	-80.3	0	0	0	0	109.5
559	T	25.9	Very low	27.2	Very low	137 Å²	137	153.8 Å²	153.8	84%	0.84	80%	0.798	S	S	*	*			trans	-70.5	129.5	164.6	37.5	0	0	0	0	110.7
560	S	23.6	Very low	27.3	Very low	114 Å²	114	153.9 Å²	153.9	80%	0.797	80%	0.797	S	S	*	*			trans	-71.2	140.2	172.4	65.2	0	0	0	0	111.8
561	T	27.7	Very low	26.8	Very low	137 Å²	137	156.8 Å²	156.8	84%	0.84	81%	0.811	S	S	*	*			trans	-128	118.8	155.4	43.9	0	0	0	0	108.5
562	H	26.9	Very low	26.5	Very low	264 Å²	264	156.2 Å²	156.2	100%	1.222	82%	0.815	S	S	*	*			trans	13.3	0	157	-92.3	-73.6	0	0	0	120.7

Retrieved 562 of 562 residues in 297.9 ms (Link to these results)

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