A0A087Y0R8_POEFO Loading...

Matrix AAA peptidase interacting protein 1

AlphaFold DB , UniProt , Accession A0A087Y0R8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 241 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.8	Very low	32.5	Very low	236 Å²	236	173.8 Å²	173.8	100%	1.163	85%	0.854	S	S	*	*				0	126	0	-75.3	-175.1	-71.8	0	0	107.7
2	V	32.3	Very low	32.8	Very low	125 Å²	125	173 Å²	173	76%	0.758	85%	0.854	S	S	*	*			cis	-152.6	108.5	-14.3	167.1	0	0	0	0	102.8
3	S	28.6	Very low	32.5	Very low	102 Å²	102	168.2 Å²	168.2	71%	0.713	84%	0.844	S	S	*	*				58.5	123.9	95.9	-64.2	0	0	0	0	117.2
4	L	32.2	Very low	32.5	Very low	143 Å²	143	164.9 Å²	164.9	75%	0.749	84%	0.844	S	S	*	*			trans	72.5	108.3	146.3	-62.2	161.9	0	0	0	120.5
5	L	35.8	Very low	32.6	Very low	183 Å²	183	160 Å²	160	96%	0.958	83%	0.831	S	S	*	*				-138.6	104.8	125.2	-81.6	-175.1	0	0	0	110.5
6	F	32.4	Very low	32.3	Very low	186 Å²	186	163 Å²	163	82%	0.816	84%	0.836	S	S	*	*			trans	-104.4	123.7	165.5	-102.7	-86.8	0	0	0	109.1
7	R	30.5	Very low	32.1	Very low	233 Å²	233	161.4 Å²	161.4	88%	0.879	84%	0.835	S	S	*	*			trans	-147.7	99.9	151.1	-85.9	-167.6	176.2	-165.2	-1.6	107.3
8	C	30	Very low	32	Very low	117 Å²	117	161.3 Å²	161.3	79%	0.791	84%	0.836	S	S	*	*				72.9	88.5	90.9	-69.4	0	0	0	0	113.5
9	Y	33	Very low	31.6	Very low	223 Å²	223	156.7 Å²	156.7	88%	0.875	82%	0.823	S	S	*	*			trans	-114.6	140.6	149.5	-80	-81.7	0	0	0	108.6
10	P	32.7	Very low	31.5	Very low	116 Å²	116	159.5 Å²	159.5	75%	0.753	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-73.6	148.9	-173.1	29.5	-34.7	0	0	0	112.5	L12	P10-L12 PolarHBondContact O-N 3.36Å
11	R	37.2	Very low	31.2	Very low	248 Å²	248	161.8 Å²	161.8	94%	0.936	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-66.4	120.8	172	-68.8	174.9	173.8	156.6	-4	109.9
12	L	36	Very low	31	Very low	164 Å²	164	156.3 Å²	156.3	86%	0.859	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-82.7	133.1	162.6	-81.4	159.7	0	0	0	109.2	P10	P10-L12 PolarHBondContact O-N 3.36Å
13	P	29.1	Very low	30.7	Very low	111 Å²	111	157.6 Å²	157.6	72%	0.721	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-72.5	130.3	173.3	29.4	-32.5	0	0	0	110.4	S15	P13-S15 PolarHBondContact O-N 3.45Å
14	S	32.2	Very low	30.7	Very low	121 Å²	121	158 Å²	158	85%	0.846	80%	0.802	S	S	*	*			trans	-82.9	93	178.9	54.7	0	0	0	0	111.4
15	S	34.7	Very low	30.8	Very low	92 Å²	92	158.1 Å²	158.1	64%	0.643	80%	0.799	S	S	*	*			trans	-138.4	76.4	170.1	62.6	0	0	0	0	111.1	P13 T17	P13-S15 PolarHBondContact O-N 3.45Å; S15-T17 PolarHBondContact O-N 3.23Å
16	F	28	Very low	30.4	Very low	208 Å²	208	155.8 Å²	155.8	91%	0.912	79%	0.787	S	S	*	*			trans	-94.6	80.7	170.7	-78.4	-75.5	0	0	0	110.5	L18	F16-L18 PolarHBondContact O-N 3.27Å; F16-L18 VanDerWaalsContact O-N 3.15Å
17	T	29.3	Very low	30.1	Very low	135 Å²	135	154.4 Å²	154.4	83%	0.828	79%	0.788	S	S	*	*			trans	-74.9	97	167.1	-50.3	0	0	0	0	108.5	S15 A19	S15-T17 PolarHBondContact O-N 3.23Å; T17-A19 PolarHBondContact O-N 3.48Å; T17-A19 VanDerWaalsContact O-N 3.15Å
18	L	29.3	Very low	30	Very low	161 Å²	161	149.1 Å²	149.1	84%	0.843	78%	0.781	S	S	*	*			trans	-77.3	103.7	179.7	-160.2	140.1	0	0	0	109.7	F16 R20	F16-L18 PolarHBondContact O-N 3.27Å; F16-L18 VanDerWaalsContact O-N 3.15Å; L18-R20 PolarHBondContact O-N 2.8Å
19	A	25	Very low	29.8	Very low	73 Å²	73	154.4 Å²	154.4	60%	0.603	78%	0.784	S	S	*	*			trans	-60.9	123.8	-177	0	0	0	0	0	111.4	T17 F21	T17-A19 PolarHBondContact O-N 3.48Å; T17-A19 VanDerWaalsContact O-N 3.15Å; A19-F21 PolarHBondContact O-N 3.31Å
20	R	30.1	Very low	29.6	Very low	212 Å²	212	148.3 Å²	148.3	80%	0.8	77%	0.774	S	S	*	*			trans	-71	113.9	168.9	-71.1	-177.7	177.3	-173.9	-1.3	108.6	L18 V22	L18-R20 PolarHBondContact O-N 2.8Å; R20-V22 PolarHBondContact O-N 3.1Å
21	F	24.4	Very low	29.5	Very low	208 Å²	208	151.2 Å²	151.2	91%	0.912	78%	0.778	S	S	*	*			trans	-71.8	111.2	165.1	-91.3	-92.7	0	0	0	109.3	A19	A19-F21 PolarHBondContact O-N 3.31Å
22	V	28.3	Very low	29	Very low	122 Å²	122	150.5 Å²	150.5	74%	0.739	78%	0.775	S	S	*	*			trans	-116.5	110	165.8	179.6	0	0	0	0	106.5	R20	R20-V22 PolarHBondContact O-N 3.1Å
23	L	26.6	Very low	28.5	Very low	152 Å²	152	148.1 Å²	148.1	80%	0.796	77%	0.771	S	S	*	*			trans	-91.3	116.7	172.4	-167.2	78.1	0	0	0	107.3
24	N	28.7	Very low	28.4	Very low	109 Å²	109	148.7 Å²	148.7	58%	0.583	78%	0.776	S	S	*	*			trans	-128.4	131.2	178.2	-171.6	-4.8	0	0	0	108
25	Q	33	Very low	28.2	Very low	146 Å²	146	150.6 Å²	150.6	68%	0.682	78%	0.776	S	S	*	*			trans	-132.4	109.9	178.3	-69.2	-164.6	15.7	0	0	111.4
26	N	27.6	Very low	27.9	Very low	134 Å²	134	153.4 Å²	153.4	72%	0.717	79%	0.789	S	S	*	*			trans	-68.2	149.5	172.3	-47.9	-84.4	0	0	0	111.4
27	L	27.3	Very low	28	Very low	157 Å²	157	154.7 Å²	154.7	82%	0.822	79%	0.788	S	S	*	*				-177.5	113	115.7	-114.8	95.3	0	0	0	114.5
28	V	27.1	Very low	28.2	Very low	122 Å²	122	152.7 Å²	152.7	74%	0.739	79%	0.785	S	S	*	*				71.9	126.2	124.5	174	0	0	0	0	122.4
29	R	26.5	Very low	28.3	Very low	229 Å²	229	148.8 Å²	148.8	86%	0.864	78%	0.784	S	S	*	*			trans	90.7	95.7	148.2	-94.7	176.4	160.2	166.5	-5.1	122.1
30	S	29.7	Very low	28.8	Very low	95 Å²	95	152.8 Å²	152.8	66%	0.664	80%	0.795	S	S	*	*				62.5	107.8	100.8	172.3	0	0	0	0	121.5
31	Q	28.8	Very low	29.2	Very low	176 Å²	176	151 Å²	151	82%	0.822	80%	0.8	S	S	*	*				170.4	123.9	123.7	-93.9	162.5	22.2	0	0	109.5
32	R	26.9	Very low	30	Very low	233 Å²	233	146.6 Å²	146.6	88%	0.879	79%	0.793	S	S	*	*				37.2	124.9	87.6	-69.5	-170.2	-175.6	-172.1	2.3	113.4
33	C	25.5	Very low	30.7	Very low	115 Å²	115	145.9 Å²	145.9	78%	0.777	80%	0.8	S	S	*	*			cis	-162.2	-175.9	3.7	-82.5	0	0	0	0	106.5
34	C	27.7	Very low	31.1	Very low	123 Å²	123	149.8 Å²	149.8	83%	0.831	80%	0.804	S	S	*	*			cis	-157.3	-171.1	8.8	-144.9	0	0	0	0	111.5
35	L	28.5	Very low	31.8	Very low	160 Å²	160	156.6 Å²	156.6	84%	0.838	82%	0.821	S	S	*	*			trans	-79.3	145.5	171.3	-74.9	156.6	0	0	0	113.6
36	V	28.5	Very low	31.9	Very low	151 Å²	151	155.5 Å²	155.5	92%	0.915	83%	0.825	S	S	*	*			trans	-134.7	149.4	152.9	-179.8	0	0	0	0	109.4
37	R	29.8	Very low	32.3	Very low	235 Å²	235	160.3 Å²	160.3	89%	0.887	84%	0.835	S	S	*	*			trans	-119.6	133.3	-160.6	-176.1	-178	-174	177.8	2.6	112.2
38	A	34.1	Very low	32.9	Very low	94 Å²	94	157.9 Å²	157.9	78%	0.777	83%	0.831	S	S	*	*			trans	22.6	134.7	155.7	0	0	0	0	0	121.9
39	G	30.2	Very low	33.5	Very low	79 Å²	79	156.4 Å²	156.4	81%	0.814	83%	0.826	S	S	*	*			trans	-135.5	129.2	155.6	0	0	0	0	0	111
40	N	36	Very low	33.9	Very low	157 Å²	157	154.7 Å²	154.7	84%	0.84	83%	0.828	S	S	*	*			trans	-89.9	140.8	-178.3	-71.7	-28.1	0	0	0	112
41	L	38.8	Very low	34.2	Very low	173 Å²	173	159.6 Å²	159.6	91%	0.906	83%	0.832	S	S	*	*			trans	-140.6	156.2	158.4	-81.1	-178.2	0	0	0	111.4
42	P	40.4	Very low	34.6	Very low	117 Å²	117	158.3 Å²	158.3	76%	0.76	83%	0.831	S	S	*	*			trans	-92.7	159.1	-148.6	34.9	-37.5	0	0	0	116.3
43	A	42.5	Very low	35.1	Very low	107 Å²	107	153.2 Å²	153.2	88%	0.884	82%	0.817	S	S	*	*			trans	-68.5	129	-178.2	0	0	0	0	0	113.6
44	R	35.7	Very low	35.7	Very low	233 Å²	233	156.5 Å²	156.5	88%	0.879	82%	0.82	S	S	*	*			trans	-118.5	117.2	169.3	-154.3	175.8	-172.6	-168.9	1.2	108.4	T46	R44-T46 PolarHBondContact O-N 3.01Å
45	R	43.1	Very low	36.5	Very low	252 Å²	252	156.4 Å²	156.4	95%	0.951	81%	0.807	S	S	*	*			trans	-75.3	123.6	177.5	-68.2	-178.8	-176.1	170.1	1.5	109.4
46	T	34.2	Very low	36.9	Very low	123 Å²	123	154.7 Å²	154.7	76%	0.755	81%	0.806	S	S	*	*			trans	-123.1	117.8	171.1	-46.2	0	0	0	0	108.3	R44	R44-T46 PolarHBondContact O-N 3.01Å
47	Y	37.5	Very low	37.8	Very low	235 Å²	235	153.1 Å²	153.1	92%	0.922	79%	0.786	S	S	*	*			trans	-79.7	123.2	174.3	-160	-96	0	0	0	107.9
48	S	39.1	Very low	38.6	Very low	107 Å²	107	145.6 Å²	145.6	75%	0.748	77%	0.768	S	S	*	*			trans	-136.9	130.9	176.1	-159.7	0	0	0	0	108.8
49	S	39.4	Very low	38.9	Very low	90 Å²	90	150.5 Å²	150.5	63%	0.629	77%	0.772	S	S	*	*			trans	-70	134.1	-177.8	45.3	0	0	0	0	111.3	R51	S49-R51 PolarHBondContact O-N 3.32Å; S49-R51 VanDerWaalsContact O-N 3.07Å
50	E	35.6	Very low	39.9	Very low	193 Å²	193	150.4 Å²	150.4	90%	0.902	76%	0.755	S	S	*	*			trans	-59	113.5	167.9	-78	169.2	121.2	0	0	109.5
51	R	36.2	Very low	40.2	Very low	199 Å²	199	148.5 Å²	148.5	75%	0.751	75%	0.749	S	S	*	*			trans	-105.4	121.4	152.5	-82.7	-174.9	-81.8	-165.2	-4.8	105.9	S49 Q53	S49-R51 PolarHBondContact O-N 3.32Å; S49-R51 VanDerWaalsContact O-N 3.07Å; R51-Q53 PolarHBondContact O-N 3.45Å
52	D	37.9	Very low	40.6	Very low	149 Å²	149	144.5 Å²	144.5	80%	0.797	73%	0.732	S	S	*	*			trans	-60.8	83.9	172.5	-81.7	-53	0	0	0	110.8	H54	D52-H54 PolarHBondContact O-N 2.6Å; D52-H54 VanDerWaalsContact O-N 3.09Å
53	Q	35.5	Very low	40.5	Very low	126 Å²	126	145.5 Å²	145.5	59%	0.589	74%	0.735	S	S	*	*			trans	-79.4	91.9	168.6	-65.3	-167.5	27.6	0	0	107.7	R51 H55	R51-Q53 PolarHBondContact O-N 3.45Å; Q53-H55 WeakPolarHBondContact CB-NE2 3.31Å; Q53-H55 PolarHBondContact O-CD2 3.35Å; Q53-H55 PolarHBondContact O-N 2.71Å; Q53-H55 PolarHBondContact OE1-CE1 2.72Å; Q53-H55 PolarHBondContact OE1-NE2 3.15Å
54	H	38.5	Very low	40.9	Very low	183 Å²	183	142.8 Å²	142.8	85%	0.847	72%	0.718	S	S	*	*			trans	-63	80.2	163.4	-96.3	64.9	0	0	0	109.3	D52	D52-H54 PolarHBondContact O-N 2.6Å; D52-H54 VanDerWaalsContact O-N 3.09Å
55	H	44.1	Very low	41.6	Very low	122 Å²	122	139.4 Å²	139.4	57%	0.565	72%	0.715	S	S	*	*			trans	-67.8	129.8	177	-67.5	-75.8	0	0	0	109.8	Q53 K57	Q53-H55 WeakPolarHBondContact CB-NE2 3.31Å; Q53-H55 PolarHBondContact O-CD2 3.35Å; Q53-H55 PolarHBondContact O-N 2.71Å; Q53-H55 PolarHBondContact OE1-CE1 2.72Å; Q53-H55 PolarHBondContact OE1-NE2 3.15Å; H55-K57 PolarHBondContact O-N 3.15Å; H55-K57 VanDerWaalsContact O-N 3.15Å
56	P	38.8	Very low	42.5	Very low	124 Å²	124	131.7 Å²	131.7	81%	0.805	70%	0.698	S	S	*	*			trans	-67.3	115.7	177.5	26.4	-32.7	0	0	0	110
57	K	47.3	Very low	44.4	Very low	117 Å²	117	129.9 Å²	129.9	51%	0.509	68%	0.684	S	S	.	*			trans	-57.8	135.8	174.9	-63.4	-173	178.5	-170	0	110.1	H55 K59 E149	H55-K57 PolarHBondContact O-N 3.15Å; H55-K57 VanDerWaalsContact O-N 3.15Å; K57-K59 PolarHBondContact O-N 3.21Å; K57-K59 VanDerWaalsContact O-N 3.09Å; K57-E149 VanDerWaalsContact NZ-CA 3.34Å; K57-E149 PolarHBondContact NZ-O 3.15Å
58	P	45.2	Very low	46.3	Very low	78 Å²	78	122.7 Å²	122.7	51%	0.506	67%	0.666	S	S	.	*			trans	-63.7	113.3	-178.1	24.9	-33.4	0	0	0	110.8	V60	P58-V60 PolarHBondContact O-N 3.28Å
59	K	41.3	Very low	48.3	Very low	196 Å²	196	125.3 Å²	125.3	85%	0.852	66%	0.664	S	S	*	*			trans	-79.2	98.5	178.7	-67.6	-176.1	179.6	-179.4	0	110.1	K57 V61	K57-K59 PolarHBondContact O-N 3.21Å; K57-K59 VanDerWaalsContact O-N 3.09Å; K59-V61 PolarHBondContact O-N 2.64Å
60	V	50.1	Low	50.1	Low	77 Å²	77	124.5 Å²	124.5	47%	0.467	65%	0.652	S	S	.	*			trans	-72.3	111.7	171.6	-178	0	0	0	0	109.2	P58 V62	P58-V60 PolarHBondContact O-N 3.28Å; V60-V62 PolarHBondContact O-N 3.47Å
61	V	42.5	Very low	52.4	Low	118 Å²	118	123.3 Å²	123.3	72%	0.715	64%	0.639	S	S	*	*			trans	-82.5	104.6	176.2	-176	0	0	0	0	109.3	K59 V63	K59-V61 PolarHBondContact O-N 2.64Å; V61-V63 HydrophobicContact CG1-CG2 3.83Å; V61-V63 PolarHBondContact O-N 2.81Å; V61-V63 VanDerWaalsContact O-N 3.14Å
62	V	46.8	Very low	54.7	Low	89 Å²	89	119.8 Å²	119.8	54%	0.539	63%	0.63	S	S	.	*			trans	-77.3	96.2	170.9	-178.9	0	0	0	0	108.7	V60 G64 Y153	V60-V62 PolarHBondContact O-N 3.47Å; V62-G64 VanDerWaalsContact C-N 3.26Å; V62-G64 PolarHBondContact O-N 3.34Å; V62-Y153 HydrophobicContact CG2-CD1 4.4Å
63	V	38.6	Very low	57.2	Low	137 Å²	137	117 Å²	117	83%	0.83	61%	0.608	S	S	*	*			trans	-80.3	76	174.2	-170.6	0	0	0	0	109.7	V61	V61-V63 HydrophobicContact CG1-CG2 3.83Å; V61-V63 PolarHBondContact O-N 2.81Å; V61-V63 VanDerWaalsContact O-N 3.14Å
64	G	51.6	Low	59.6	Low	50 Å²	50	111.6 Å²	111.6	52%	0.515	58%	0.584	S	S	.	*			trans	-113.5	127.5	160.5	0	0	0	0	0	108.4	V62 P66	V62-G64 VanDerWaalsContact C-N 3.26Å; V62-G64 PolarHBondContact O-N 3.34Å; G64-P66 WeakPolarHBondContact O-CD 3.46Å
65	I	50.8	Low	62.1	Low	162 Å²	162	109.4 Å²	109.4	83%	0.831	57%	0.568	S	S	*	*			trans	-67.5	115.1	172.1	-60.1	175.6	0	0	0	106.8	N67	I65-N67 PolarHBondContact O-N 3.02Å
66	P	61	Low	64.4	Low	91 Å²	91	107.1 Å²	107.1	59%	0.591	56%	0.559	S	S	*	*			trans	-62.7	134.1	178	-17.9	31.9	0	0	0	108.5	G64 P68	G64-P66 WeakPolarHBondContact O-CD 3.46Å; P66-P68 VanDerWaalsContact O-CD 3.26Å; P66-P68 WeakPolarHBondContact O-CD 3.44Å
67	N	74.4	Confident	67	Low	84 Å²	84	104.6 Å²	104.6	45%	0.449	53%	0.534	S	S	.	.			trans	-59.8	115.3	174	178.3	-21.5	0	0	0	108	I65 F69 I70 W71	I65-N67 PolarHBondContact O-N 3.02Å; N67-F69 PolarHBondContact O-N 2.98Å; N67-F69 WeakPolarHBondContact OD1-CB 3.37Å; N67-F69 WeakPolarHBondContact OD1-CD2 3.35Å; N67-F69 PolarHBondContact OD1-N 2.92Å; N67-F69 VanDerWaalsContact OD1-N 3.09Å; N67-I70 HydrophobicContact CB-CB 4.21Å; N67-I70 HydrophobicContact CB-CG1 3.91Å; N67-I70 PolarHBondContact O-N 2.89Å; N67-W71 PolarHBondContact O-N 2.98Å
68	P	77.1	Confident	69.2	Low	84 Å²	84	100 Å²	100	55%	0.545	51%	0.513	S	S	.	.	H	α-helix	trans	-64.1	-28.4	-170.3	24.9	-34.3	0	0	0	112.2	P66 F72	P66-P68 VanDerWaalsContact O-CD 3.26Å; P66-P68 WeakPolarHBondContact O-CD 3.44Å; P68-F72 VanDerWaalsContact O-CB 3.23Å; P68-F72 WeakPolarHBondContact O-CB 3.08Å; P68-F72 PolarHBondContact O-N 3.44Å
69	F	81.7	Confident	71.5	Confident	163 Å²	163	102.5 Å²	102.5	72%	0.715	52%	0.517	S	S	*	.	H	α-helix	trans	-67	-41.4	174.5	-62.7	-76.7	0	0	0	112	N67 R73	N67-F69 PolarHBondContact O-N 2.98Å; N67-F69 WeakPolarHBondContact OD1-CB 3.37Å; N67-F69 WeakPolarHBondContact OD1-CD2 3.35Å; N67-F69 PolarHBondContact OD1-N 2.92Å; N67-F69 VanDerWaalsContact OD1-N 3.09Å; F69-R73 WeakPolarHBondContact O-CB 3.26Å; F69-R73 PolarHBondContact O-N 2.97Å
70	I	78.1	Confident	74.1	Confident	72 Å²	72	95.7 Å²	95.7	37%	0.369	49%	0.49	S	S	.	.	H	α-helix	trans	-68.3	-46.9	177.1	-59	-61.2	0	0	0	109.8	N67 F72 R73 T74	N67-I70 HydrophobicContact CB-CB 4.21Å; N67-I70 HydrophobicContact CB-CG1 3.91Å; N67-I70 PolarHBondContact O-N 2.89Å; I70-F72 PolarHBondContact O-N 3.32Å; I70-R73 PolarHBondContact O-N 3.34Å; I70-T74 WeakPolarHBondContact O-CB 3.35Å; I70-T74 PolarHBondContact O-N 3.26Å; I70-T74 PolarHBondContact O-OG1 3.24Å
71	W	82.2	Confident	76.2	Confident	168 Å²	168	92 Å²	92	64%	0.636	47%	0.467	S	S	*	.	H	α-helix	trans	-56.5	-48.3	176.7	177.5	85.5	0	0	0	112.4	N67 T74 R75	N67-W71 PolarHBondContact O-N 2.98Å; W71-T74 PolarHBondContact O-N 3.3Å; W71-R75 PolarHBondContact O-N 3.41Å
72	F	86.2	Confident	78.7	Confident	125 Å²	125	93.5 Å²	93.5	55%	0.548	46%	0.46	S	S	.	.	H	α-helix	trans	-65.2	-44.4	178.9	-179.9	-107.5	0	0	0	112.2	P68 I70 T74 R75 I76	P68-F72 VanDerWaalsContact O-CB 3.23Å; P68-F72 WeakPolarHBondContact O-CB 3.08Å; P68-F72 PolarHBondContact O-N 3.44Å; I70-F72 PolarHBondContact O-N 3.32Å; F72-T74 PolarHBondContact O-N 3.29Å; F72-R75 PolarHBondContact O-N 3.45Å; F72-I76 HydrophobicContact CD1-CD1 3.91Å; F72-I76 HydrophobicContact CE1-CD1 3.38Å; F72-I76 HydrophobicContact CE1-CG1 4.32Å; F72-I76 HydrophobicContact CE2-CD1 4.48Å; F72-I76 HydrophobicContact CZ-CD1 3.71Å; F72-I76 HydrophobicContact CZ-CG1 4.32Å; F72-I76 PolarHBondContact O-N 3.43Å
73	R	88.7	Confident	81	Confident	90 Å²	90	92.2 Å²	92.2	34%	0.34	45%	0.452	S	S	.	.	H	α-helix	trans	-57.3	-48.9	175.7	-177.2	-176.8	75.3	174.2	5.2	111.4	F69 I70 R75 I76 Y77 D158	F69-R73 WeakPolarHBondContact O-CB 3.26Å; F69-R73 PolarHBondContact O-N 2.97Å; I70-R73 PolarHBondContact O-N 3.34Å; R73-R75 VanDerWaalsContact C-N 3.28Å; R73-R75 PolarHBondContact O-N 2.68Å; R73-I76 WeakPolarHBondContact O-CB 3.47Å; R73-I76 PolarHBondContact O-N 3.45Å; R73-I76 VanDerWaalsContact O-N 3.17Å; R73-Y77 HydrophobicContact CG-CD2 3.91Å; R73-Y77 HydrophobicContact CG-CE2 3.59Å; R73-Y77 VanDerWaalsContact O-CD2 3.28Å; R73-Y77 WeakPolarHBondContact O-CD2 3.16Å; R73-Y77 PolarHBondContact O-N 3.14Å; R73-D158 IonicContact CZ-OD1 3.35Å; R73-D158 IonicContact CZ-OD2 2.84Å; R73-D158 IonicContact NE-OD1 3.92Å; R73-D158 IonicContact NH1-OD2 3.98Å; R73-D158 IonicContact NH2-OD1 3.06Å; R73-D158 PolarHBondContact NH2-OD1 2.72Å; R73-D158 IonicContact NH2-OD2 2.8Å; R73-D158 PolarHBondContact NH2-OD2 3.39Å
74	T	87.5	Confident	83.6	Confident	13 Å²	13	94.2 Å²	94.2	8%	0.08	45%	0.446	C	S	.	.	H	α-helix	trans	-60.8	-38.1	177.9	-59.3	0	0	0	0	111.3	I70 W71 F72 Y77 Y78 V159	I70-T74 WeakPolarHBondContact O-CB 3.35Å; I70-T74 PolarHBondContact O-N 3.26Å; I70-T74 PolarHBondContact O-OG1 3.24Å; W71-T74 PolarHBondContact O-N 3.3Å; F72-T74 PolarHBondContact O-N 3.29Å; T74-Y77 PolarHBondContact O-N 2.93Å; T74-Y78 HydrophobicContact CG2-CD2 4.5Å; T74-Y78 HydrophobicContact CG2-CE1 4.02Å; T74-Y78 HydrophobicContact CG2-CE2 3.66Å; T74-Y78 WeakPolarHBondContact CG2-OH 3.43Å; T74-Y78 WeakPolarHBondContact O-CD2 3.39Å; T74-Y78 PolarHBondContact O-N 2.93Å; T74-Y78 VanDerWaalsContact O-N 3.12Å; T74-V159 HydrophobicContact CG2-CG2 4.13Å
75	R	89.9	Confident	85.6	Confident	137 Å²	137	93.7 Å²	93.7	52%	0.517	43%	0.43	S	S	.	.	H	α-helix	trans	-66.5	-36.2	175.6	-166.1	56.9	170	152.1	-11.5	113.3	W71 F72 R73 F79	W71-R75 PolarHBondContact O-N 3.41Å; F72-R75 PolarHBondContact O-N 3.45Å; R73-R75 VanDerWaalsContact C-N 3.28Å; R73-R75 PolarHBondContact O-N 2.68Å; R75-F79 PolarHBondContact O-N 2.72Å
76	I	92.1	Very high	87.6	Confident	74 Å²	74	87.5 Å²	87.5	38%	0.379	40%	0.399	S	S	.	.	H	α-helix	trans	-62.4	-45.7	170.7	-70.8	172.2	0	0	0	110.4	F72 R73 Y78 F79 L80	F72-I76 HydrophobicContact CD1-CD1 3.91Å; F72-I76 HydrophobicContact CE1-CD1 3.38Å; F72-I76 HydrophobicContact CE1-CG1 4.32Å; F72-I76 HydrophobicContact CE2-CD1 4.48Å; F72-I76 HydrophobicContact CZ-CD1 3.71Å; F72-I76 HydrophobicContact CZ-CG1 4.32Å; F72-I76 PolarHBondContact O-N 3.43Å; R73-I76 WeakPolarHBondContact O-CB 3.47Å; R73-I76 PolarHBondContact O-N 3.45Å; R73-I76 VanDerWaalsContact O-N 3.17Å; I76-Y78 VanDerWaalsContact C-N 3.34Å; I76-Y78 PolarHBondContact O-N 3.44Å; I76-F79 CarbonylContact O-C 3.59Å; I76-F79 WeakPolarHBondContact O-CA 3.49Å; I76-F79 WeakPolarHBondContact O-CB 3.48Å; I76-F79 PolarHBondContact O-N 3.48Å; I76-L80 HydrophobicContact CG2-CD1 4Å; I76-L80 HydrophobicContact CG2-CG 4.17Å; I76-L80 WeakPolarHBondContact O-CG 3.46Å; I76-L80 PolarHBondContact O-N 2.81Å
77	Y	94.1	Very high	89.1	Confident	72 Å²	72	91.3 Å²	91.3	28%	0.282	41%	0.406	S	S	.	.	H	α-helix	trans	-60.1	-41.1	179.6	-81	-66.6	0	0	0	112.9	R73 T74 F79 L80 I81 V159 I161	R73-Y77 HydrophobicContact CG-CD2 3.91Å; R73-Y77 HydrophobicContact CG-CE2 3.59Å; R73-Y77 VanDerWaalsContact O-CD2 3.28Å; R73-Y77 WeakPolarHBondContact O-CD2 3.16Å; R73-Y77 PolarHBondContact O-N 3.14Å; T74-Y77 PolarHBondContact O-N 2.93Å; Y77-F79 VanDerWaalsContact C-N 3.29Å; Y77-F79 PolarHBondContact O-N 3.18Å; Y77-L80 HydrophobicContact CD1-CD1 4.28Å; Y77-L80 PolarHBondContact O-N 2.92Å; Y77-L80 VanDerWaalsContact O-N 3.13Å; Y77-I81 WeakPolarHBondContact O-CG1 3.32Å; Y77-I81 PolarHBondContact O-N 2.88Å; Y77-V159 HydrophobicContact CD1-CG1 4.37Å; Y77-V159 HydrophobicContact CD2-CB 4.25Å; Y77-V159 HydrophobicContact CG-CB 4.01Å; Y77-V159 HydrophobicContact CG-CG1 4.09Å; Y77-I161 HydrophobicContact CD1-CD1 3.8Å; Y77-I161 HydrophobicContact CD1-CG1 3.97Å; Y77-I161 HydrophobicContact CE1-CD1 4.32Å; Y77-I161 HydrophobicContact CE1-CG1 4.25Å
78	Y	93.6	Very high	90	Very high	19 Å²	19	95.4 Å²	95.4	8%	0.075	42%	0.422	C	S	.	.	H	α-helix	trans	-61.3	-37.3	173.2	-57.8	-31.6	0	0	0	112.9	T74 I76 I81 R82 F89 I91 P156 V159	T74-Y78 HydrophobicContact CG2-CD2 4.5Å; T74-Y78 HydrophobicContact CG2-CE1 4.02Å; T74-Y78 HydrophobicContact CG2-CE2 3.66Å; T74-Y78 WeakPolarHBondContact CG2-OH 3.43Å; T74-Y78 WeakPolarHBondContact O-CD2 3.39Å; T74-Y78 PolarHBondContact O-N 2.93Å; T74-Y78 VanDerWaalsContact O-N 3.12Å; I76-Y78 VanDerWaalsContact C-N 3.34Å; I76-Y78 PolarHBondContact O-N 3.44Å; Y78-I81 HydrophobicContact CD1-CD1 4.42Å; Y78-R82 VanDerWaalsContact O-CB 3.31Å; Y78-R82 WeakPolarHBondContact O-CB 3.27Å; Y78-R82 PolarHBondContact O-N 2.83Å; Y78-F89 AromaticContact CD1-CE1 3.79Å; Y78-F89 HydrophobicContact CD1-CE1 3.79Å; Y78-F89 HydrophobicContact CD1-CZ 4.2Å; Y78-F89 HydrophobicContact CG-CE1 4.23Å; Y78-I91 HydrophobicContact CD1-CD1 4.36Å; Y78-I91 HydrophobicContact CD2-CB 4.14Å; Y78-I91 HydrophobicContact CD2-CG1 4.25Å; Y78-I91 HydrophobicContact CD2-CG2 4.13Å; Y78-I91 HydrophobicContact CE1-CB 4.43Å; Y78-I91 HydrophobicContact CE1-CD1 3.59Å; Y78-I91 HydrophobicContact CE1-CG1 4Å; Y78-I91 HydrophobicContact CE2-CB 4.04Å; Y78-I91 HydrophobicContact CE2-CD1 4.14Å; Y78-I91 HydrophobicContact CE2-CG1 3.63Å; Y78-I91 HydrophobicContact CE2-CG2 4.17Å; Y78-I91 HydrophobicContact CG-CB 4.38Å; Y78-I91 VanDerWaalsContact CZ-CD1 3.46Å; Y78-I91 VanDerWaalsContact CZ-CG1 3.49Å; Y78-I91 WeakPolarHBondContact OH-CD1 3.32Å; Y78-P156 WeakPolarHBondContact OH-CB 3.42Å; Y78-P156 VanDerWaalsContact OH-CG 3.27Å; Y78-P156 WeakPolarHBondContact OH-CG 3.43Å; Y78-V159 HydrophobicContact CD1-CG2 4.35Å; Y78-V159 HydrophobicContact CE1-CG2 3.68Å
79	F	94	Very high	90.9	Very high	132 Å²	132	92.2 Å²	92.2	58%	0.579	40%	0.4	S	S	*	.	H	α-helix	trans	-66.4	-39.3	173.6	177.1	-96.5	0	0	0	111.9	R75 I76 Y77 R82 T83	R75-F79 PolarHBondContact O-N 2.72Å; I76-F79 CarbonylContact O-C 3.59Å; I76-F79 WeakPolarHBondContact O-CA 3.49Å; I76-F79 WeakPolarHBondContact O-CB 3.48Å; I76-F79 PolarHBondContact O-N 3.48Å; Y77-F79 VanDerWaalsContact C-N 3.29Å; Y77-F79 PolarHBondContact O-N 3.18Å; F79-R82 PolarHBondContact O-N 2.91Å; F79-T83 HydrophobicContact CD1-CG2 4.35Å; F79-T83 HydrophobicContact CD2-CG2 4.22Å; F79-T83 HydrophobicContact CE1-CG2 3.92Å; F79-T83 HydrophobicContact CE2-CG2 3.77Å; F79-T83 HydrophobicContact CG-CG2 4.5Å; F79-T83 HydrophobicContact CZ-CG2 3.61Å; F79-T83 WeakPolarHBondContact O-CB 3.5Å; F79-T83 WeakPolarHBondContact O-CG2 3.49Å; F79-T83 PolarHBondContact O-N 2.9Å; F79-T83 PolarHBondContact O-OG1 3.31Å
80	L	94.9	Very high	91.5	Very high	53 Å²	53	86 Å²	86	28%	0.277	38%	0.376	S	S	.	.	H	α-helix	trans	-66	-44.6	175.7	-67	176.8	0	0	0	112.3	I76 Y77 R82 T83 Y84 I161	I76-L80 HydrophobicContact CG2-CD1 4Å; I76-L80 HydrophobicContact CG2-CG 4.17Å; I76-L80 WeakPolarHBondContact O-CG 3.46Å; I76-L80 PolarHBondContact O-N 2.81Å; Y77-L80 HydrophobicContact CD1-CD1 4.28Å; Y77-L80 PolarHBondContact O-N 2.92Å; Y77-L80 VanDerWaalsContact O-N 3.13Å; L80-R82 VanDerWaalsContact C-N 3.3Å; L80-R82 PolarHBondContact O-N 2.93Å; L80-T83 WeakPolarHBondContact CA-OG1 3.32Å; L80-T83 PolarHBondContact O-N 3.42Å; L80-T83 PolarHBondContact O-OG1 2.72Å; L80-Y84 HydrophobicContact CD2-CD2 4.01Å; L80-Y84 HydrophobicContact CD2-CE2 3.73Å; L80-Y84 WeakPolarHBondContact O-CB 3.4Å; L80-Y84 WeakPolarHBondContact O-CD2 3.48Å; L80-Y84 PolarHBondContact O-N 2.79Å; L80-I161 HydrophobicContact CB-CD1 4.06Å
81	I	94.8	Very high	92.2	Very high	0 Å²	0	83.3 Å²	83.3	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-55.2	-51	172	-65.1	162.9	0	0	0	109	Y77 Y78 T83 F85 D86 F89 V159 I161 V171 I173	Y77-I81 WeakPolarHBondContact O-CG1 3.32Å; Y77-I81 PolarHBondContact O-N 2.88Å; Y78-I81 HydrophobicContact CD1-CD1 4.42Å; I81-T83 VanDerWaalsContact C-N 3.31Å; I81-T83 PolarHBondContact O-N 2.83Å; I81-F85 WeakPolarHBondContact O-CA 3.35Å; I81-F85 WeakPolarHBondContact O-CB 3.37Å; I81-F85 PolarHBondContact O-N 3.13Å; I81-D86 PolarHBondContact O-N 3.06Å; I81-F89 HydrophobicContact CB-CD1 4.11Å; I81-F89 HydrophobicContact CB-CE1 4.41Å; I81-F89 HydrophobicContact CB-CG 4.4Å; I81-F89 HydrophobicContact CD1-CE1 4.2Å; I81-F89 HydrophobicContact CD1-CZ 4.23Å; I81-F89 HydrophobicContact CG2-CB 3.89Å; I81-F89 HydrophobicContact CG2-CD1 3.72Å; I81-F89 HydrophobicContact CG2-CD2 3.84Å; I81-F89 HydrophobicContact CG2-CE1 4.22Å; I81-F89 HydrophobicContact CG2-CE2 4.33Å; I81-F89 HydrophobicContact CG2-CG 3.51Å; I81-V159 HydrophobicContact CD1-CG1 3.79Å; I81-I161 HydrophobicContact CG1-CD1 4.16Å; I81-V171 HydrophobicContact CD1-CG1 3.55Å; I81-V171 HydrophobicContact CG1-CG1 3.85Å; I81-V171 HydrophobicContact CG1-CG2 4.23Å; I81-I173 HydrophobicContact CD1-CD1 4.3Å
82	R	95.2	Very high	92.8	Very high	148 Å²	148	81 Å²	81	56%	0.558	36%	0.359	S	S	*	.	H	α-helix	trans	-64.4	-31.8	-177.2	-164.8	174.4	178.9	-169	1.1	114.4	Y78 F79 L80 D86 K87	Y78-R82 VanDerWaalsContact O-CB 3.31Å; Y78-R82 WeakPolarHBondContact O-CB 3.27Å; Y78-R82 PolarHBondContact O-N 2.83Å; F79-R82 PolarHBondContact O-N 2.91Å; L80-R82 VanDerWaalsContact C-N 3.3Å; L80-R82 PolarHBondContact O-N 2.93Å; R82-D86 VanDerWaalsContact CA-O 3.26Å; R82-D86 WeakPolarHBondContact CA-O 3.47Å; R82-K87 WeakPolarHBondContact CG-O 3.38Å; R82-K87 PolarHBondContact NE-O 2.98Å; R82-K87 VanDerWaalsContact O-CA 3.31Å; R82-K87 WeakPolarHBondContact O-CA 3.48Å
83	T	94.3	Very high	93.3	Very high	62 Å²	62	81.7 Å²	81.7	38%	0.38	36%	0.364	S	S	.	.	H	α-helix	trans	-89.4	-34.4	-176.5	45.1	0	0	0	0	113.9	F79 L80 I81	F79-T83 HydrophobicContact CD1-CG2 4.35Å; F79-T83 HydrophobicContact CD2-CG2 4.22Å; F79-T83 HydrophobicContact CE1-CG2 3.92Å; F79-T83 HydrophobicContact CE2-CG2 3.77Å; F79-T83 HydrophobicContact CG-CG2 4.5Å; F79-T83 HydrophobicContact CZ-CG2 3.61Å; F79-T83 WeakPolarHBondContact O-CB 3.5Å; F79-T83 WeakPolarHBondContact O-CG2 3.49Å; F79-T83 PolarHBondContact O-N 2.9Å; F79-T83 PolarHBondContact O-OG1 3.31Å; L80-T83 WeakPolarHBondContact CA-OG1 3.32Å; L80-T83 PolarHBondContact O-N 3.42Å; L80-T83 PolarHBondContact O-OG1 2.72Å; I81-T83 VanDerWaalsContact C-N 3.31Å; I81-T83 PolarHBondContact O-N 2.83Å
84	Y	93.3	Very high	93.6	Very high	180 Å²	180	78.3 Å²	78.3	71%	0.706	35%	0.352	S	S	*	.	H	α-helix	trans	-110	-21.5	-171.7	-67.1	-78.5	0	0	0	115.1	L80	L80-Y84 HydrophobicContact CD2-CD2 4.01Å; L80-Y84 HydrophobicContact CD2-CE2 3.73Å; L80-Y84 WeakPolarHBondContact O-CB 3.4Å; L80-Y84 WeakPolarHBondContact O-CD2 3.48Å; L80-Y84 PolarHBondContact O-N 2.79Å
85	F	92.9	Very high	94	Very high	39 Å²	39	78.7 Å²	78.7	17%	0.171	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	-49.7	-170	-62.2	-88.4	0	0	0	112.8	I81 I161 K169 V171 F221	I81-F85 WeakPolarHBondContact O-CA 3.35Å; I81-F85 WeakPolarHBondContact O-CB 3.37Å; I81-F85 PolarHBondContact O-N 3.13Å; F85-I161 HydrophobicContact CE1-CG2 4.45Å; F85-I161 HydrophobicContact CE2-CD1 4.08Å; F85-I161 HydrophobicContact CE2-CG2 3.87Å; F85-I161 HydrophobicContact CZ-CG2 3.54Å; F85-K169 HydrophobicContact CE1-CB 4.08Å; F85-K169 HydrophobicContact CE1-CD 4.18Å; F85-V171 HydrophobicContact CD1-CG2 4.37Å; F85-V171 HydrophobicContact CG-CG2 4.32Å; F85-F221 HydrophobicContact CB-CD1 3.88Å; F85-F221 HydrophobicContact CB-CD2 4.38Å; F85-F221 HydrophobicContact CB-CE1 4.05Å; F85-F221 HydrophobicContact CB-CG 4.05Å; F85-F221 HydrophobicContact CB-CZ 4.35Å; F85-F221 HydrophobicContact CD1-CB 3.73Å; F85-F221 HydrophobicContact CD1-CD1 4.45Å; F85-F221 HydrophobicContact CD1-CD2 4.09Å; F85-F221 AromaticContact CD1-CG 3.83Å; F85-F221 HydrophobicContact CD1-CG 3.83Å; F85-F221 HydrophobicContact CE1-CB 4.47Å; F85-F221 HydrophobicContact CG-CG 4.4Å
86	D	93.2	Very high	94.3	Very high	32 Å²	32	77 Å²	77	17%	0.171	35%	0.352	C	S	.	.			trans	-148.5	99.9	-171.7	-170.2	-25.1	0	0	0	111.4	I81 R82 E88 F89 R219 F221	I81-D86 PolarHBondContact O-N 3.06Å; R82-D86 VanDerWaalsContact CA-O 3.26Å; R82-D86 WeakPolarHBondContact CA-O 3.47Å; D86-E88 PolarHBondContact O-N 3.38Å; D86-E88 VanDerWaalsContact O-N 3.13Å; D86-E88 PolarHBondContact OD1-N 3.13Å; D86-E88 VanDerWaalsContact OD1-N 3.12Å; D86-F89 HydrophobicContact CB-CB 4.01Å; D86-F89 VanDerWaalsContact O-CB 3.23Å; D86-F89 WeakPolarHBondContact O-CB 3.5Å; D86-F89 PolarHBondContact O-N 2.86Å; D86-F89 PolarHBondContact OD1-N 3.36Å; D86-R219 IonicContact OD2-CZ 3.53Å; D86-R219 IonicContact OD2-NH1 3.16Å; D86-R219 PolarHBondContact OD2-NH1 3.16Å; D86-R219 IonicContact OD2-NH2 3.5Å; D86-R219 PolarHBondContact OD2-NH2 2.89Å; D86-F221 HydrophobicContact CB-CE1 3.86Å; D86-F221 HydrophobicContact CB-CZ 4.34Å
87	K	92.9	Very high	94.5	Very high	170 Å²	170	75.1 Å²	75.1	74%	0.739	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-23.6	-175.3	-68.2	-178.2	179.6	177.9	0	114.3	R82	R82-K87 WeakPolarHBondContact CG-O 3.38Å; R82-K87 PolarHBondContact NE-O 2.98Å; R82-K87 VanDerWaalsContact O-CA 3.31Å; R82-K87 WeakPolarHBondContact O-CA 3.48Å
88	E	93.4	Very high	94.7	Very high	170 Å²	170	71.9 Å²	71.9	79%	0.794	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-6.5	-177.1	-65.5	174.8	-172	0	0	111.3	D86 S90	D86-E88 PolarHBondContact O-N 3.38Å; D86-E88 VanDerWaalsContact O-N 3.13Å; D86-E88 PolarHBondContact OD1-N 3.13Å; D86-E88 VanDerWaalsContact OD1-N 3.12Å; E88-S90 PolarHBondContact O-N 2.89Å; E88-S90 VanDerWaalsContact O-N 3.15Å
89	F	95.1	Very high	94.9	Very high	18 Å²	18	72.7 Å²	72.7	8%	0.079	34%	0.343	C	S	.	.			trans	-53.8	119.5	178.9	-177.9	-98.4	0	0	0	113.5	Y78 I81 D86 I91 F94 I173 W229	Y78-F89 AromaticContact CD1-CE1 3.79Å; Y78-F89 HydrophobicContact CD1-CE1 3.79Å; Y78-F89 HydrophobicContact CD1-CZ 4.2Å; Y78-F89 HydrophobicContact CG-CE1 4.23Å; I81-F89 HydrophobicContact CB-CD1 4.11Å; I81-F89 HydrophobicContact CB-CE1 4.41Å; I81-F89 HydrophobicContact CB-CG 4.4Å; I81-F89 HydrophobicContact CD1-CE1 4.2Å; I81-F89 HydrophobicContact CD1-CZ 4.23Å; I81-F89 HydrophobicContact CG2-CB 3.89Å; I81-F89 HydrophobicContact CG2-CD1 3.72Å; I81-F89 HydrophobicContact CG2-CD2 3.84Å; I81-F89 HydrophobicContact CG2-CE1 4.22Å; I81-F89 HydrophobicContact CG2-CE2 4.33Å; I81-F89 HydrophobicContact CG2-CG 3.51Å; D86-F89 HydrophobicContact CB-CB 4.01Å; D86-F89 VanDerWaalsContact O-CB 3.23Å; D86-F89 WeakPolarHBondContact O-CB 3.5Å; D86-F89 PolarHBondContact O-N 2.86Å; D86-F89 PolarHBondContact OD1-N 3.36Å; F89-I91 HydrophobicContact CE1-CB 4.43Å; F89-I91 HydrophobicContact CZ-CD1 4.44Å; F89-F94 HydrophobicContact CE2-CB 4.06Å; F89-F94 HydrophobicContact CE2-CD2 4.25Å; F89-F94 HydrophobicContact CE2-CG 4.2Å; F89-F94 HydrophobicContact CZ-CB 4.41Å; F89-I173 HydrophobicContact CE2-CD1 3.95Å; F89-I173 HydrophobicContact CZ-CD1 3.71Å; F89-W229 HydrophobicContact CE2-CZ2 4.25Å
90	S	94.8	Very high	95	Very high	31 Å²	31	72.6 Å²	72.6	22%	0.217	34%	0.344	C	S	.	.			trans	-121.2	126.9	175.1	172.8	0	0	0	0	108.5	E88 E92 E93 F94	E88-S90 PolarHBondContact O-N 2.89Å; E88-S90 VanDerWaalsContact O-N 3.15Å; S90-E92 VanDerWaalsContact C-N 3.27Å; S90-E92 PolarHBondContact OG-OE2 2.92Å; S90-E93 PolarHBondContact OG-N 2.71Å; S90-F94 VanDerWaalsContact O-CB 3.3Å; S90-F94 WeakPolarHBondContact O-CB 3.28Å; S90-F94 PolarHBondContact O-N 2.9Å
91	I	93.5	Very high	95.1	Very high	16 Å²	16	71.6 Å²	71.6	8%	0.082	34%	0.344	C	S	.	.	H	α-helix	trans	-72.8	-28.6	179.2	-179.8	59.4	0	0	0	110.8	Y78 F89 F94 T95 P156	Y78-I91 HydrophobicContact CD1-CD1 4.36Å; Y78-I91 HydrophobicContact CD2-CB 4.14Å; Y78-I91 HydrophobicContact CD2-CG1 4.25Å; Y78-I91 HydrophobicContact CD2-CG2 4.13Å; Y78-I91 HydrophobicContact CE1-CB 4.43Å; Y78-I91 HydrophobicContact CE1-CD1 3.59Å; Y78-I91 HydrophobicContact CE1-CG1 4Å; Y78-I91 HydrophobicContact CE2-CB 4.04Å; Y78-I91 HydrophobicContact CE2-CD1 4.14Å; Y78-I91 HydrophobicContact CE2-CG1 3.63Å; Y78-I91 HydrophobicContact CE2-CG2 4.17Å; Y78-I91 HydrophobicContact CG-CB 4.38Å; Y78-I91 VanDerWaalsContact CZ-CD1 3.46Å; Y78-I91 VanDerWaalsContact CZ-CG1 3.49Å; Y78-I91 WeakPolarHBondContact OH-CD1 3.32Å; F89-I91 HydrophobicContact CE1-CB 4.43Å; F89-I91 HydrophobicContact CZ-CD1 4.44Å; I91-F94 HydrophobicContact CD1-CD1 3.9Å; I91-T95 VanDerWaalsContact O-CB 3.26Å; I91-T95 WeakPolarHBondContact O-CB 3.3Å; I91-T95 PolarHBondContact O-N 3.46Å; I91-T95 PolarHBondContact O-OG1 3.38Å; I91-P156 HydrophobicContact CD1-CB 4.3Å
92	E	94.2	Very high	95.3	Very high	119 Å²	119	71.6 Å²	71.6	56%	0.556	34%	0.344	S	S	*	.	H	α-helix	trans	-65	-49.7	176.2	-64	73.7	-166.3	0	0	110.6	S90 T95 E96	S90-E92 VanDerWaalsContact C-N 3.27Å; S90-E92 PolarHBondContact OG-OE2 2.92Å; E92-T95 PolarHBondContact O-N 3.47Å; E92-E96 PolarHBondContact O-N 3.03Å
93	E	96	Very high	95.4	Very high	140 Å²	140	64.7 Å²	64.7	65%	0.654	32%	0.318	S	S	*	.	H	α-helix	trans	-66.7	-42.3	176.7	-65.8	173.3	177.4	0	0	111.8	S90 T95 E96 G97	S90-E93 PolarHBondContact OG-N 2.71Å; E93-T95 VanDerWaalsContact C-N 3.28Å; E93-T95 PolarHBondContact O-N 3.12Å; E93-E96 PolarHBondContact O-N 2.66Å; E93-G97 PolarHBondContact O-N 3.17Å
94	F	96.3	Very high	95.5	Very high	20 Å²	20	65.8 Å²	65.8	9%	0.088	32%	0.319	C	S	.	.	H	α-helix	trans	-58.4	-40.3	173.5	175.9	-90	0	0	0	111.8	F89 S90 I91 G97 A98 I173 M175 F217 W229	F89-F94 HydrophobicContact CE2-CB 4.06Å; F89-F94 HydrophobicContact CE2-CD2 4.25Å; F89-F94 HydrophobicContact CE2-CG 4.2Å; F89-F94 HydrophobicContact CZ-CB 4.41Å; S90-F94 VanDerWaalsContact O-CB 3.3Å; S90-F94 WeakPolarHBondContact O-CB 3.28Å; S90-F94 PolarHBondContact O-N 2.9Å; I91-F94 HydrophobicContact CD1-CD1 3.9Å; F94-G97 PolarHBondContact O-N 3.01Å; F94-A98 HydrophobicContact CE1-CB 4.23Å; F94-A98 HydrophobicContact CZ-CB 4.44Å; F94-A98 WeakPolarHBondContact O-CB 3.23Å; F94-A98 PolarHBondContact O-N 2.95Å; F94-I173 HydrophobicContact CD1-CD1 4.18Å; F94-I173 HydrophobicContact CD1-CG2 4.39Å; F94-I173 HydrophobicContact CD2-CD1 4.3Å; F94-I173 HydrophobicContact CE1-CB 3.87Å; F94-I173 HydrophobicContact CE1-CD1 3.92Å; F94-I173 HydrophobicContact CE1-CG1 4.48Å; F94-I173 HydrophobicContact CE1-CG2 3.54Å; F94-I173 HydrophobicContact CE2-CD1 4.04Å; F94-I173 HydrophobicContact CG-CD1 4.37Å; F94-I173 HydrophobicContact CZ-CB 3.71Å; F94-I173 HydrophobicContact CZ-CD1 3.85Å; F94-I173 HydrophobicContact CZ-CG1 4.26Å; F94-I173 HydrophobicContact CZ-CG2 3.95Å; F94-M175 HydrophobicContact CD1-SD 4.34Å; F94-M175 HydrophobicContact CE1-CG 3.79Å; F94-M175 HydrophobicContact CE1-SD 3.78Å; F94-M175 HydrophobicContact CZ-CG 4.41Å; F94-F217 HydrophobicContact CE2-CB 4.24Å; F94-F217 HydrophobicContact CZ-CB 3.87Å; F94-F217 HydrophobicContact CZ-CD2 4.18Å; F94-F217 HydrophobicContact CZ-CG 4.12Å; F94-W229 HydrophobicContact CD2-CD2 4.4Å; F94-W229 AromaticContact CD2-CE2 3.95Å; F94-W229 HydrophobicContact CD2-CH2 4.42Å; F94-W229 AromaticContact CD2-CZ2 3.96Å; F94-W229 HydrophobicContact CD2-CZ2 3.96Å; F94-W229 AromaticContact CE2-CD2 3.78Å; F94-W229 HydrophobicContact CE2-CD2 3.78Å; F94-W229 AromaticContact CE2-CE2 3.77Å; F94-W229 AromaticContact CE2-CE3 3.87Å; F94-W229 HydrophobicContact CE2-CE3 3.87Å; F94-W229 HydrophobicContact CE2-CG 4.44Å; F94-W229 AromaticContact CE2-CH2 3.97Å; F94-W229 HydrophobicContact CE2-CH2 3.97Å; F94-W229 AromaticContact CE2-CZ2 3.87Å; F94-W229 HydrophobicContact CE2-CZ2 3.87Å; F94-W229 AromaticContact CE2-CZ3 3.97Å; F94-W229 HydrophobicContact CE2-CZ3 3.97Å
95	T	95.9	Very high	95.8	Very high	20 Å²	20	57.3 Å²	57.3	12%	0.123	29%	0.286	C	S	.	.	H	α-helix	trans	-65.2	-42.1	180	-64.8	0	0	0	0	111.9	I91 E92 E93 K99 T154 M175	I91-T95 VanDerWaalsContact O-CB 3.26Å; I91-T95 WeakPolarHBondContact O-CB 3.3Å; I91-T95 PolarHBondContact O-N 3.46Å; I91-T95 PolarHBondContact O-OG1 3.38Å; E92-T95 PolarHBondContact O-N 3.47Å; E93-T95 VanDerWaalsContact C-N 3.28Å; E93-T95 PolarHBondContact O-N 3.12Å; T95-K99 WeakPolarHBondContact O-CB 3.34Å; T95-K99 PolarHBondContact O-N 3.32Å; T95-T154 WeakPolarHBondContact CG2-OG1 3.36Å; T95-M175 HydrophobicContact CG2-CE 3.87Å
96	E	96.3	Very high	95.9	Very high	101 Å²	101	55.4 Å²	55.4	47%	0.472	28%	0.277	S	S	.	.	H	α-helix	trans	-69.5	-41.4	175.8	-69.9	-56.7	136.3	0	0	112	E92 E93 K99 Q100	E92-E96 PolarHBondContact O-N 3.03Å; E93-E96 PolarHBondContact O-N 2.66Å; E96-K99 WeakPolarHBondContact O-CB 3.34Å; E96-K99 PolarHBondContact O-N 3.23Å; E96-Q100 WeakPolarHBondContact O-CG 3.41Å; E96-Q100 PolarHBondContact O-N 3.01Å
97	G	96.7	Very high	96.1	Very high	36 Å²	36	56.9 Å²	56.9	37%	0.371	28%	0.281	S	S	.	.	H	α-helix	trans	-60	-46	173	0	0	0	0	0	112.4	E93 F94 K99 Q100 A101	E93-G97 PolarHBondContact O-N 3.17Å; F94-G97 PolarHBondContact O-N 3.01Å; G97-K99 VanDerWaalsContact C-N 3.3Å; G97-K99 PolarHBondContact O-N 3.37Å; G97-Q100 PolarHBondContact O-N 3.05Å; G97-A101 WeakPolarHBondContact O-CB 3.41Å; G97-A101 PolarHBondContact O-N 3.26Å
98	A	97.4	Very high	96.3	Very high	3 Å²	3	49.6 Å²	49.6	3%	0.025	25%	0.249	C	C	.	.	H	α-helix	trans	-62.4	-35.5	175.8	0	0	0	0	0	112.4	F94 F102 M175 F177 F217	F94-A98 HydrophobicContact CE1-CB 4.23Å; F94-A98 HydrophobicContact CZ-CB 4.44Å; F94-A98 WeakPolarHBondContact O-CB 3.23Å; F94-A98 PolarHBondContact O-N 2.95Å; A98-F102 VanDerWaalsContact O-CB 3.22Å; A98-F102 WeakPolarHBondContact O-CB 3.26Å; A98-F102 PolarHBondContact O-N 3.49Å; A98-M175 HydrophobicContact CB-CE 4.41Å; A98-M175 HydrophobicContact CB-CG 3.99Å; A98-F177 HydrophobicContact CB-CZ 4.2Å; A98-F217 HydrophobicContact CB-CD2 4.27Å; A98-F217 HydrophobicContact CB-CE1 4.38Å; A98-F217 HydrophobicContact CB-CE2 3.72Å; A98-F217 HydrophobicContact CB-CZ 3.79Å
99	K	97.1	Very high	96.4	Very high	37 Å²	37	41.5 Å²	41.5	16%	0.161	21%	0.212	C	C	.	.	H	α-helix	trans	-66.5	-41.6	174.3	-172.7	-170.6	178.9	-163.2	0	112.4	T95 E96 G97 S103 P148 V151 T154 F177	T95-K99 WeakPolarHBondContact O-CB 3.34Å; T95-K99 PolarHBondContact O-N 3.32Å; E96-K99 WeakPolarHBondContact O-CB 3.34Å; E96-K99 PolarHBondContact O-N 3.23Å; G97-K99 VanDerWaalsContact C-N 3.3Å; G97-K99 PolarHBondContact O-N 3.37Å; K99-S103 WeakPolarHBondContact O-CB 3.28Å; K99-S103 PolarHBondContact O-N 2.88Å; K99-S103 PolarHBondContact O-OG 2.9Å; K99-P148 WeakPolarHBondContact CE-O 3.32Å; K99-P148 PolarHBondContact NZ-O 3.03Å; K99-V151 HydrophobicContact CG-CG1 4.36Å; K99-T154 HydrophobicContact CG-CG2 4.43Å; K99-F177 HydrophobicContact CB-CE1 4.26Å
100	Q	97.4	Very high	96.4	Very high	129 Å²	129	41.4 Å²	41.4	60%	0.603	21%	0.213	S	C	*	.	H	α-helix	trans	-65.6	-46.1	174.4	-68.1	177.3	15.8	0	0	111.3	E96 G97 S103 H104	E96-Q100 WeakPolarHBondContact O-CG 3.41Å; E96-Q100 PolarHBondContact O-N 3.01Å; G97-Q100 PolarHBondContact O-N 3.05Å; Q100-S103 PolarHBondContact O-N 3.09Å; Q100-H104 WeakPolarHBondContact O-CB 3.38Å; Q100-H104 PolarHBondContact O-N 3.11Å
101	A	97.5	Very high	96.4	Very high	33 Å²	33	47.4 Å²	47.4	27%	0.273	23%	0.231	S	C	.	.	H	α-helix	trans	-60.9	-45.4	177	0	0	0	0	0	112.2	G97 S103 H104 V105 F217	G97-A101 WeakPolarHBondContact O-CB 3.41Å; G97-A101 PolarHBondContact O-N 3.26Å; A101-S103 PolarHBondContact O-N 3.18Å; A101-H104 PolarHBondContact O-N 3.28Å; A101-V105 WeakPolarHBondContact O-CB 3.47Å; A101-V105 WeakPolarHBondContact O-CG2 3.15Å; A101-V105 PolarHBondContact O-N 3.31Å; A101-F217 HydrophobicContact CB-CE1 3.82Å; A101-F217 HydrophobicContact CB-CZ 4.27Å
102	F	97.7	Very high	96.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-55.1	-48.5	172.2	166.4	-104.7	0	0	0	111.8	A98 H104 S106 A146 V151 F177 Y179 A213 Y215	A98-F102 VanDerWaalsContact O-CB 3.22Å; A98-F102 WeakPolarHBondContact O-CB 3.26Å; A98-F102 PolarHBondContact O-N 3.49Å; F102-H104 VanDerWaalsContact C-N 3.34Å; F102-H104 PolarHBondContact O-N 3.34Å; F102-S106 WeakPolarHBondContact O-CB 3.45Å; F102-S106 PolarHBondContact O-N 3.05Å; F102-S106 PolarHBondContact O-OG 3.4Å; F102-A146 HydrophobicContact CD1-CB 4.43Å; F102-A146 HydrophobicContact CE1-CB 3.4Å; F102-A146 VanDerWaalsContact CE1-CB 3.4Å; F102-A146 HydrophobicContact CZ-CB 3.66Å; F102-V151 HydrophobicContact CD1-CG2 3.98Å; F102-V151 HydrophobicContact CE1-CG2 3.74Å; F102-F177 HydrophobicContact CB-CD1 4.11Å; F102-F177 HydrophobicContact CB-CD2 4.18Å; F102-F177 HydrophobicContact CB-CE1 3.84Å; F102-F177 HydrophobicContact CB-CE2 3.89Å; F102-F177 HydrophobicContact CB-CG 4.29Å; F102-F177 HydrophobicContact CB-CZ 3.71Å; F102-F177 HydrophobicContact CD1-CB 4.13Å; F102-F177 AromaticContact CD1-CD1 3.75Å; F102-F177 HydrophobicContact CD1-CD1 3.75Å; F102-F177 HydrophobicContact CD1-CD2 4.38Å; F102-F177 HydrophobicContact CD1-CE1 4.31Å; F102-F177 AromaticContact CD1-CG 3.81Å; F102-F177 HydrophobicContact CD1-CG 3.81Å; F102-F177 HydrophobicContact CD2-CB 4.36Å; F102-F177 AromaticContact CD2-CD2 3.71Å; F102-F177 HydrophobicContact CD2-CD2 3.71Å; F102-F177 HydrophobicContact CD2-CE2 4.15Å; F102-F177 AromaticContact CD2-CG 3.93Å; F102-F177 HydrophobicContact CD2-CG 3.93Å; F102-F177 HydrophobicContact CE1-CB 3.93Å; F102-F177 HydrophobicContact CE1-CD1 4.36Å; F102-F177 HydrophobicContact CE1-CG 4.13Å; F102-F177 HydrophobicContact CE2-CB 4.2Å; F102-F177 HydrophobicContact CE2-CD2 4.25Å; F102-F177 HydrophobicContact CE2-CG 4.27Å; F102-F177 HydrophobicContact CG-CB 4.35Å; F102-F177 AromaticContact CG-CD1 3.84Å; F102-F177 HydrophobicContact CG-CD1 3.84Å; F102-F177 AromaticContact CG-CD2 3.8Å; F102-F177 HydrophobicContact CG-CD2 3.8Å; F102-F177 HydrophobicContact CG-CE1 4.11Å; F102-F177 HydrophobicContact CG-CE2 4.04Å; F102-F177 AromaticContact CG-CG 3.7Å; F102-F177 HydrophobicContact CG-CG 3.7Å; F102-F177 HydrophobicContact CG-CZ 4.19Å; F102-F177 HydrophobicContact CZ-CB 3.99Å; F102-F177 HydrophobicContact CZ-CG 4.37Å; F102-Y179 HydrophobicContact CE1-CD1 4.3Å; F102-Y179 HydrophobicContact CE1-CG 4.44Å; F102-Y179 AromaticContact CZ-CD1 3.7Å; F102-Y179 HydrophobicContact CZ-CD1 3.7Å; F102-Y179 AromaticContact CZ-CE1 3.91Å; F102-Y179 HydrophobicContact CZ-CE1 3.91Å; F102-Y179 HydrophobicContact CZ-CG 4.17Å; F102-A213 HydrophobicContact CE2-CB 3.64Å; F102-A213 HydrophobicContact CZ-CB 4.2Å; F102-Y215 AromaticContact CD2-CD1 3.81Å; F102-Y215 HydrophobicContact CD2-CD1 3.81Å; F102-Y215 HydrophobicContact CD2-CD2 4.4Å; F102-Y215 AromaticContact CD2-CE1 3.45Å; F102-Y215 HydrophobicContact CD2-CE1 3.45Å; F102-Y215 VanDerWaalsContact CD2-CE1 3.45Å; F102-Y215 HydrophobicContact CD2-CE2 4.05Å; F102-Y215 HydrophobicContact CD2-CG 4.33Å; F102-Y215 AromaticContact CD2-CZ 3.59Å; F102-Y215 HydrophobicContact CE2-CD1 4.27Å; F102-Y215 AromaticContact CE2-CE1 3.65Å; F102-Y215 HydrophobicContact CE2-CE1 3.65Å; F102-Y215 AromaticContact CE2-CZ 3.99Å
103	S	97.3	Very high	96.4	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.014	23%	0.234	C	C	.	.	H	α-helix	trans	-64.8	-40	-178.8	-51.1	0	0	0	0	111.6	K99 Q100 A101 S106 R107 A146	K99-S103 WeakPolarHBondContact O-CB 3.28Å; K99-S103 PolarHBondContact O-N 2.88Å; K99-S103 PolarHBondContact O-OG 2.9Å; Q100-S103 PolarHBondContact O-N 3.09Å; A101-S103 PolarHBondContact O-N 3.18Å; S103-S106 PolarHBondContact O-OG 3.48Å; S103-R107 WeakPolarHBondContact O-CB 3.44Å; S103-R107 PolarHBondContact O-N 2.72Å; S103-A146 VanDerWaalsContact CA-O 3.25Å; S103-A146 WeakPolarHBondContact CA-O 3.31Å; S103-A146 VanDerWaalsContact CB-O 3.31Å; S103-A146 WeakPolarHBondContact CB-O 3.47Å
104	H	97.7	Very high	96.3	Very high	86 Å²	86	41.6 Å²	41.6	40%	0.398	21%	0.208	S	C	.	.	H	α-helix	trans	-66.9	-52.1	176.9	-174.5	80.8	0	0	0	112.5	Q100 A101 F102 R107 L108	Q100-H104 WeakPolarHBondContact O-CB 3.38Å; Q100-H104 PolarHBondContact O-N 3.11Å; A101-H104 PolarHBondContact O-N 3.28Å; F102-H104 VanDerWaalsContact C-N 3.34Å; F102-H104 PolarHBondContact O-N 3.34Å; H104-R107 WeakPolarHBondContact O-CB 3.23Å; H104-R107 PolarHBondContact O-N 3.45Å; H104-L108 PolarHBondContact O-N 2.83Å; H104-L108 VanDerWaalsContact O-N 3.1Å
105	V	97.8	Very high	96.3	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.006	24%	0.24	C	C	.	.	H	α-helix	trans	-66.4	-41.7	-177.9	168.6	0	0	0	0	111.5	A101 R107 L108 L109 L117 L120 V121 Y215 I231 I234	A101-V105 WeakPolarHBondContact O-CB 3.47Å; A101-V105 WeakPolarHBondContact O-CG2 3.15Å; A101-V105 PolarHBondContact O-N 3.31Å; V105-R107 VanDerWaalsContact C-N 3.28Å; V105-R107 PolarHBondContact O-N 2.94Å; V105-L108 PolarHBondContact O-N 3.22Å; V105-L108 VanDerWaalsContact O-N 3.12Å; V105-L109 HydrophobicContact CG1-CD1 3.98Å; V105-L109 HydrophobicContact CG1-CG 4.27Å; V105-L109 WeakPolarHBondContact O-CG 3.42Å; V105-L109 PolarHBondContact O-N 3.37Å; V105-L117 HydrophobicContact CB-CD2 4.41Å; V105-L117 HydrophobicContact CG1-CD2 3.88Å; V105-L117 HydrophobicContact CG2-CD2 4.25Å; V105-L120 HydrophobicContact CG2-CB 4.47Å; V105-L120 HydrophobicContact CG2-CD1 4.29Å; V105-V121 HydrophobicContact CG1-CG2 4.28Å; V105-V121 HydrophobicContact CG2-CG2 4.45Å; V105-Y215 HydrophobicContact CB-CE2 4.16Å; V105-Y215 HydrophobicContact CG1-CE2 3.83Å; V105-I231 HydrophobicContact CB-CD1 4.45Å; V105-I231 HydrophobicContact CG2-CD1 3.81Å; V105-I234 HydrophobicContact CG1-CD1 3.68Å
106	S	96.6	Very high	96.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-62.3	-35.7	176.9	71.2	0	0	0	0	112.5	F102 S103 L109 S110 L144 A146	F102-S106 WeakPolarHBondContact O-CB 3.45Å; F102-S106 PolarHBondContact O-N 3.05Å; F102-S106 PolarHBondContact O-OG 3.4Å; S103-S106 PolarHBondContact O-OG 3.48Å; S106-L109 PolarHBondContact O-N 3.04Å; S106-S110 WeakPolarHBondContact O-CB 3.22Å; S106-S110 PolarHBondContact O-N 3.47Å; S106-L144 VanDerWaalsContact CB-O 3.31Å; S106-L144 WeakPolarHBondContact CB-O 3.22Å; S106-A146 PolarHBondContact OG-N 2.95Å
107	R	96.7	Very high	96.3	Very high	63 Å²	63	45 Å²	45	24%	0.238	23%	0.23	C	C	.	.	H	α-helix	trans	-64	-44.6	171.4	-165.4	-171.1	-57.6	124.8	-5.8	112	S103 H104 V105 S110 R111 E147	S103-R107 WeakPolarHBondContact O-CB 3.44Å; S103-R107 PolarHBondContact O-N 2.72Å; H104-R107 WeakPolarHBondContact O-CB 3.23Å; H104-R107 PolarHBondContact O-N 3.45Å; V105-R107 VanDerWaalsContact C-N 3.28Å; V105-R107 PolarHBondContact O-N 2.94Å; R107-S110 PolarHBondContact O-N 3.08Å; R107-S110 PolarHBondContact O-OG 3.37Å; R107-R111 WeakPolarHBondContact O-CG 3.47Å; R107-R111 PolarHBondContact O-N 2.87Å; R107-E147 IonicContact CZ-OE1 3.58Å; R107-E147 IonicContact CZ-OE2 2.72Å; R107-E147 IonicContact NE-OE1 2.66Å; R107-E147 PolarHBondContact NE-OE1 2.84Å; R107-E147 IonicContact NE-OE2 2.79Å; R107-E147 VanDerWaalsContact NH2-CD 3.26Å; R107-E147 IonicContact NH2-OE1 3.72Å; R107-E147 PolarHBondContact NH2-OE1 3.29Å; R107-E147 IonicContact NH2-OE2 2.78Å; R107-E147 PolarHBondContact NH2-OE2 3.08Å
108	L	96.9	Very high	96.2	Very high	16 Å²	16	48.5 Å²	48.5	8%	0.084	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-42.9	176.1	-67.3	177	0	0	0	112	H104 V105 R111 C112 Q113 A116 L117	H104-L108 PolarHBondContact O-N 2.83Å; H104-L108 VanDerWaalsContact O-N 3.1Å; V105-L108 PolarHBondContact O-N 3.22Å; V105-L108 VanDerWaalsContact O-N 3.12Å; L108-R111 CarbonylContact O-C 3.5Å; L108-R111 PolarHBondContact O-N 2.82Å; L108-R111 VanDerWaalsContact O-N 3.15Å; L108-C112 PolarHBondContact O-N 2.74Å; L108-C112 VanDerWaalsContact O-N 3.08Å; L108-Q113 HydrophobicContact CB-CB 4.48Å; L108-Q113 HydrophobicContact CD2-CB 4.02Å; L108-Q113 PolarHBondContact O-N 2.73Å; L108-A116 HydrophobicContact CD1-CB 3.81Å; L108-A116 WeakPolarHBondContact CD1-O 3.25Å; L108-A116 HydrophobicContact CD2-CB 3.85Å; L108-A116 HydrophobicContact CG-CB 4.44Å; L108-L117 HydrophobicContact CB-CD2 3.89Å; L108-L117 HydrophobicContact CD1-CD2 3.76Å
109	L	95.5	Very high	95.9	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61	-43.7	175.4	-70.3	172.9	0	0	0	112	V105 S106 R111 C112 F114 L117 L129 L144 I234	V105-L109 HydrophobicContact CG1-CD1 3.98Å; V105-L109 HydrophobicContact CG1-CG 4.27Å; V105-L109 WeakPolarHBondContact O-CG 3.42Å; V105-L109 PolarHBondContact O-N 3.37Å; S106-L109 PolarHBondContact O-N 3.04Å; L109-R111 PolarHBondContact O-N 2.95Å; L109-R111 VanDerWaalsContact O-N 3.11Å; L109-C112 PolarHBondContact O-N 2.73Å; L109-F114 HydrophobicContact CD2-CD1 4.43Å; L109-F114 HydrophobicContact CD2-CE1 4.05Å; L109-L117 HydrophobicContact CD2-CD1 3.81Å; L109-L129 HydrophobicContact CD2-CB 4.16Å; L109-L129 HydrophobicContact CD2-CD1 4.14Å; L109-L129 HydrophobicContact CD2-CD2 4.3Å; L109-L129 HydrophobicContact CD2-CG 4.44Å; L109-L144 HydrophobicContact CB-CD1 4.14Å; L109-I234 HydrophobicContact CD1-CD1 4.13Å; L109-I234 HydrophobicContact CD1-CG2 4.16Å
110	S	94.7	Very high	95.8	Very high	16 Å²	16	52.8 Å²	52.8	11%	0.112	28%	0.276	C	S	.	.	H	α-helix	trans	-61.5	-20.8	177.2	77.9	0	0	0	0	114.3	S106 R107 Q141	S106-S110 WeakPolarHBondContact O-CB 3.22Å; S106-S110 PolarHBondContact O-N 3.47Å; R107-S110 PolarHBondContact O-N 3.08Å; R107-S110 PolarHBondContact O-OG 3.37Å; S110-Q141 VanDerWaalsContact CA-O 3.25Å; S110-Q141 WeakPolarHBondContact CA-O 3.39Å; S110-Q141 WeakPolarHBondContact CB-O 3.35Å
111	R	94.4	Very high	95.8	Very high	157 Å²	157	46.8 Å²	46.8	59%	0.592	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.7	1.8	179	-63.6	174.9	-177.9	-171	-0.2	113.1	R107 L108 L109 Q113	R107-R111 WeakPolarHBondContact O-CG 3.47Å; R107-R111 PolarHBondContact O-N 2.87Å; L108-R111 CarbonylContact O-C 3.5Å; L108-R111 PolarHBondContact O-N 2.82Å; L108-R111 VanDerWaalsContact O-N 3.15Å; L109-R111 PolarHBondContact O-N 2.95Å; L109-R111 VanDerWaalsContact O-N 3.11Å; R111-Q113 HydrophobicContact CB-CG 3.79Å; R111-Q113 VanDerWaalsContact CD-OE1 3.26Å; R111-Q113 PolarHBondContact O-N 2.94Å
112	C	92.9	Very high	95.8	Very high	44 Å²	44	46 Å²	46	30%	0.297	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	35.3	-174.6	-61.2	0	0	0	0	113.8	L108 L109 F114	L108-C112 PolarHBondContact O-N 2.74Å; L108-C112 VanDerWaalsContact O-N 3.08Å; L109-C112 PolarHBondContact O-N 2.73Å; C112-F114 HydrophobicContact CB-CD2 4.49Å; C112-F114 HydrophobicContact CB-CE2 3.58Å; C112-F114 HydrophobicContact CB-CZ 3.77Å; C112-F114 WeakPolarHBondContact O-CD2 3.32Å; C112-F114 WeakPolarHBondContact O-CE2 3.3Å; C112-F114 PolarHBondContact O-N 2.71Å
113	Q	94.9	Very high	95.6	Very high	86 Å²	86	53.4 Å²	53.4	40%	0.402	27%	0.274	S	S	.	.			trans	-91.1	67	-179	-64.5	-173.3	-80.2	0	0	111.1	L108 R111 E115 A116	L108-Q113 HydrophobicContact CB-CB 4.48Å; L108-Q113 HydrophobicContact CD2-CB 4.02Å; L108-Q113 PolarHBondContact O-N 2.73Å; R111-Q113 HydrophobicContact CB-CG 3.79Å; R111-Q113 VanDerWaalsContact CD-OE1 3.26Å; R111-Q113 PolarHBondContact O-N 2.94Å; Q113-E115 PolarHBondContact O-N 3.12Å; Q113-A116 HydrophobicContact CB-CB 4.49Å; Q113-A116 PolarHBondContact O-N 2.89Å
114	F	94.9	Very high	95.4	Very high	24 Å²	24	58.1 Å²	58.1	11%	0.105	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-68.4	-33.4	-171.6	-54.3	-67.4	0	0	0	114.2	L109 C112 A116 L117 I126 L129 E130 C133	L109-F114 HydrophobicContact CD2-CD1 4.43Å; L109-F114 HydrophobicContact CD2-CE1 4.05Å; C112-F114 HydrophobicContact CB-CD2 4.49Å; C112-F114 HydrophobicContact CB-CE2 3.58Å; C112-F114 HydrophobicContact CB-CZ 3.77Å; C112-F114 WeakPolarHBondContact O-CD2 3.32Å; C112-F114 WeakPolarHBondContact O-CE2 3.3Å; C112-F114 PolarHBondContact O-N 2.71Å; F114-A116 PolarHBondContact O-N 2.91Å; F114-L117 HydrophobicContact CD1-CD1 3.97Å; F114-L117 VanDerWaalsContact O-CB 3.25Å; F114-L117 WeakPolarHBondContact O-CB 3.43Å; F114-L117 PolarHBondContact O-N 3.29Å; F114-I126 HydrophobicContact CB-CG2 4.02Å; F114-L129 HydrophobicContact CE1-CB 4.46Å; F114-E130 HydrophobicContact CD1-CB 4.33Å; F114-E130 HydrophobicContact CD2-CB 3.95Å; F114-E130 HydrophobicContact CD2-CG 3.79Å; F114-E130 HydrophobicContact CE1-CB 4.44Å; F114-E130 HydrophobicContact CE2-CB 4.06Å; F114-E130 HydrophobicContact CE2-CG 3.85Å; F114-E130 HydrophobicContact CG-CB 4.11Å; F114-E130 HydrophobicContact CG-CG 4.43Å; F114-E130 HydrophobicContact CZ-CB 4.34Å; F114-C133 HydrophobicContact CE1-CB 4.1Å; F114-C133 HydrophobicContact CZ-CB 3.67Å
115	E	95.5	Very high	95.3	Very high	164 Å²	164	55 Å²	55	77%	0.766	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-56	-35.2	173.9	-55.7	-60.7	158.2	0	0	112.3	Q113 L117 E118	Q113-E115 PolarHBondContact O-N 3.12Å; E115-L117 PolarHBondContact O-N 2.74Å; E115-E118 PolarHBondContact O-N 2.84Å
116	A	96.1	Very high	95.2	Very high	47 Å²	47	55.9 Å²	55.9	39%	0.388	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-77.9	-0.4	178.9	0	0	0	0	0	113.6	L108 Q113 F114	L108-A116 HydrophobicContact CD1-CB 3.81Å; L108-A116 WeakPolarHBondContact CD1-O 3.25Å; L108-A116 HydrophobicContact CD2-CB 3.85Å; L108-A116 HydrophobicContact CG-CB 4.44Å; Q113-A116 HydrophobicContact CB-CB 4.49Å; Q113-A116 PolarHBondContact O-N 2.89Å; F114-A116 PolarHBondContact O-N 2.91Å
117	L	95.9	Very high	95	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-90	-11.3	171.8	-57.6	177.3	0	0	0	112.5	V105 L108 L109 F114 E115 G119 L120 V121 I126	V105-L117 HydrophobicContact CB-CD2 4.41Å; V105-L117 HydrophobicContact CG1-CD2 3.88Å; V105-L117 HydrophobicContact CG2-CD2 4.25Å; L108-L117 HydrophobicContact CB-CD2 3.89Å; L108-L117 HydrophobicContact CD1-CD2 3.76Å; L109-L117 HydrophobicContact CD2-CD1 3.81Å; F114-L117 HydrophobicContact CD1-CD1 3.97Å; F114-L117 VanDerWaalsContact O-CB 3.25Å; F114-L117 WeakPolarHBondContact O-CB 3.43Å; F114-L117 PolarHBondContact O-N 3.29Å; E115-L117 PolarHBondContact O-N 2.74Å; L117-G119 PolarHBondContact O-N 2.8Å; L117-L120 PolarHBondContact O-N 2.99Å; L117-V121 HydrophobicContact CB-CB 4.19Å; L117-V121 HydrophobicContact CB-CG2 3.94Å; L117-V121 HydrophobicContact CD2-CG2 4.08Å; L117-V121 HydrophobicContact CG-CG2 4.42Å; L117-V121 PolarHBondContact O-N 2.97Å; L117-I126 HydrophobicContact CB-CD1 3.98Å; L117-I126 HydrophobicContact CB-CG1 4.11Å
118	E	94.5	Very high	94.8	Very high	110 Å²	110	59.9 Å²	59.9	51%	0.514	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-57.7	133.3	175.8	-72.1	-142.9	121.7	0	0	111.1	E115 L120 K123 I126	E115-E118 PolarHBondContact O-N 2.84Å; E118-L120 PolarHBondContact O-N 3.19Å; E118-K123 IonicContact OE1-NZ 3.4Å; E118-I126 HydrophobicContact CG-CD1 4.4Å
119	G	92.3	Very high	94.7	Very high	62 Å²	62	59.3 Å²	59.3	64%	0.639	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	-18.3	-175.6	0	0	0	0	0	115.1	L117	L117-G119 PolarHBondContact O-N 2.8Å
120	L	95.5	Very high	94.6	Very high	68 Å²	68	64.7 Å²	64.7	36%	0.356	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-35.1	174.2	-58.5	-179.6	0	0	0	112.5	V105 L117 E118 I231	V105-L120 HydrophobicContact CG2-CB 4.47Å; V105-L120 HydrophobicContact CG2-CD1 4.29Å; L117-L120 PolarHBondContact O-N 2.99Å; E118-L120 PolarHBondContact O-N 3.19Å; L120-I231 PolarHBondContact O-N 3.4Å
121	V	97	Very high	94.4	Very high	3 Å²	3	71.3 Å²	71.3	2%	0.018	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-123.1	144.6	-174.2	-173.5	0	0	0	0	109.8	V105 L117 K123 L125 I126 L129 I231 I234	V105-V121 HydrophobicContact CG1-CG2 4.28Å; V105-V121 HydrophobicContact CG2-CG2 4.45Å; L117-V121 HydrophobicContact CB-CB 4.19Å; L117-V121 HydrophobicContact CB-CG2 3.94Å; L117-V121 HydrophobicContact CD2-CG2 4.08Å; L117-V121 HydrophobicContact CG-CG2 4.42Å; L117-V121 PolarHBondContact O-N 2.97Å; V121-K123 PolarHBondContact O-N 2.75Å; V121-L125 HydrophobicContact CG1-CB 4.11Å; V121-L125 HydrophobicContact CG1-CD2 3.76Å; V121-L125 HydrophobicContact CG1-CG 4.01Å; V121-I126 HydrophobicContact CB-CD1 4.4Å; V121-I126 HydrophobicContact CB-CG1 4.01Å; V121-I126 HydrophobicContact CG1-CG1 4.08Å; V121-L129 HydrophobicContact CG1-CD1 4.2Å; V121-I231 WeakPolarHBondContact CA-O 3.46Å; V121-I231 HydrophobicContact CG2-CB 4.31Å; V121-I231 HydrophobicContact CG2-CD1 4.4Å; V121-I234 HydrophobicContact CG2-CD1 4.4Å
122	A	96.2	Very high	94.2	Very high	17 Å²	17	67.3 Å²	67.3	14%	0.14	36%	0.358	C	S	.	.			trans	-58.6	133.8	176.2	0	0	0	0	0	111.4	D124 L125 I126 T230 I231 T232	A122-D124 VanDerWaalsContact C-N 3.29Å; A122-D124 PolarHBondContact O-N 3.04Å; A122-L125 HydrophobicContact CB-CB 4.4Å; A122-L125 WeakPolarHBondContact O-CA 3.26Å; A122-L125 WeakPolarHBondContact O-CB 3.36Å; A122-L125 PolarHBondContact O-N 3.17Å; A122-I126 PolarHBondContact O-N 2.94Å; A122-T230 HydrophobicContact CB-CG2 4.28Å; A122-I231 PolarHBondContact N-O 2.79Å; A122-T232 HydrophobicContact CB-CG2 4.42Å
123	K	94.6	Very high	94	Very high	155 Å²	155	65.2 Å²	65.2	67%	0.674	34%	0.344	S	S	*	.	H	α-helix	trans	-59.1	-35.7	-171.2	-66.8	-167.5	171.5	-153.9	0	113.9	E118 V121 L125 I126	E118-K123 IonicContact OE1-NZ 3.4Å; V121-K123 PolarHBondContact O-N 2.75Å; K123-L125 VanDerWaalsContact C-N 3.26Å; K123-L125 PolarHBondContact O-N 3.48Å; K123-I126 PolarHBondContact O-N 2.98Å
124	D	93.1	Very high	93.6	Very high	102 Å²	102	64 Å²	64	55%	0.545	36%	0.355	S	S	.	.	H	α-helix	trans	-71.8	-21	177.5	76.2	-67.1	0	0	0	113	A122 K128	A122-D124 VanDerWaalsContact C-N 3.29Å; A122-D124 PolarHBondContact O-N 3.04Å; D124-K128 WeakPolarHBondContact O-CD 3.1Å; D124-K128 WeakPolarHBondContact O-CE 3.2Å; D124-K128 WeakPolarHBondContact O-CG 3.27Å; D124-K128 PolarHBondContact O-NZ 3.33Å; D124-K128 IonicContact OD2-NZ 2.64Å; D124-K128 PolarHBondContact OD2-NZ 3.3Å
125	L	95	Very high	93.3	Very high	19 Å²	19	67.4 Å²	67.4	10%	0.099	38%	0.382	C	S	.	.	H	α-helix	trans	-84	-33.8	175.5	-179.5	60.9	0	0	0	111.7	V121 A122 K123 G127 K128 L129 I234	V121-L125 HydrophobicContact CG1-CB 4.11Å; V121-L125 HydrophobicContact CG1-CD2 3.76Å; V121-L125 HydrophobicContact CG1-CG 4.01Å; A122-L125 HydrophobicContact CB-CB 4.4Å; A122-L125 WeakPolarHBondContact O-CA 3.26Å; A122-L125 WeakPolarHBondContact O-CB 3.36Å; A122-L125 PolarHBondContact O-N 3.17Å; K123-L125 VanDerWaalsContact C-N 3.26Å; K123-L125 PolarHBondContact O-N 3.48Å; L125-G127 PolarHBondContact O-N 3.22Å; L125-K128 HydrophobicContact CD1-CB 4.48Å; L125-K128 HydrophobicContact CD1-CD 4.41Å; L125-K128 WeakPolarHBondContact O-CB 3.31Å; L125-K128 PolarHBondContact O-N 3.22Å; L125-K128 VanDerWaalsContact O-N 3.14Å; L125-L129 HydrophobicContact CD1-CD1 4.27Å; L125-L129 HydrophobicContact CD1-CG 4.13Å; L125-L129 HydrophobicContact CD2-CD1 4.28Å; L125-L129 HydrophobicContact CG-CD1 3.74Å; L125-L129 HydrophobicContact CG-CG 4.12Å; L125-L129 WeakPolarHBondContact O-CG 3.34Å; L125-L129 PolarHBondContact O-N 3.41Å; L125-I234 HydrophobicContact CD2-CB 4.4Å; L125-I234 HydrophobicContact CD2-CG1 4.15Å
126	I	95.8	Very high	92.9	Very high	20 Å²	20	61.1 Å²	61.1	10%	0.103	35%	0.353	C	S	.	.	H	α-helix	trans	-55.5	-49.9	178.6	-63.4	175.6	0	0	0	111.2	F114 L117 E118 V121 A122 K123 K128 L129 E130	F114-I126 HydrophobicContact CB-CG2 4.02Å; L117-I126 HydrophobicContact CB-CD1 3.98Å; L117-I126 HydrophobicContact CB-CG1 4.11Å; E118-I126 HydrophobicContact CG-CD1 4.4Å; V121-I126 HydrophobicContact CB-CD1 4.4Å; V121-I126 HydrophobicContact CB-CG1 4.01Å; V121-I126 HydrophobicContact CG1-CG1 4.08Å; A122-I126 PolarHBondContact O-N 2.94Å; K123-I126 PolarHBondContact O-N 2.98Å; I126-K128 VanDerWaalsContact C-N 3.31Å; I126-K128 PolarHBondContact O-N 3Å; I126-L129 WeakPolarHBondContact O-CB 3.49Å; I126-L129 PolarHBondContact O-N 3.37Å; I126-L129 VanDerWaalsContact O-N 3.11Å; I126-E130 PolarHBondContact O-N 3.11Å
127	G	93.3	Very high	92.5	Very high	41 Å²	41	62.4 Å²	62.4	42%	0.423	36%	0.357	S	S	.	.	H	α-helix	trans	-64.1	-31.7	178.7	0	0	0	0	0	114.2	L125 Q131	L125-G127 PolarHBondContact O-N 3.22Å; G127-Q131 PolarHBondContact O-N 3.28Å
128	K	92.9	Very high	92	Very high	106 Å²	106	65.3 Å²	65.3	46%	0.461	38%	0.377	S	S	.	.	H	α-helix	trans	-69	-39.3	173.4	-62.4	165.9	-168.2	155.9	0	111	D124 L125 I126 K132	D124-K128 WeakPolarHBondContact O-CD 3.1Å; D124-K128 WeakPolarHBondContact O-CE 3.2Å; D124-K128 WeakPolarHBondContact O-CG 3.27Å; D124-K128 PolarHBondContact O-NZ 3.33Å; D124-K128 IonicContact OD2-NZ 2.64Å; D124-K128 PolarHBondContact OD2-NZ 3.3Å; L125-K128 HydrophobicContact CD1-CB 4.48Å; L125-K128 HydrophobicContact CD1-CD 4.41Å; L125-K128 WeakPolarHBondContact O-CB 3.31Å; L125-K128 PolarHBondContact O-N 3.22Å; L125-K128 VanDerWaalsContact O-N 3.14Å; I126-K128 VanDerWaalsContact C-N 3.31Å; I126-K128 PolarHBondContact O-N 3Å; K128-K132 WeakPolarHBondContact O-CG 3.41Å; K128-K132 PolarHBondContact O-N 3.12Å
129	L	93.9	Very high	91.6	Very high	4 Å²	4	62.1 Å²	62.1	2%	0.021	37%	0.367	C	S	.	.	H	α-helix	trans	-68.8	-39.8	177.6	-70.6	165.5	0	0	0	111.7	L109 F114 V121 L125 I126 K132 C133 I234 L240	L109-L129 HydrophobicContact CD2-CB 4.16Å; L109-L129 HydrophobicContact CD2-CD1 4.14Å; L109-L129 HydrophobicContact CD2-CD2 4.3Å; L109-L129 HydrophobicContact CD2-CG 4.44Å; F114-L129 HydrophobicContact CE1-CB 4.46Å; V121-L129 HydrophobicContact CG1-CD1 4.2Å; L125-L129 HydrophobicContact CD1-CD1 4.27Å; L125-L129 HydrophobicContact CD1-CG 4.13Å; L125-L129 HydrophobicContact CD2-CD1 4.28Å; L125-L129 HydrophobicContact CG-CD1 3.74Å; L125-L129 HydrophobicContact CG-CG 4.12Å; L125-L129 WeakPolarHBondContact O-CG 3.34Å; L125-L129 PolarHBondContact O-N 3.41Å; I126-L129 WeakPolarHBondContact O-CB 3.49Å; I126-L129 PolarHBondContact O-N 3.37Å; I126-L129 VanDerWaalsContact O-N 3.11Å; L129-K132 PolarHBondContact O-N 3.35Å; L129-C133 WeakPolarHBondContact O-CB 3.41Å; L129-C133 PolarHBondContact O-N 2.85Å; L129-C133 PolarHBondContact O-SG 2.99Å; L129-I234 HydrophobicContact CD1-CD1 3.97Å; L129-I234 HydrophobicContact CD2-CB 4.26Å; L129-I234 HydrophobicContact CD2-CG2 4.2Å; L129-L240 HydrophobicContact CD2-CD1 4.45Å
130	E	93.3	Very high	91.4	Very high	114 Å²	114	60 Å²	60	53%	0.533	34%	0.34	S	S	.	.	H	α-helix	trans	-57.5	-50.7	173.8	-177.8	177.2	-165.4	0	0	111.3	F114 I126 K132 G134	F114-E130 HydrophobicContact CD1-CB 4.33Å; F114-E130 HydrophobicContact CD2-CB 3.95Å; F114-E130 HydrophobicContact CD2-CG 3.79Å; F114-E130 HydrophobicContact CE1-CB 4.44Å; F114-E130 HydrophobicContact CE2-CB 4.06Å; F114-E130 HydrophobicContact CE2-CG 3.85Å; F114-E130 HydrophobicContact CG-CB 4.11Å; F114-E130 HydrophobicContact CG-CG 4.43Å; F114-E130 HydrophobicContact CZ-CB 4.34Å; I126-E130 PolarHBondContact O-N 3.11Å; E130-K132 PolarHBondContact O-N 3.28Å; E130-G134 PolarHBondContact O-N 3.49Å
131	Q	90.8	Very high	91.1	Very high	155 Å²	155	58.3 Å²	58.3	72%	0.724	33%	0.33	S	S	*	.	H	α-helix	trans	-59.9	-47.2	176.9	-172.1	-175	9.4	0	0	112.2	G127 S135	G127-Q131 PolarHBondContact O-N 3.28Å; Q131-S135 PolarHBondContact O-N 2.87Å
132	K	89.9	Confident	90.8	Very high	73 Å²	73	65.5 Å²	65.5	32%	0.317	36%	0.357	S	S	.	.	H	α-helix	trans	-64.2	-56.4	-179.8	-76.4	-167	175.8	-152.8	0	111.5	K128 L129 E130 G134 S135 L136 L240 D241	K128-K132 WeakPolarHBondContact O-CG 3.41Å; K128-K132 PolarHBondContact O-N 3.12Å; L129-K132 PolarHBondContact O-N 3.35Å; E130-K132 PolarHBondContact O-N 3.28Å; K132-G134 VanDerWaalsContact C-N 3.3Å; K132-G134 PolarHBondContact O-N 2.9Å; K132-S135 PolarHBondContact O-N 2.88Å; K132-S135 VanDerWaalsContact O-N 3.08Å; K132-S135 PolarHBondContact O-OG 2.86Å; K132-L136 PolarHBondContact O-N 3.31Å; K132-L240 HydrophobicContact CB-CD2 3.85Å; K132-L240 PolarHBondContact NZ-O 3.07Å; K132-D241 PolarHBondContact NZ-O 3.07Å; K132-D241 PolarHBondContact NZ-OXT 3.45Å
133	C	89.4	Confident	90.6	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-60	-37.5	180	-73.4	0	0	0	0	112.7	F114 L129 S135 L136 Q141	F114-C133 HydrophobicContact CE1-CB 4.1Å; F114-C133 HydrophobicContact CZ-CB 3.67Å; L129-C133 WeakPolarHBondContact O-CB 3.41Å; L129-C133 PolarHBondContact O-N 2.85Å; L129-C133 PolarHBondContact O-SG 2.99Å; C133-S135 PolarHBondContact O-N 2.95Å; C133-L136 PolarHBondContact O-N 2.82Å; C133-L136 VanDerWaalsContact O-N 3.11Å; C133-Q141 PolarHBondContact O-NE2 2.88Å
134	G	86.6	Confident	90.5	Very high	60 Å²	60	57.3 Å²	57.3	62%	0.619	32%	0.318	S	S	*	.	H	α-helix	trans	-62.9	-24.3	176.4	0	0	0	0	0	114.2	E130 K132	E130-G134 PolarHBondContact O-N 3.49Å; K132-G134 VanDerWaalsContact C-N 3.3Å; K132-G134 PolarHBondContact O-N 2.9Å
135	S	87.5	Confident	90.5	Very high	96 Å²	96	54.2 Å²	54.2	67%	0.671	30%	0.303	S	S	*	.	H	α-helix	trans	-88	-11.9	174.7	71	0	0	0	0	114.6	Q131 K132 C133	Q131-S135 PolarHBondContact O-N 2.87Å; K132-S135 PolarHBondContact O-N 2.88Å; K132-S135 VanDerWaalsContact O-N 3.08Å; K132-S135 PolarHBondContact O-OG 2.86Å; C133-S135 PolarHBondContact O-N 2.95Å
136	L	86.6	Confident	90.5	Very high	32 Å²	32	53.3 Å²	53.3	17%	0.168	30%	0.299	C	S	.	.	S	Bend	trans	-79.1	142.5	-176.9	-72.6	-179.3	0	0	0	113	K132 C133 Q141 L144 L239 L240	K132-L136 PolarHBondContact O-N 3.31Å; C133-L136 PolarHBondContact O-N 2.82Å; C133-L136 VanDerWaalsContact O-N 3.11Å; L136-Q141 HydrophobicContact CB-CG 3.82Å; L136-Q141 PolarHBondContact O-NE2 2.88Å; L136-L144 HydrophobicContact CD1-CD1 4.49Å; L136-L239 WeakPolarHBondContact CD1-O 3.35Å; L136-L239 WeakPolarHBondContact CD2-O 3.47Å; L136-L240 HydrophobicContact CD1-CD2 3.68Å; L136-L240 HydrophobicContact CD1-CG 4.36Å
137	P	87.8	Confident	90.3	Very high	73 Å²	73	55.3 Å²	55.3	47%	0.474	31%	0.308	S	S	.	.			trans	-59.9	147.7	166.4	-19.3	30.8	0	0	0	111.5	S139 Y140 Q141	P137-S139 PolarHBondContact O-N 2.9Å; P137-Y140 HydrophobicContact CB-CD2 3.98Å; P137-Y140 HydrophobicContact CG-CD2 3.94Å; P137-Y140 HydrophobicContact CG-CE2 4.43Å; P137-Y140 WeakPolarHBondContact O-CA 3.26Å; P137-Y140 WeakPolarHBondContact O-CB 3.43Å; P137-Y140 PolarHBondContact O-N 3.23Å; P137-Q141 PolarHBondContact O-N 3.39Å; P137-Q141 VanDerWaalsContact O-N 3.07Å
138	C	86.9	Confident	90.2	Very high	62 Å²	62	54.8 Å²	54.8	42%	0.419	30%	0.297	S	S	.	.	H	α-helix	trans	-59.4	-26.3	-175.4	-168.4	0	0	0	0	114.2	R142	C138-R142 VanDerWaalsContact O-CG 3.26Å; C138-R142 WeakPolarHBondContact O-CG 3.34Å; C138-R142 PolarHBondContact O-N 3.38Å; C138-R142 VanDerWaalsContact O-N 3.09Å; C138-R142 PolarHBondContact SG-NE 3.17Å; C138-R142 VanDerWaalsContact SG-NE 3.44Å; C138-R142 PolarHBondContact SG-NH2 2.87Å
139	S	85.8	Confident	90.1	Very high	42 Å²	42	54.9 Å²	54.9	29%	0.294	30%	0.299	S	S	.	.	H	α-helix	trans	-66.1	-43.5	170.5	46.3	0	0	0	0	112.4	P137 R142 A143 V183	P137-S139 PolarHBondContact O-N 2.9Å; S139-R142 PolarHBondContact O-N 3.27Å; S139-A143 WeakPolarHBondContact O-CB 3.41Å; S139-A143 PolarHBondContact O-N 3.03Å; S139-V183 WeakPolarHBondContact O-CG1 3.48Å
140	Y	86.9	Confident	89.9	Confident	18 Å²	18	56.6 Å²	56.6	7%	0.071	31%	0.308	C	S	.	.	H	α-helix	trans	-66.1	-41.7	177.9	-75	-111.2	0	0	0	111.1	P137 A143 L144 L185 P186 I189 M190 L239	P137-Y140 HydrophobicContact CB-CD2 3.98Å; P137-Y140 HydrophobicContact CG-CD2 3.94Å; P137-Y140 HydrophobicContact CG-CE2 4.43Å; P137-Y140 WeakPolarHBondContact O-CA 3.26Å; P137-Y140 WeakPolarHBondContact O-CB 3.43Å; P137-Y140 PolarHBondContact O-N 3.23Å; Y140-A143 PolarHBondContact O-N 2.91Å; Y140-L144 PolarHBondContact O-N 3.29Å; Y140-L185 HydrophobicContact CD1-CD2 4.28Å; Y140-L185 HydrophobicContact CD2-CD2 3.8Å; Y140-L185 HydrophobicContact CE1-CD2 4.37Å; Y140-L185 HydrophobicContact CE2-CD2 3.92Å; Y140-L185 HydrophobicContact CG-CD2 3.97Å; Y140-P186 HydrophobicContact CE2-CG 4.46Å; Y140-P186 WeakPolarHBondContact OH-CD 3.33Å; Y140-I189 HydrophobicContact CE1-CG2 4.29Å; Y140-I189 VanDerWaalsContact OH-CD1 3.31Å; Y140-I189 WeakPolarHBondContact OH-CD1 3.44Å; Y140-M190 HydrophobicContact CE1-SD 4.42Å; Y140-L239 HydrophobicContact CD1-CD2 3.41Å; Y140-L239 VanDerWaalsContact CD1-CD2 3.41Å; Y140-L239 HydrophobicContact CE1-CD2 4Å; Y140-L239 HydrophobicContact CG-CD2 4.23Å
141	Q	90.3	Very high	89.9	Confident	32 Å²	32	51.7 Å²	51.7	15%	0.15	29%	0.286	C	S	.	.	H	α-helix	trans	-57.3	-50.2	172.6	-65.7	173.4	-16.1	0	0	111.6	S110 C133 L136 P137 A143 L144	S110-Q141 VanDerWaalsContact CA-O 3.25Å; S110-Q141 WeakPolarHBondContact CA-O 3.39Å; S110-Q141 WeakPolarHBondContact CB-O 3.35Å; C133-Q141 PolarHBondContact O-NE2 2.88Å; L136-Q141 HydrophobicContact CB-CG 3.82Å; L136-Q141 PolarHBondContact O-NE2 2.88Å; P137-Q141 PolarHBondContact O-N 3.39Å; P137-Q141 VanDerWaalsContact O-N 3.07Å; Q141-A143 VanDerWaalsContact C-N 3.27Å; Q141-A143 PolarHBondContact O-N 2.96Å; Q141-L144 VanDerWaalsContact O-CB 3.27Å; Q141-L144 WeakPolarHBondContact O-CB 3.41Å; Q141-L144 WeakPolarHBondContact O-CG 3.43Å; Q141-L144 PolarHBondContact O-N 2.81Å; Q141-L144 VanDerWaalsContact O-N 3.09Å
142	R	91.1	Very high	89.8	Confident	155 Å²	155	46.9 Å²	46.9	59%	0.585	26%	0.264	S	S	*	.	H	α-helix	trans	-61.7	-34.8	177.9	-70.7	172.5	-160.4	170.3	5.5	112.8	C138 S139 L144 C145 V183	C138-R142 VanDerWaalsContact O-CG 3.26Å; C138-R142 WeakPolarHBondContact O-CG 3.34Å; C138-R142 PolarHBondContact O-N 3.38Å; C138-R142 VanDerWaalsContact O-N 3.09Å; C138-R142 PolarHBondContact SG-NE 3.17Å; C138-R142 VanDerWaalsContact SG-NE 3.44Å; C138-R142 PolarHBondContact SG-NH2 2.87Å; S139-R142 PolarHBondContact O-N 3.27Å; R142-L144 PolarHBondContact O-N 3.15Å; R142-C145 WeakPolarHBondContact O-CB 3.44Å; R142-C145 PolarHBondContact O-N 2.88Å; R142-C145 VanDerWaalsContact O-N 3.14Å; R142-V183 HydrophobicContact CB-CG2 4.02Å
143	A	90.8	Very high	89.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-69.2	-12.5	177.6	0	0	0	0	0	114.1	S139 Y140 Q141 C145 Y179 T181 V183 L185 L211 L239	S139-A143 WeakPolarHBondContact O-CB 3.41Å; S139-A143 PolarHBondContact O-N 3.03Å; Y140-A143 PolarHBondContact O-N 2.91Å; Q141-A143 VanDerWaalsContact C-N 3.27Å; Q141-A143 PolarHBondContact O-N 2.96Å; A143-C145 VanDerWaalsContact C-N 3.31Å; A143-Y179 WeakPolarHBondContact O-CE2 3.39Å; A143-Y179 PolarHBondContact O-OH 3.33Å; A143-T181 HydrophobicContact CB-CG2 4.27Å; A143-V183 HydrophobicContact CB-CB 4.15Å; A143-V183 HydrophobicContact CB-CG1 4.44Å; A143-V183 HydrophobicContact CB-CG2 4.45Å; A143-L185 HydrophobicContact CB-CD1 3.65Å; A143-L185 HydrophobicContact CB-CD2 3.97Å; A143-L185 HydrophobicContact CB-CG 4.06Å; A143-L211 HydrophobicContact CB-CD1 4.25Å; A143-L211 WeakPolarHBondContact O-CD1 3.42Å; A143-L239 HydrophobicContact CB-CD1 4.22Å
144	L	92.5	Very high	89.9	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-32.9	168.9	-60.4	172.3	0	0	0	111.9	S106 L109 L136 Y140 Q141 R142 A146 H236 L239 L240	S106-L144 VanDerWaalsContact CB-O 3.31Å; S106-L144 WeakPolarHBondContact CB-O 3.22Å; L109-L144 HydrophobicContact CB-CD1 4.14Å; L136-L144 HydrophobicContact CD1-CD1 4.49Å; Y140-L144 PolarHBondContact O-N 3.29Å; Q141-L144 VanDerWaalsContact O-CB 3.27Å; Q141-L144 WeakPolarHBondContact O-CB 3.41Å; Q141-L144 WeakPolarHBondContact O-CG 3.43Å; Q141-L144 PolarHBondContact O-N 2.81Å; Q141-L144 VanDerWaalsContact O-N 3.09Å; R142-L144 PolarHBondContact O-N 3.15Å; L144-A146 PolarHBondContact O-N 2.94Å; L144-H236 HydrophobicContact CD2-CB 3.86Å; L144-H236 WeakPolarHBondContact CD2-ND1 3.34Å; L144-L239 HydrophobicContact CD2-CB 3.91Å; L144-L239 HydrophobicContact CD2-CD1 3.74Å; L144-L239 HydrophobicContact CD2-CG 4.5Å; L144-L239 HydrophobicContact CG-CD1 4.48Å; L144-L240 HydrophobicContact CD1-CD1 4.03Å; L144-L240 HydrophobicContact CD2-CD1 3.6Å; L144-L240 HydrophobicContact CD2-CG 3.9Å; L144-L240 HydrophobicContact CG-CD1 4.5Å
145	C	94.3	Very high	90	Very high	36 Å²	36	50.1 Å²	50.1	24%	0.243	26%	0.264	C	S	.	.			trans	-64.2	122.6	-173.7	-167.4	0	0	0	0	110.9	R142 A143	R142-C145 WeakPolarHBondContact O-CB 3.44Å; R142-C145 PolarHBondContact O-N 2.88Å; R142-C145 VanDerWaalsContact O-N 3.14Å; A143-C145 VanDerWaalsContact C-N 3.31Å
146	A	93.7	Very high	90.1	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.244	C	C	.	.			trans	-127.6	122.3	174.8	0	0	0	0	0	109.7	F102 S103 S106 L144 Y179	F102-A146 HydrophobicContact CD1-CB 4.43Å; F102-A146 HydrophobicContact CE1-CB 3.4Å; F102-A146 VanDerWaalsContact CE1-CB 3.4Å; F102-A146 HydrophobicContact CZ-CB 3.66Å; S103-A146 VanDerWaalsContact CA-O 3.25Å; S103-A146 WeakPolarHBondContact CA-O 3.31Å; S103-A146 VanDerWaalsContact CB-O 3.31Å; S103-A146 WeakPolarHBondContact CB-O 3.47Å; S106-A146 PolarHBondContact OG-N 2.95Å; L144-A146 PolarHBondContact O-N 2.94Å; A146-Y179 HydrophobicContact CB-CD1 4.5Å; A146-Y179 HydrophobicContact CB-CD2 3.46Å; A146-Y179 VanDerWaalsContact CB-CD2 3.46Å; A146-Y179 HydrophobicContact CB-CE2 3.98Å; A146-Y179 HydrophobicContact CB-CG 3.75Å
147	E	92.8	Very high	90.1	Very high	62 Å²	62	47.1 Å²	47.1	29%	0.29	25%	0.248	S	C	.	.			trans	-84.1	153.8	169.3	-66.4	-60.9	151.7	0	0	110.1	R107 E149 D150 V151	R107-E147 IonicContact CZ-OE1 3.58Å; R107-E147 IonicContact CZ-OE2 2.72Å; R107-E147 IonicContact NE-OE1 2.66Å; R107-E147 PolarHBondContact NE-OE1 2.84Å; R107-E147 IonicContact NE-OE2 2.79Å; R107-E147 VanDerWaalsContact NH2-CD 3.26Å; R107-E147 IonicContact NH2-OE1 3.72Å; R107-E147 PolarHBondContact NH2-OE1 3.29Å; R107-E147 IonicContact NH2-OE2 2.78Å; R107-E147 PolarHBondContact NH2-OE2 3.08Å; E147-E149 PolarHBondContact O-N 2.69Å; E147-D150 PolarHBondContact O-N 3.33Å; E147-V151 PolarHBondContact O-N 3.49Å
148	P	91.1	Very high	90.2	Very high	31 Å²	31	46.7 Å²	46.7	20%	0.201	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-22	-178.8	-23.2	32.7	0	0	0	113.8	K99	K99-P148 WeakPolarHBondContact CE-O 3.32Å; K99-P148 PolarHBondContact NZ-O 3.03Å
149	E	90.4	Very high	90.5	Very high	108 Å²	108	43.9 Å²	43.9	51%	0.505	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-31.6	178.8	-67.2	60.5	-128.5	0	0	113.6	K57 E147 M152	K57-E149 VanDerWaalsContact NZ-CA 3.34Å; K57-E149 PolarHBondContact NZ-O 3.15Å; E147-E149 PolarHBondContact O-N 2.69Å; E149-M152 WeakPolarHBondContact O-CE 3.45Å
150	D	89.5	Confident	90.9	Very high	39 Å²	39	43 Å²	43	21%	0.209	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-15.4	179.2	-75.6	-57.4	0	0	0	112.3	E147 M152 Y179 L180 K208	E147-D150 PolarHBondContact O-N 3.33Å; D150-M152 VanDerWaalsContact O-CE 3.32Å; D150-M152 WeakPolarHBondContact O-CE 3.16Å; D150-M152 PolarHBondContact O-N 3.37Å; D150-M152 VanDerWaalsContact O-N 3.16Å; D150-Y179 CarbonylContact O-C 3.55Å; D150-Y179 VanDerWaalsContact O-CA 3.31Å; D150-Y179 WeakPolarHBondContact O-CA 3.42Å; D150-L180 HydrophobicContact CB-CB 4.47Å; D150-L180 PolarHBondContact O-N 2.88Å; D150-K208 IonicContact OD1-NZ 2.71Å; D150-K208 PolarHBondContact OD1-NZ 2.98Å
151	V	92.1	Very high	91.3	Very high	11 Å²	11	44.1 Å²	44.1	7%	0.067	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	105.6	169.2	-179.2	0	0	0	0	109.7	K99 F102 E147 T154 F177	K99-V151 HydrophobicContact CG-CG1 4.36Å; F102-V151 HydrophobicContact CD1-CG2 3.98Å; F102-V151 HydrophobicContact CE1-CG2 3.74Å; E147-V151 PolarHBondContact O-N 3.49Å; V151-T154 HydrophobicContact CG1-CG2 3.63Å; V151-F177 HydrophobicContact CG1-CD1 4.42Å
152	M	89.9	Confident	91.4	Very high	54 Å²	54	46.4 Å²	46.4	27%	0.266	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-36.1	-178	-64	-66	112.3	0	0	112.6	E149 D150 W178 L180 L210	E149-M152 WeakPolarHBondContact O-CE 3.45Å; D150-M152 VanDerWaalsContact O-CE 3.32Å; D150-M152 WeakPolarHBondContact O-CE 3.16Å; D150-M152 PolarHBondContact O-N 3.37Å; D150-M152 VanDerWaalsContact O-N 3.16Å; M152-W178 PolarHBondContact N-O 3.29Å; M152-L180 HydrophobicContact CE-CD1 3.8Å; M152-L180 HydrophobicContact CE-CG 4.2Å; M152-L180 HydrophobicContact CG-CD1 4.01Å; M152-L180 HydrophobicContact CG-CD2 4.4Å; M152-L180 HydrophobicContact CG-CG 3.77Å; M152-L180 HydrophobicContact SD-CD1 3.85Å; M152-L180 HydrophobicContact SD-CG 4.28Å; M152-L210 HydrophobicContact CG-CD1 4.45Å
153	Y	88.3	Confident	91.5	Very high	101 Å²	101	45.6 Å²	45.6	40%	0.396	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	146.6	-177.3	-175.3	-124.3	0	0	0	110.8	V62 M155 W178	V62-Y153 HydrophobicContact CG2-CD1 4.4Å; Y153-M155 HydrophobicContact CE1-CB 3.89Å; Y153-W178 AromaticContact CD1-CD2 3.99Å; Y153-W178 HydrophobicContact CD1-CD2 3.99Å; Y153-W178 AromaticContact CD1-CE3 3.41Å; Y153-W178 HydrophobicContact CD1-CE3 3.41Å; Y153-W178 VanDerWaalsContact CD1-CE3 3.41Å; Y153-W178 AromaticContact CD1-CH2 3.82Å; Y153-W178 HydrophobicContact CD1-CH2 3.82Å; Y153-W178 HydrophobicContact CD1-CZ2 4.39Å; Y153-W178 AromaticContact CD1-CZ3 3.33Å; Y153-W178 HydrophobicContact CD1-CZ3 3.33Å; Y153-W178 HydrophobicContact CE1-CE3 4.14Å; Y153-W178 AromaticContact CE1-CH2 3.74Å; Y153-W178 HydrophobicContact CE1-CH2 3.74Å; Y153-W178 AromaticContact CE1-CZ3 3.56Å; Y153-W178 HydrophobicContact CE1-CZ3 3.56Å; Y153-W178 HydrophobicContact CG-CE3 4.17Å; Y153-W178 HydrophobicContact CG-CZ3 4.35Å; Y153-W178 PolarHBondContact N-O 3.29Å; Y153-W178 PolarHBondContact O-N 3.14Å
154	T	92.2	Very high	91.6	Very high	29 Å²	29	47.4 Å²	47.4	18%	0.178	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	144.5	172.1	57.2	0	0	0	0	108.7	T95 K99 V151 R176 F177	T95-T154 WeakPolarHBondContact CG2-OG1 3.36Å; K99-T154 HydrophobicContact CG-CG2 4.43Å; V151-T154 HydrophobicContact CG1-CG2 3.63Å; T154-R176 WeakPolarHBondContact CA-O 3.43Å; T154-F177 HydrophobicContact CG2-CD1 3.6Å; T154-F177 HydrophobicContact CG2-CE1 3.87Å
155	M	89.3	Confident	91.6	Very high	72 Å²	72	55.8 Å²	55.8	36%	0.355	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	122.5	176.7	-171.4	-176.5	76.3	0	0	108.8	Y153 G157 R176 W178	Y153-M155 HydrophobicContact CE1-CB 3.89Å; M155-G157 PolarHBondContact O-N 3.11Å; M155-R176 PolarHBondContact N-O 3.34Å; M155-R176 PolarHBondContact O-N 3.24Å; M155-W178 HydrophobicContact CB-CH2 3.63Å; M155-W178 HydrophobicContact CB-CZ3 3.44Å; M155-W178 VanDerWaalsContact CB-CZ3 3.44Å; M155-W178 HydrophobicContact CE-CH2 3.99Å; M155-W178 HydrophobicContact CG-CH2 4.46Å; M155-W178 HydrophobicContact SD-CH2 4.06Å
156	P	90.3	Very high	91.4	Very high	41 Å²	41	60.6 Å²	60.6	27%	0.266	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	134.6	166.6	29.2	-33.3	0	0	0	109.7	Y78 I91 M175	Y78-P156 WeakPolarHBondContact OH-CB 3.42Å; Y78-P156 VanDerWaalsContact OH-CG 3.27Å; Y78-P156 WeakPolarHBondContact OH-CG 3.43Å; I91-P156 HydrophobicContact CD1-CB 4.3Å; P156-M175 VanDerWaalsContact CA-SD 3.56Å; P156-M175 HydrophobicContact CB-SD 3.72Å
157	G	86.3	Confident	91.2	Very high	23 Å²	23	62.8 Å²	62.8	24%	0.237	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-131.9	177.8	0	0	0	0	0	111.5	M155 L174	M155-G157 PolarHBondContact O-N 3.11Å; G157-L174 PolarHBondContact N-O 3.22Å
158	D	89.3	Confident	91.2	Very high	65 Å²	65	64.5 Å²	64.5	35%	0.348	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	155.2	178.3	-144.5	-6.5	0	0	0	112.3	R73 L174	R73-D158 IonicContact CZ-OD1 3.35Å; R73-D158 IonicContact CZ-OD2 2.84Å; R73-D158 IonicContact NE-OD1 3.92Å; R73-D158 IonicContact NH1-OD2 3.98Å; R73-D158 IonicContact NH2-OD1 3.06Å; R73-D158 PolarHBondContact NH2-OD1 2.72Å; R73-D158 IonicContact NH2-OD2 2.8Å; R73-D158 PolarHBondContact NH2-OD2 3.39Å; D158-L174 HydrophobicContact CB-CD1 4.06Å; D158-L174 PolarHBondContact O-N 3.45Å
159	V	94.1	Very high	91.4	Very high	3 Å²	3	67.2 Å²	67.2	2%	0.018	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	116.2	178.6	-179.5	0	0	0	0	108.8	T74 Y77 Y78 I81 V171 S172 I173	T74-V159 HydrophobicContact CG2-CG2 4.13Å; Y77-V159 HydrophobicContact CD1-CG1 4.37Å; Y77-V159 HydrophobicContact CD2-CB 4.25Å; Y77-V159 HydrophobicContact CG-CB 4.01Å; Y77-V159 HydrophobicContact CG-CG1 4.09Å; Y78-V159 HydrophobicContact CD1-CG2 4.35Å; Y78-V159 HydrophobicContact CE1-CG2 3.68Å; I81-V159 HydrophobicContact CD1-CG1 3.79Å; V159-V171 HydrophobicContact CG1-CG1 4.4Å; V159-S172 CarbonylContact C-O 3.52Å; V159-S172 WeakPolarHBondContact CA-O 3.19Å; V159-I173 HydrophobicContact CG1-CG1 4.25Å; V159-I173 HydrophobicContact CG2-CG1 4.36Å; V159-I173 HydrophobicContact CG2-CG2 4.37Å
160	G	93.4	Very high	91.6	Very high	24 Å²	24	62.7 Å²	62.7	25%	0.247	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	138.4	172.4	0	0	0	0	0	111	V171 S172	G160-V171 CarbonylContact O-C 3.57Å; G160-V171 WeakPolarHBondContact O-CA 3.18Å; G160-S172 PolarHBondContact N-O 2.91Å; G160-S172 PolarHBondContact O-N 3.06Å
161	I	94.8	Very high	92	Very high	40 Å²	40	60.9 Å²	60.9	21%	0.205	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	119.2	160.9	-56.6	-177.1	0	0	0	105.8	Y77 L80 I81 F85 Y163 F170 V171	Y77-I161 HydrophobicContact CD1-CD1 3.8Å; Y77-I161 HydrophobicContact CD1-CG1 3.97Å; Y77-I161 HydrophobicContact CE1-CD1 4.32Å; Y77-I161 HydrophobicContact CE1-CG1 4.25Å; L80-I161 HydrophobicContact CB-CD1 4.06Å; I81-I161 HydrophobicContact CG1-CD1 4.16Å; F85-I161 HydrophobicContact CE1-CG2 4.45Å; F85-I161 HydrophobicContact CE2-CD1 4.08Å; F85-I161 HydrophobicContact CE2-CG2 3.87Å; F85-I161 HydrophobicContact CZ-CG2 3.54Å; I161-Y163 HydrophobicContact CG2-CE2 4.32Å; I161-F170 WeakPolarHBondContact CA-O 3.26Å; I161-V171 HydrophobicContact CG1-CG2 4.36Å
162	F	93.6	Very high	92.2	Very high	81 Å²	81	61 Å²	61	36%	0.355	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	158.1	-177.4	67.6	-89.2	0	0	0	112.5	F170	F162-F170 HydrophobicContact CD1-CB 3.85Å; F162-F170 HydrophobicContact CD2-CB 3.96Å; F162-F170 AromaticContact CD2-CD2 3.75Å; F162-F170 HydrophobicContact CD2-CD2 3.75Å; F162-F170 HydrophobicContact CD2-CG 4.22Å; F162-F170 HydrophobicContact CE1-CB 3.44Å; F162-F170 VanDerWaalsContact CE1-CB 3.44Å; F162-F170 HydrophobicContact CE1-CG 4.27Å; F162-F170 HydrophobicContact CE2-CB 3.56Å; F162-F170 AromaticContact CE2-CD2 3.28Å; F162-F170 HydrophobicContact CE2-CD2 3.28Å; F162-F170 HydrophobicContact CE2-CE2 4.12Å; F162-F170 AromaticContact CE2-CG 3.56Å; F162-F170 HydrophobicContact CE2-CG 3.56Å; F162-F170 HydrophobicContact CG-CB 4.1Å; F162-F170 HydrophobicContact CZ-CB 3.29Å; F162-F170 HydrophobicContact CZ-CD1 4.4Å; F162-F170 AromaticContact CZ-CD2 3.86Å; F162-F170 HydrophobicContact CZ-CD2 3.86Å; F162-F170 AromaticContact CZ-CG 3.6Å; F162-F170 HydrophobicContact CZ-CG 3.6Å; F162-F170 PolarHBondContact N-O 2.88Å; F162-F170 PolarHBondContact O-N 3.17Å
163	Y	93.4	Very high	92.5	Very high	138 Å²	138	58.4 Å²	58.4	54%	0.541	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	139.6	179.3	-58.4	-98.3	0	0	0	106.4	I161 R168 K169	I161-Y163 HydrophobicContact CG2-CE2 4.32Å; Y163-R168 WeakPolarHBondContact CA-O 3.36Å; Y163-K169 HydrophobicContact CD1-CB 4.43Å; Y163-K169 HydrophobicContact CD1-CD 4.32Å; Y163-K169 HydrophobicContact CD1-CG 3.81Å; Y163-K169 HydrophobicContact CE1-CB 4.39Å; Y163-K169 HydrophobicContact CE1-CD 3.81Å; Y163-K169 HydrophobicContact CE1-CG 3.79Å
164	D	92.3	Very high	92.9	Very high	37 Å²	37	55.1 Å²	55.1	20%	0.198	29%	0.294	C	S	.	.			trans	-99	175.6	171.3	70.1	1.9	0	0	0	111.7	D166 G167 R168	D164-D166 PolarHBondContact O-N 2.96Å; D164-D166 PolarHBondContact OD1-N 3.1Å; D164-G167 PolarHBondContact O-N 3.09Å; D164-G167 PolarHBondContact OD1-N 3.35Å; D164-G167 VanDerWaalsContact OD1-N 3.1Å; D164-R168 PolarHBondContact N-O 3.07Å; D164-R168 WeakPolarHBondContact OD1-CA 3.3Å; D164-R168 VanDerWaalsContact OD1-CB 3.31Å; D164-R168 WeakPolarHBondContact OD1-CB 3.48Å; D164-R168 PolarHBondContact OD1-N 3.33Å; D164-R168 IonicContact OD1-NE 3.97Å; D164-R168 IonicContact OD2-CZ 3.1Å; D164-R168 IonicContact OD2-NE 2.72Å; D164-R168 PolarHBondContact OD2-NE 3.25Å; D164-R168 IonicContact OD2-NH2 2.71Å; D164-R168 PolarHBondContact OD2-NH2 2.89Å
165	D	91.6	Very high	93.1	Very high	176 Å²	176	53.8 Å²	53.8	94%	0.941	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-22.6	-178.5	-60.4	-46.5	0	0	0	112.6	G167	D165-G167 PolarHBondContact O-N 3.09Å
166	D	90.8	Very high	93.3	Very high	137 Å²	137	54.2 Å²	54.2	73%	0.733	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-3.9	173.2	-62.6	-50.7	0	0	0	112.8	D164 R168	D164-D166 PolarHBondContact O-N 2.96Å; D164-D166 PolarHBondContact OD1-N 3.1Å; D166-R168 VanDerWaalsContact C-N 3.3Å; D166-R168 HydrophobicContact CB-CG 4.41Å; D166-R168 PolarHBondContact O-N 3.3Å
167	G	89.6	Confident	93.6	Very high	47 Å²	47	52.2 Å²	52.2	49%	0.485	27%	0.271	S	S	.	.			trans	77.5	11	-179.8	0	0	0	0	0	114.5	D164 D165	D164-G167 PolarHBondContact O-N 3.09Å; D164-G167 PolarHBondContact OD1-N 3.35Å; D164-G167 VanDerWaalsContact OD1-N 3.1Å; D165-G167 PolarHBondContact O-N 3.09Å
168	R	93.8	Very high	93.9	Very high	98 Å²	98	53.2 Å²	53.2	37%	0.37	27%	0.267	S	S	.	.			trans	-67.9	156.8	170.2	-60.7	-176.1	-65	162.5	-2.3	109.8	Y163 D164 D166 F170 E220 T222	Y163-R168 WeakPolarHBondContact CA-O 3.36Å; D164-R168 PolarHBondContact N-O 3.07Å; D164-R168 WeakPolarHBondContact OD1-CA 3.3Å; D164-R168 VanDerWaalsContact OD1-CB 3.31Å; D164-R168 WeakPolarHBondContact OD1-CB 3.48Å; D164-R168 PolarHBondContact OD1-N 3.33Å; D164-R168 IonicContact OD1-NE 3.97Å; D164-R168 IonicContact OD2-CZ 3.1Å; D164-R168 IonicContact OD2-NE 2.72Å; D164-R168 PolarHBondContact OD2-NE 3.25Å; D164-R168 IonicContact OD2-NH2 2.71Å; D164-R168 PolarHBondContact OD2-NH2 2.89Å; D166-R168 VanDerWaalsContact C-N 3.3Å; D166-R168 HydrophobicContact CB-CG 4.41Å; D166-R168 PolarHBondContact O-N 3.3Å; R168-F170 HydrophobicContact CB-CE2 3.58Å; R168-F170 HydrophobicContact CB-CZ 3.82Å; R168-E220 VanDerWaalsContact CD-OE1 3.26Å; R168-E220 WeakPolarHBondContact CD-OE1 3.17Å; R168-E220 WeakPolarHBondContact CG-OE1 3.49Å; R168-E220 IonicContact NH1-OE2 3.9Å; R168-T222 WeakPolarHBondContact CA-OG1 3.17Å; R168-T222 WeakPolarHBondContact CB-OG1 3.09Å; R168-T222 HydrophobicContact CG-CG2 4.42Å
169	K	94.3	Very high	94	Very high	87 Å²	87	50.2 Å²	50.2	38%	0.378	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	126.6	-171	-50.4	-174.1	-179.4	-177.9	0	110.6	F85 Y163 E220 F221 T222	F85-K169 HydrophobicContact CE1-CB 4.08Å; F85-K169 HydrophobicContact CE1-CD 4.18Å; Y163-K169 HydrophobicContact CD1-CB 4.43Å; Y163-K169 HydrophobicContact CD1-CD 4.32Å; Y163-K169 HydrophobicContact CD1-CG 3.81Å; Y163-K169 HydrophobicContact CE1-CB 4.39Å; Y163-K169 HydrophobicContact CE1-CD 3.81Å; Y163-K169 HydrophobicContact CE1-CG 3.79Å; K169-E220 CarbonylContact O-C 3.45Å; K169-E220 WeakPolarHBondContact O-CA 3.31Å; K169-F221 HydrophobicContact CB-CB 4.38Å; K169-F221 PolarHBondContact O-N 2.72Å; K169-T222 PolarHBondContact N-OG1 3.12Å
170	F	95.8	Very high	93.8	Very high	14 Å²	14	50.5 Å²	50.5	6%	0.061	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	141.8	-175.9	-58.6	-84	0	0	0	111	I161 F162 R168 Q218 R219 E220	I161-F170 WeakPolarHBondContact CA-O 3.26Å; F162-F170 HydrophobicContact CD1-CB 3.85Å; F162-F170 HydrophobicContact CD2-CB 3.96Å; F162-F170 AromaticContact CD2-CD2 3.75Å; F162-F170 HydrophobicContact CD2-CD2 3.75Å; F162-F170 HydrophobicContact CD2-CG 4.22Å; F162-F170 HydrophobicContact CE1-CB 3.44Å; F162-F170 VanDerWaalsContact CE1-CB 3.44Å; F162-F170 HydrophobicContact CE1-CG 4.27Å; F162-F170 HydrophobicContact CE2-CB 3.56Å; F162-F170 AromaticContact CE2-CD2 3.28Å; F162-F170 HydrophobicContact CE2-CD2 3.28Å; F162-F170 HydrophobicContact CE2-CE2 4.12Å; F162-F170 AromaticContact CE2-CG 3.56Å; F162-F170 HydrophobicContact CE2-CG 3.56Å; F162-F170 HydrophobicContact CG-CB 4.1Å; F162-F170 HydrophobicContact CZ-CB 3.29Å; F162-F170 HydrophobicContact CZ-CD1 4.4Å; F162-F170 AromaticContact CZ-CD2 3.86Å; F162-F170 HydrophobicContact CZ-CD2 3.86Å; F162-F170 AromaticContact CZ-CG 3.6Å; F162-F170 HydrophobicContact CZ-CG 3.6Å; F162-F170 PolarHBondContact N-O 2.88Å; F162-F170 PolarHBondContact O-N 3.17Å; R168-F170 HydrophobicContact CB-CE2 3.58Å; R168-F170 HydrophobicContact CB-CZ 3.82Å; F170-Q218 HydrophobicContact CB-CG 4.37Å; F170-Q218 HydrophobicContact CD1-CG 4.31Å; F170-R219 WeakPolarHBondContact CA-O 3.42Å; F170-E220 HydrophobicContact CD1-CB 3.85Å; F170-E220 HydrophobicContact CD1-CG 3.96Å; F170-E220 HydrophobicContact CE1-CB 3.66Å; F170-E220 HydrophobicContact CE1-CG 3.52Å; F170-E220 VanDerWaalsContact CE1-OE2 3.27Å; F170-E220 WeakPolarHBondContact CE1-OE2 3.48Å; F170-E220 HydrophobicContact CZ-CG 4.01Å
171	V	96.8	Very high	93.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.3	164.3	179.7	0	0	0	0	107.1	I81 F85 V159 G160 I161 I173 Q218 R219 F221 W229	I81-V171 HydrophobicContact CD1-CG1 3.55Å; I81-V171 HydrophobicContact CG1-CG1 3.85Å; I81-V171 HydrophobicContact CG1-CG2 4.23Å; F85-V171 HydrophobicContact CD1-CG2 4.37Å; F85-V171 HydrophobicContact CG-CG2 4.32Å; V159-V171 HydrophobicContact CG1-CG1 4.4Å; G160-V171 CarbonylContact O-C 3.57Å; G160-V171 WeakPolarHBondContact O-CA 3.18Å; I161-V171 HydrophobicContact CG1-CG2 4.36Å; V171-I173 HydrophobicContact CG1-CG1 4.21Å; V171-Q218 CarbonylContact O-C 3.49Å; V171-Q218 VanDerWaalsContact O-CA 3.3Å; V171-Q218 WeakPolarHBondContact O-CA 3.43Å; V171-R219 PolarHBondContact N-O 2.93Å; V171-R219 PolarHBondContact O-N 2.83Å; V171-F221 HydrophobicContact CB-CD2 4.31Å; V171-F221 HydrophobicContact CB-CE2 3.83Å; V171-F221 HydrophobicContact CG2-CD2 3.76Å; V171-F221 HydrophobicContact CG2-CE2 3.56Å; V171-W229 HydrophobicContact CB-CH2 4.4Å; V171-W229 HydrophobicContact CG1-CH2 4.12Å
172	S	96.8	Very high	92.9	Very high	13 Å²	13	51.7 Å²	51.7	9%	0.091	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	140.8	168.4	63.4	0	0	0	0	110.5	V159 G160 F217	V159-S172 CarbonylContact C-O 3.52Å; V159-S172 WeakPolarHBondContact CA-O 3.19Å; G160-S172 PolarHBondContact N-O 2.91Å; G160-S172 PolarHBondContact O-N 3.06Å; S172-F217 CarbonylContact C-O 3.58Å; S172-F217 VanDerWaalsContact CA-O 3.28Å; S172-F217 WeakPolarHBondContact CA-O 3.25Å
173	I	96.8	Very high	92.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	118.6	175.6	-55.1	179.6	0	0	0	107.7	I81 F89 F94 V159 V171 M175 F217 W229	I81-I173 HydrophobicContact CD1-CD1 4.3Å; F89-I173 HydrophobicContact CE2-CD1 3.95Å; F89-I173 HydrophobicContact CZ-CD1 3.71Å; F94-I173 HydrophobicContact CD1-CD1 4.18Å; F94-I173 HydrophobicContact CD1-CG2 4.39Å; F94-I173 HydrophobicContact CD2-CD1 4.3Å; F94-I173 HydrophobicContact CE1-CB 3.87Å; F94-I173 HydrophobicContact CE1-CD1 3.92Å; F94-I173 HydrophobicContact CE1-CG1 4.48Å; F94-I173 HydrophobicContact CE1-CG2 3.54Å; F94-I173 HydrophobicContact CE2-CD1 4.04Å; F94-I173 HydrophobicContact CG-CD1 4.37Å; F94-I173 HydrophobicContact CZ-CB 3.71Å; F94-I173 HydrophobicContact CZ-CD1 3.85Å; F94-I173 HydrophobicContact CZ-CG1 4.26Å; F94-I173 HydrophobicContact CZ-CG2 3.95Å; V159-I173 HydrophobicContact CG1-CG1 4.25Å; V159-I173 HydrophobicContact CG2-CG1 4.36Å; V159-I173 HydrophobicContact CG2-CG2 4.37Å; V171-I173 HydrophobicContact CG1-CG1 4.21Å; I173-M175 HydrophobicContact CG2-SD 4.29Å; I173-F217 PolarHBondContact N-O 3.4Å; I173-F217 PolarHBondContact O-N 2.94Å; I173-W229 HydrophobicContact CD1-CH2 3.77Å; I173-W229 HydrophobicContact CD1-CZ3 4.29Å; I173-W229 HydrophobicContact CG1-CH2 4.16Å; I173-W229 HydrophobicContact CG1-CZ3 4.26Å
174	L	95.9	Very high	91.3	Very high	32 Å²	32	46.4 Å²	46.4	17%	0.168	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	135.1	169.5	-72.4	165.5	0	0	0	109.4	G157 D158 I214 E216	G157-L174 PolarHBondContact N-O 3.22Å; D158-L174 HydrophobicContact CB-CD1 4.06Å; D158-L174 PolarHBondContact O-N 3.45Å; L174-I214 HydrophobicContact CD2-CG2 4.03Å; L174-E216 HydrophobicContact CD2-CB 3.65Å; L174-E216 HydrophobicContact CD2-CG 3.88Å; L174-E216 HydrophobicContact CG-CG 4.33Å
175	M	96	Very high	90.4	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.2	173.4	-70.1	-62.3	-65.5	0	0	109.5	F94 T95 A98 P156 I173 F177 I214 Y215 F217	F94-M175 HydrophobicContact CD1-SD 4.34Å; F94-M175 HydrophobicContact CE1-CG 3.79Å; F94-M175 HydrophobicContact CE1-SD 3.78Å; F94-M175 HydrophobicContact CZ-CG 4.41Å; T95-M175 HydrophobicContact CG2-CE 3.87Å; A98-M175 HydrophobicContact CB-CE 4.41Å; A98-M175 HydrophobicContact CB-CG 3.99Å; P156-M175 VanDerWaalsContact CA-SD 3.56Å; P156-M175 HydrophobicContact CB-SD 3.72Å; I173-M175 HydrophobicContact CG2-SD 4.29Å; M175-F177 HydrophobicContact CB-CD2 4.46Å; M175-F177 HydrophobicContact CB-CE2 3.5Å; M175-F177 HydrophobicContact CB-CZ 3.6Å; M175-F177 HydrophobicContact CG-CZ 4.37Å; M175-I214 WeakPolarHBondContact O-CA 3.31Å; M175-Y215 PolarHBondContact N-O 2.88Å; M175-Y215 PolarHBondContact O-N 3.41Å; M175-F217 HydrophobicContact CB-CD2 4.27Å; M175-F217 HydrophobicContact CB-CE2 3.95Å; M175-F217 HydrophobicContact CG-CD2 3.94Å; M175-F217 HydrophobicContact CG-CE2 3.94Å
176	R	94.8	Very high	89.2	Confident	81 Å²	81	39.7 Å²	39.7	31%	0.306	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131	173	-171.3	176.5	-70.4	-92.5	5.5	109.8	T154 M155 W178 T212 A213 I214	T154-R176 WeakPolarHBondContact CA-O 3.43Å; M155-R176 PolarHBondContact N-O 3.34Å; M155-R176 PolarHBondContact O-N 3.24Å; R176-W178 HydrophobicContact CB-CH2 4.04Å; R176-W178 HydrophobicContact CB-CZ3 3.87Å; R176-W178 HydrophobicContact CG-CD2 4.3Å; R176-W178 HydrophobicContact CG-CE3 4.03Å; R176-W178 HydrophobicContact CG-CH2 3.7Å; R176-W178 HydrophobicContact CG-CZ2 3.91Å; R176-W178 HydrophobicContact CG-CZ3 3.71Å; R176-T212 HydrophobicContact CG-CG2 3.71Å; R176-A213 WeakPolarHBondContact CA-O 3.47Å; R176-I214 HydrophobicContact CG-CG1 4.44Å
177	F	94.9	Very high	87.8	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	132.4	-179.9	-57.9	-86.6	0	0	0	109.2	A98 K99 F102 V151 T154 M175 T212 A213 Y215 F217	A98-F177 HydrophobicContact CB-CZ 4.2Å; K99-F177 HydrophobicContact CB-CE1 4.26Å; F102-F177 HydrophobicContact CB-CD1 4.11Å; F102-F177 HydrophobicContact CB-CD2 4.18Å; F102-F177 HydrophobicContact CB-CE1 3.84Å; F102-F177 HydrophobicContact CB-CE2 3.89Å; F102-F177 HydrophobicContact CB-CG 4.29Å; F102-F177 HydrophobicContact CB-CZ 3.71Å; F102-F177 HydrophobicContact CD1-CB 4.13Å; F102-F177 AromaticContact CD1-CD1 3.75Å; F102-F177 HydrophobicContact CD1-CD1 3.75Å; F102-F177 HydrophobicContact CD1-CD2 4.38Å; F102-F177 HydrophobicContact CD1-CE1 4.31Å; F102-F177 AromaticContact CD1-CG 3.81Å; F102-F177 HydrophobicContact CD1-CG 3.81Å; F102-F177 HydrophobicContact CD2-CB 4.36Å; F102-F177 AromaticContact CD2-CD2 3.71Å; F102-F177 HydrophobicContact CD2-CD2 3.71Å; F102-F177 HydrophobicContact CD2-CE2 4.15Å; F102-F177 AromaticContact CD2-CG 3.93Å; F102-F177 HydrophobicContact CD2-CG 3.93Å; F102-F177 HydrophobicContact CE1-CB 3.93Å; F102-F177 HydrophobicContact CE1-CD1 4.36Å; F102-F177 HydrophobicContact CE1-CG 4.13Å; F102-F177 HydrophobicContact CE2-CB 4.2Å; F102-F177 HydrophobicContact CE2-CD2 4.25Å; F102-F177 HydrophobicContact CE2-CG 4.27Å; F102-F177 HydrophobicContact CG-CB 4.35Å; F102-F177 AromaticContact CG-CD1 3.84Å; F102-F177 HydrophobicContact CG-CD1 3.84Å; F102-F177 AromaticContact CG-CD2 3.8Å; F102-F177 HydrophobicContact CG-CD2 3.8Å; F102-F177 HydrophobicContact CG-CE1 4.11Å; F102-F177 HydrophobicContact CG-CE2 4.04Å; F102-F177 AromaticContact CG-CG 3.7Å; F102-F177 HydrophobicContact CG-CG 3.7Å; F102-F177 HydrophobicContact CG-CZ 4.19Å; F102-F177 HydrophobicContact CZ-CB 3.99Å; F102-F177 HydrophobicContact CZ-CG 4.37Å; V151-F177 HydrophobicContact CG1-CD1 4.42Å; T154-F177 HydrophobicContact CG2-CD1 3.6Å; T154-F177 HydrophobicContact CG2-CE1 3.87Å; M175-F177 HydrophobicContact CB-CD2 4.46Å; M175-F177 HydrophobicContact CB-CE2 3.5Å; M175-F177 HydrophobicContact CB-CZ 3.6Å; M175-F177 HydrophobicContact CG-CZ 4.37Å; F177-T212 CarbonylContact O-C 3.59Å; F177-T212 VanDerWaalsContact O-CA 3.31Å; F177-T212 WeakPolarHBondContact O-CA 3.12Å; F177-A213 PolarHBondContact N-O 3.02Å; F177-A213 PolarHBondContact O-N 3.44Å; F177-Y215 HydrophobicContact CD2-CD1 4.4Å; F177-Y215 HydrophobicContact CE2-CD1 4.47Å; F177-Y215 HydrophobicContact CE2-CG 4.35Å; F177-F217 HydrophobicContact CE2-CE2 4.34Å; F177-F217 HydrophobicContact CZ-CE2 4.29Å
178	W	92.4	Very high	86.2	Confident	44 Å²	44	44.3 Å²	44.3	17%	0.167	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	118.3	168.8	-66.3	-101.3	0	0	0	108.2	M152 Y153 M155 R176 L210 L211 T212	M152-W178 PolarHBondContact N-O 3.29Å; Y153-W178 AromaticContact CD1-CD2 3.99Å; Y153-W178 HydrophobicContact CD1-CD2 3.99Å; Y153-W178 AromaticContact CD1-CE3 3.41Å; Y153-W178 HydrophobicContact CD1-CE3 3.41Å; Y153-W178 VanDerWaalsContact CD1-CE3 3.41Å; Y153-W178 AromaticContact CD1-CH2 3.82Å; Y153-W178 HydrophobicContact CD1-CH2 3.82Å; Y153-W178 HydrophobicContact CD1-CZ2 4.39Å; Y153-W178 AromaticContact CD1-CZ3 3.33Å; Y153-W178 HydrophobicContact CD1-CZ3 3.33Å; Y153-W178 HydrophobicContact CE1-CE3 4.14Å; Y153-W178 AromaticContact CE1-CH2 3.74Å; Y153-W178 HydrophobicContact CE1-CH2 3.74Å; Y153-W178 AromaticContact CE1-CZ3 3.56Å; Y153-W178 HydrophobicContact CE1-CZ3 3.56Å; Y153-W178 HydrophobicContact CG-CE3 4.17Å; Y153-W178 HydrophobicContact CG-CZ3 4.35Å; Y153-W178 PolarHBondContact N-O 3.29Å; Y153-W178 PolarHBondContact O-N 3.14Å; M155-W178 HydrophobicContact CB-CH2 3.63Å; M155-W178 HydrophobicContact CB-CZ3 3.44Å; M155-W178 VanDerWaalsContact CB-CZ3 3.44Å; M155-W178 HydrophobicContact CE-CH2 3.99Å; M155-W178 HydrophobicContact CG-CH2 4.46Å; M155-W178 HydrophobicContact SD-CH2 4.06Å; R176-W178 HydrophobicContact CB-CH2 4.04Å; R176-W178 HydrophobicContact CB-CZ3 3.87Å; R176-W178 HydrophobicContact CG-CD2 4.3Å; R176-W178 HydrophobicContact CG-CE3 4.03Å; R176-W178 HydrophobicContact CG-CH2 3.7Å; R176-W178 HydrophobicContact CG-CZ2 3.91Å; R176-W178 HydrophobicContact CG-CZ3 3.71Å; W178-L210 HydrophobicContact CB-CD1 4.09Å; W178-L211 WeakPolarHBondContact CA-O 3.36Å; W178-T212 VanDerWaalsContact CD1-OG1 3.27Å
179	Y	92.4	Very high	84.2	Confident	1 Å²	1	44.7 Å²	44.7	0%	0.004	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	152.5	-171.8	68.1	-80.3	0	0	0	111.2	F102 A143 A146 D150 L211 A213 H236	F102-Y179 HydrophobicContact CE1-CD1 4.3Å; F102-Y179 HydrophobicContact CE1-CG 4.44Å; F102-Y179 AromaticContact CZ-CD1 3.7Å; F102-Y179 HydrophobicContact CZ-CD1 3.7Å; F102-Y179 AromaticContact CZ-CE1 3.91Å; F102-Y179 HydrophobicContact CZ-CE1 3.91Å; F102-Y179 HydrophobicContact CZ-CG 4.17Å; A143-Y179 WeakPolarHBondContact O-CE2 3.39Å; A143-Y179 PolarHBondContact O-OH 3.33Å; A146-Y179 HydrophobicContact CB-CD1 4.5Å; A146-Y179 HydrophobicContact CB-CD2 3.46Å; A146-Y179 VanDerWaalsContact CB-CD2 3.46Å; A146-Y179 HydrophobicContact CB-CE2 3.98Å; A146-Y179 HydrophobicContact CB-CG 3.75Å; D150-Y179 CarbonylContact O-C 3.55Å; D150-Y179 VanDerWaalsContact O-CA 3.31Å; D150-Y179 WeakPolarHBondContact O-CA 3.42Å; Y179-L211 HydrophobicContact CD1-CB 4.16Å; Y179-L211 HydrophobicContact CD2-CB 4.38Å; Y179-L211 HydrophobicContact CE1-CB 3.62Å; Y179-L211 HydrophobicContact CE2-CB 3.91Å; Y179-L211 HydrophobicContact CE2-CD1 3.78Å; Y179-L211 HydrophobicContact CE2-CG 4.45Å; Y179-L211 VanDerWaalsContact CZ-CB 3.49Å; Y179-L211 PolarHBondContact N-O 3.39Å; Y179-L211 PolarHBondContact O-N 3.37Å; Y179-L211 WeakPolarHBondContact OH-CD1 3.44Å; Y179-A213 HydrophobicContact CE1-CB 4.04Å; Y179-H236 AromaticContact CZ-ND1 3.86Å; Y179-H236 PolarHBondContact OH-ND1 3.13Å
180	L	89.8	Confident	82.2	Confident	10 Å²	10	40.7 Å²	40.7	5%	0.052	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	143.1	176.7	-65.1	-178.4	0	0	0	111.2	D150 M152 V198 K208 R209 L210	D150-L180 HydrophobicContact CB-CB 4.47Å; D150-L180 PolarHBondContact O-N 2.88Å; M152-L180 HydrophobicContact CE-CD1 3.8Å; M152-L180 HydrophobicContact CE-CG 4.2Å; M152-L180 HydrophobicContact CG-CD1 4.01Å; M152-L180 HydrophobicContact CG-CD2 4.4Å; M152-L180 HydrophobicContact CG-CG 3.77Å; M152-L180 HydrophobicContact SD-CD1 3.85Å; M152-L180 HydrophobicContact SD-CG 4.28Å; L180-V198 HydrophobicContact CD1-CG2 4.25Å; L180-K208 HydrophobicContact CB-CB 4.14Å; L180-K208 HydrophobicContact CB-CD 3.97Å; L180-K208 HydrophobicContact CD1-CB 4.18Å; L180-K208 HydrophobicContact CD1-CD 3.84Å; L180-K208 HydrophobicContact CD2-CB 4.26Å; L180-K208 HydrophobicContact CG-CB 4.43Å; L180-R209 CarbonylContact C-O 3.53Å; L180-R209 WeakPolarHBondContact CA-O 3.31Å; L180-L210 HydrophobicContact CD2-CB 4.04Å; L180-L210 HydrophobicContact CD2-CD1 3.78Å
181	T	86.8	Confident	79.7	Confident	9 Å²	9	47.5 Å²	47.5	6%	0.055	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	141.9	165.3	-171.2	0	0	0	0	110.6	A143 V183 K208 R209 L211	A143-T181 HydrophobicContact CB-CG2 4.27Å; T181-V183 VanDerWaalsContact C-N 3.35Å; T181-V183 PolarHBondContact OG1-N 2.71Å; T181-K208 CarbonylContact O-C 3.6Å; T181-K208 VanDerWaalsContact O-CA 3.31Å; T181-K208 WeakPolarHBondContact O-CA 3.39Å; T181-R209 HydrophobicContact CG2-CB 3.92Å; T181-R209 PolarHBondContact N-O 3.33Å; T181-R209 PolarHBondContact O-N 3.26Å; T181-L211 HydrophobicContact CG2-CD1 3.48Å; T181-L211 VanDerWaalsContact CG2-CD1 3.48Å; T181-L211 HydrophobicContact CG2-CG 4.05Å
182	S	83.3	Confident	77.5	Confident	79 Å²	79	51.3 Å²	51.3	55%	0.552	31%	0.306	S	S	*	.			trans	-91.1	2.8	171.8	53.7	0	0	0	0	113	G184	S182-G184 PolarHBondContact O-N 3.04Å
183	V	81.2	Confident	75.4	Confident	36 Å²	36	52 Å²	52	22%	0.218	31%	0.31	C	S	.	.	S	Bend	trans	-72.1	123.6	177.9	-178	0	0	0	0	109.9	S139 R142 A143 T181 L185	S139-V183 WeakPolarHBondContact O-CG1 3.48Å; R142-V183 HydrophobicContact CB-CG2 4.02Å; A143-V183 HydrophobicContact CB-CB 4.15Å; A143-V183 HydrophobicContact CB-CG1 4.44Å; A143-V183 HydrophobicContact CB-CG2 4.45Å; T181-V183 VanDerWaalsContact C-N 3.35Å; T181-V183 PolarHBondContact OG1-N 2.71Å; V183-L185 HydrophobicContact CG1-CD2 4.35Å; V183-L185 PolarHBondContact O-N 2.99Å
184	G	72.4	Confident	73.6	Confident	72 Å²	72	60.7 Å²	60.7	74%	0.742	34%	0.343	S	S	*	.			trans	-64.2	91.1	171.6	0	0	0	0	0	111.6	S182	S182-G184 PolarHBondContact O-N 3.04Å
185	L	72.4	Confident	71.7	Confident	11 Å²	11	63.4 Å²	63.4	6%	0.058	36%	0.356	C	S	.	.			trans	-89.5	139	170.7	-66.8	176.4	0	0	0	109.8	Y140 A143 V183 D187 M190 R209 L211 L239	Y140-L185 HydrophobicContact CD1-CD2 4.28Å; Y140-L185 HydrophobicContact CD2-CD2 3.8Å; Y140-L185 HydrophobicContact CE1-CD2 4.37Å; Y140-L185 HydrophobicContact CE2-CD2 3.92Å; Y140-L185 HydrophobicContact CG-CD2 3.97Å; A143-L185 HydrophobicContact CB-CD1 3.65Å; A143-L185 HydrophobicContact CB-CD2 3.97Å; A143-L185 HydrophobicContact CB-CG 4.06Å; V183-L185 HydrophobicContact CG1-CD2 4.35Å; V183-L185 PolarHBondContact O-N 2.99Å; L185-D187 PolarHBondContact O-N 3.22Å; L185-M190 HydrophobicContact CD1-SD 3.78Å; L185-R209 PolarHBondContact O-NH1 2.94Å; L185-L211 HydrophobicContact CD1-CD1 4.47Å; L185-L211 HydrophobicContact CD1-CD2 4.47Å; L185-L239 HydrophobicContact CD1-CD2 4.02Å
186	P	67.1	Low	69.8	Low	61 Å²	61	66.3 Å²	66.3	40%	0.396	37%	0.369	S	S	.	.			trans	-54	131.5	172.7	-23.9	32.3	0	0	0	112.2	Y140 D188 I189	Y140-P186 HydrophobicContact CE2-CG 4.46Å; Y140-P186 WeakPolarHBondContact OH-CD 3.33Å; P186-D188 VanDerWaalsContact C-N 3.3Å; P186-D188 PolarHBondContact O-N 3.43Å; P186-I189 HydrophobicContact CB-CD1 4.25Å; P186-I189 HydrophobicContact CG-CD1 4.47Å
187	D	61.3	Low	67.9	Low	116 Å²	116	66.7 Å²	66.7	62%	0.62	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-67.7	-31.9	179	-71.4	-34.4	0	0	0	113	L185 I189 R209	L185-D187 PolarHBondContact O-N 3.22Å; D187-I189 PolarHBondContact O-N 2.98Å; D187-R209 IonicContact OD1-CZ 3.48Å; D187-R209 IonicContact OD1-NH1 3.62Å; D187-R209 PolarHBondContact OD1-NH1 2.99Å; D187-R209 IonicContact OD1-NH2 3.54Å
188	D	56	Low	66.1	Low	165 Å²	165	67.8 Å²	67.8	88%	0.882	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-65.6	-4.4	-173.4	-155.3	30	0	0	0	115.2	P186	P186-D188 VanDerWaalsContact C-N 3.3Å; P186-D188 PolarHBondContact O-N 3.43Å
189	I	50.8	Low	64	Low	106 Å²	106	69.8 Å²	69.8	54%	0.544	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-116.5	-17.5	-171.1	-66.5	171.3	0	0	0	113.3	Y140 P186 D187	Y140-I189 HydrophobicContact CE1-CG2 4.29Å; Y140-I189 VanDerWaalsContact OH-CD1 3.31Å; Y140-I189 WeakPolarHBondContact OH-CD1 3.44Å; P186-I189 HydrophobicContact CB-CD1 4.25Å; P186-I189 HydrophobicContact CG-CD1 4.47Å; D187-I189 PolarHBondContact O-N 2.98Å
190	M	53	Low	62	Low	4 Å²	4	74.2 Å²	74.2	2%	0.02	43%	0.43	C	S	.	.			trans	-130.9	75.3	-170	-49.3	-179.7	71.8	0	0	112.7	Y140 L185 G192 T193 L211 S237 S238 L239	Y140-M190 HydrophobicContact CE1-SD 4.42Å; L185-M190 HydrophobicContact CD1-SD 3.78Å; M190-G192 PolarHBondContact O-N 3.19Å; M190-T193 WeakPolarHBondContact CB-OG1 3.27Å; M190-T193 PolarHBondContact O-N 3.38Å; M190-T193 PolarHBondContact O-OG1 3.02Å; M190-L211 HydrophobicContact CE-CD2 3.58Å; M190-L211 HydrophobicContact SD-CD2 4.43Å; M190-S237 VanDerWaalsContact CE-O 3.32Å; M190-S237 WeakPolarHBondContact CE-O 3.48Å; M190-S238 WeakPolarHBondContact CB-OG 3.5Å; M190-S238 WeakPolarHBondContact CE-OG 3.15Å; M190-L239 HydrophobicContact CE-CD2 3.6Å; M190-L239 HydrophobicContact CE-CG 3.82Å; M190-L239 HydrophobicContact SD-CD2 3.9Å
191	E	43.9	Very low	60.4	Low	156 Å²	156	76.1 Å²	76.1	73%	0.729	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	133.8	173.3	-107.5	-173	154.3	0	0	111.9	T193	E191-T193 PolarHBondContact O-N 3.45Å
192	G	48.9	Very low	58.4	Low	80 Å²	80	84.5 Å²	84.5	83%	0.825	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.1	-6.8	178.7	0	0	0	0	0	116	M190 R194	M190-G192 PolarHBondContact O-N 3.19Å; G192-R194 PolarHBondContact O-N 3.25Å
193	T	53.8	Low	56.9	Low	29 Å²	29	90.7 Å²	90.7	18%	0.178	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-76.1	117.3	174.9	-29.1	0	0	0	0	110.9	M190 E191 R209 L210 L211	M190-T193 WeakPolarHBondContact CB-OG1 3.27Å; M190-T193 PolarHBondContact O-N 3.38Å; M190-T193 PolarHBondContact O-OG1 3.02Å; E191-T193 PolarHBondContact O-N 3.45Å; T193-R209 HydrophobicContact CG2-CG 3.42Å; T193-R209 VanDerWaalsContact CG2-CG 3.42Å; T193-R209 PolarHBondContact OG1-NH2 2.78Å; T193-L210 WeakPolarHBondContact CG2-O 3.25Å; T193-L211 HydrophobicContact CG2-CD2 3.88Å
194	R	58.9	Low	55.6	Low	182 Å²	182	97.6 Å²	97.6	69%	0.687	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-84.8	125.5	177.4	-67.7	-178.9	-174.2	-175.7	1.4	110.5	G192 F196 L210	G192-R194 PolarHBondContact O-N 3.25Å; R194-F196 HydrophobicContact CB-CD2 4.12Å; R194-F196 HydrophobicContact CB-CE2 3.4Å; R194-F196 HydrophobicContact CB-CZ 3.72Å; R194-F196 WeakPolarHBondContact O-CD2 3.47Å; R194-L210 PolarHBondContact O-N 3.4Å; R194-L210 VanDerWaalsContact O-N 3.12Å
195	M	55.3	Low	54.8	Low	89 Å²	89	100.5 Å²	100.5	44%	0.438	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	128.5	165.2	-164.7	103.6	-51.4	0	0	108.7	A207 R209	M195-A207 HydrophobicContact SD-CB 4.21Å; M195-R209 HydrophobicContact CE-CB 3.41Å; M195-R209 VanDerWaalsContact CE-CB 3.41Å; M195-R209 HydrophobicContact CE-CG 3.54Å
196	F	56	Low	54.3	Low	61 Å²	61	104.8 Å²	104.8	27%	0.268	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.7	119.1	173.7	-67.9	-84	0	0	0	109.5	R194 V198 K208 L210	R194-F196 HydrophobicContact CB-CD2 4.12Å; R194-F196 HydrophobicContact CB-CE2 3.4Å; R194-F196 HydrophobicContact CB-CZ 3.72Å; R194-F196 WeakPolarHBondContact O-CD2 3.47Å; F196-V198 HydrophobicContact CB-CG2 4.23Å; F196-V198 PolarHBondContact O-N 3.04Å; F196-K208 CarbonylContact C-O 3.59Å; F196-K208 WeakPolarHBondContact CA-O 3.48Å; F196-K208 PolarHBondContact N-O 2.66Å; F196-K208 PolarHBondContact O-N 2.8Å; F196-L210 HydrophobicContact CD2-CB 3.68Å; F196-L210 HydrophobicContact CE2-CB 3.5Å; F196-L210 VanDerWaalsContact CE2-CB 3.5Å; F196-L210 HydrophobicContact CE2-CD2 3.66Å; F196-L210 HydrophobicContact CE2-CG 4.16Å; F196-L210 HydrophobicContact CZ-CD2 4.29Å
197	T	54.7	Low	54.4	Low	89 Å²	89	104.5 Å²	104.5	55%	0.546	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.8	106.4	173.9	-54.4	0	0	0	0	108.4	M205	T197-M205 HydrophobicContact CG2-CE 4.07Å; T197-M205 HydrophobicContact CG2-CG 3.09Å; T197-M205 HydrophobicContact CG2-SD 3.35Å; T197-M205 WeakPolarHBondContact CG2-SD 3.44Å
198	V	57.8	Low	55.3	Low	24 Å²	24	100 Å²	100	15%	0.145	53%	0.531	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	106.6	-173.6	-173.7	0	0	0	0	110	L180 F196 I200 E206 K208	L180-V198 HydrophobicContact CD1-CG2 4.25Å; F196-V198 HydrophobicContact CB-CG2 4.23Å; F196-V198 PolarHBondContact O-N 3.04Å; V198-I200 HydrophobicContact CG1-CD1 4.42Å; V198-I200 HydrophobicContact CG1-CG1 3.83Å; V198-I200 PolarHBondContact O-N 2.94Å; V198-E206 PolarHBondContact N-O 3.28Å; V198-K208 HydrophobicContact CG2-CB 4.25Å
199	S	49	Very low	56.6	Low	86 Å²	86	92.4 Å²	92.4	60%	0.601	49%	0.49	S	S	*	.			trans	-75.8	101.4	170.6	54.5	0	0	0	0	110.5	G201	S199-G201 PolarHBondContact O-N 3.35Å
200	I	48.8	Very low	58.3	Low	94 Å²	94	88.9 Å²	88.9	48%	0.482	47%	0.472	S	S	.	.			trans	-91.2	80.3	174.4	-53.8	-179	0	0	0	108.9	V198	V198-I200 HydrophobicContact CG1-CD1 4.42Å; V198-I200 HydrophobicContact CG1-CG1 3.83Å; V198-I200 PolarHBondContact O-N 2.94Å
201	G	56.8	Low	60	Low	50 Å²	50	88.8 Å²	88.8	52%	0.515	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	-150	179.9	0	0	0	0	0	113.9	S199 R203	S199-G201 PolarHBondContact O-N 3.35Å; G201-R203 PolarHBondContact O-N 3.14Å; G201-R203 VanDerWaalsContact O-N 3.09Å
202	D	45.2	Very low	62.3	Low	185 Å²	185	82.8 Å²	82.8	99%	0.989	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	8.5	177	-79.2	-20.6	0	0	0	114.1
203	R	51.3	Low	64.5	Low	209 Å²	209	79 Å²	79	79%	0.789	41%	0.407	S	S	*	.	S	Bend	trans	-92.7	159.9	178.3	-69.7	-167.3	-173.4	-176.9	6.2	112	G201	G201-R203 PolarHBondContact O-N 3.14Å; G201-R203 VanDerWaalsContact O-N 3.09Å
204	E	53.7	Low	66.5	Low	180 Å²	180	78.5 Å²	78.5	84%	0.841	40%	0.403	S	S	*	.			trans	-50.7	147.2	-177.2	-148.9	164.6	-152.7	0	0	112.3	E206	E204-E206 PolarHBondContact O-N 2.99Å
205	M	55.3	Low	68.3	Low	134 Å²	134	69.9 Å²	69.9	66%	0.66	37%	0.37	S	S	*	.			trans	-73.4	85.3	-168.4	179.9	173	-86.6	0	0	111.2	T197 A207	T197-M205 HydrophobicContact CG2-CE 4.07Å; T197-M205 HydrophobicContact CG2-CG 3.09Å; T197-M205 HydrophobicContact CG2-SD 3.35Å; T197-M205 WeakPolarHBondContact CG2-SD 3.44Å; M205-A207 PolarHBondContact O-N 3.44Å
206	E	63.1	Low	70.4	Confident	100 Å²	100	67.6 Å²	67.6	47%	0.467	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	117.3	179.5	-73.2	-172.8	-171.5	0	0	111.6	V198 E204 K208	V198-E206 PolarHBondContact N-O 3.28Å; E204-E206 PolarHBondContact O-N 2.99Å; E206-K208 PolarHBondContact O-N 3.06Å
207	A	69.6	Low	72.4	Confident	55 Å²	55	65 Å²	65	46%	0.455	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	111.9	167.8	0	0	0	0	0	109.3	M195 M205	M195-A207 HydrophobicContact SD-CB 4.21Å; M205-A207 PolarHBondContact O-N 3.44Å
208	K	80	Confident	74.4	Confident	22 Å²	22	62.9 Å²	62.9	10%	0.096	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	138.6	175.2	-70.9	-166.1	168.7	-162.9	0	110.6	D150 L180 T181 F196 V198 E206	D150-K208 IonicContact OD1-NZ 2.71Å; D150-K208 PolarHBondContact OD1-NZ 2.98Å; L180-K208 HydrophobicContact CB-CB 4.14Å; L180-K208 HydrophobicContact CB-CD 3.97Å; L180-K208 HydrophobicContact CD1-CB 4.18Å; L180-K208 HydrophobicContact CD1-CD 3.84Å; L180-K208 HydrophobicContact CD2-CB 4.26Å; L180-K208 HydrophobicContact CG-CB 4.43Å; T181-K208 CarbonylContact O-C 3.6Å; T181-K208 VanDerWaalsContact O-CA 3.31Å; T181-K208 WeakPolarHBondContact O-CA 3.39Å; F196-K208 CarbonylContact C-O 3.59Å; F196-K208 WeakPolarHBondContact CA-O 3.48Å; F196-K208 PolarHBondContact N-O 2.66Å; F196-K208 PolarHBondContact O-N 2.8Å; V198-K208 HydrophobicContact CG2-CB 4.25Å; E206-K208 PolarHBondContact O-N 3.06Å
209	R	82.8	Confident	76.2	Confident	5 Å²	5	63.5 Å²	63.5	2%	0.019	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	128.4	-180	-166.1	169.9	-174.6	120.6	12.1	109.9	L180 T181 L185 D187 T193 M195 L211	L180-R209 CarbonylContact C-O 3.53Å; L180-R209 WeakPolarHBondContact CA-O 3.31Å; T181-R209 HydrophobicContact CG2-CB 3.92Å; T181-R209 PolarHBondContact N-O 3.33Å; T181-R209 PolarHBondContact O-N 3.26Å; L185-R209 PolarHBondContact O-NH1 2.94Å; D187-R209 IonicContact OD1-CZ 3.48Å; D187-R209 IonicContact OD1-NH1 3.62Å; D187-R209 PolarHBondContact OD1-NH1 2.99Å; D187-R209 IonicContact OD1-NH2 3.54Å; T193-R209 HydrophobicContact CG2-CG 3.42Å; T193-R209 VanDerWaalsContact CG2-CG 3.42Å; T193-R209 PolarHBondContact OG1-NH2 2.78Å; M195-R209 HydrophobicContact CE-CB 3.41Å; M195-R209 VanDerWaalsContact CE-CB 3.41Å; M195-R209 HydrophobicContact CE-CG 3.54Å; R209-L211 PolarHBondContact O-N 2.97Å
210	L	86.3	Confident	78.4	Confident	32 Å²	32	61.2 Å²	61.2	17%	0.168	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	104.3	177.6	-175.4	74	0	0	0	111.1	M152 W178 L180 T193 R194 F196	M152-L210 HydrophobicContact CG-CD1 4.45Å; W178-L210 HydrophobicContact CB-CD1 4.09Å; L180-L210 HydrophobicContact CD2-CB 4.04Å; L180-L210 HydrophobicContact CD2-CD1 3.78Å; T193-L210 WeakPolarHBondContact CG2-O 3.25Å; R194-L210 PolarHBondContact O-N 3.4Å; R194-L210 VanDerWaalsContact O-N 3.12Å; F196-L210 HydrophobicContact CD2-CB 3.68Å; F196-L210 HydrophobicContact CE2-CB 3.5Å; F196-L210 VanDerWaalsContact CE2-CB 3.5Å; F196-L210 HydrophobicContact CE2-CD2 3.66Å; F196-L210 HydrophobicContact CE2-CG 4.16Å; F196-L210 HydrophobicContact CZ-CD2 4.29Å
211	L	89.8	Confident	80.6	Confident	3 Å²	3	58.4 Å²	58.4	2%	0.016	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	160.1	175.5	-65.4	175.5	0	0	0	111.4	A143 W178 Y179 T181 L185 M190 T193 R209 L239	A143-L211 HydrophobicContact CB-CD1 4.25Å; A143-L211 WeakPolarHBondContact O-CD1 3.42Å; W178-L211 WeakPolarHBondContact CA-O 3.36Å; Y179-L211 HydrophobicContact CD1-CB 4.16Å; Y179-L211 HydrophobicContact CD2-CB 4.38Å; Y179-L211 HydrophobicContact CE1-CB 3.62Å; Y179-L211 HydrophobicContact CE2-CB 3.91Å; Y179-L211 HydrophobicContact CE2-CD1 3.78Å; Y179-L211 HydrophobicContact CE2-CG 4.45Å; Y179-L211 VanDerWaalsContact CZ-CB 3.49Å; Y179-L211 PolarHBondContact N-O 3.39Å; Y179-L211 PolarHBondContact O-N 3.37Å; Y179-L211 WeakPolarHBondContact OH-CD1 3.44Å; T181-L211 HydrophobicContact CG2-CD1 3.48Å; T181-L211 VanDerWaalsContact CG2-CD1 3.48Å; T181-L211 HydrophobicContact CG2-CG 4.05Å; L185-L211 HydrophobicContact CD1-CD1 4.47Å; L185-L211 HydrophobicContact CD1-CD2 4.47Å; M190-L211 HydrophobicContact CE-CD2 3.58Å; M190-L211 HydrophobicContact SD-CD2 4.43Å; T193-L211 HydrophobicContact CG2-CD2 3.88Å; R209-L211 PolarHBondContact O-N 2.97Å; L211-L239 HydrophobicContact CD1-CD1 3.83Å
212	T	91.3	Very high	82.3	Confident	29 Å²	29	58 Å²	58	18%	0.178	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	136.1	175.7	-54.2	0	0	0	0	110	R176 F177 W178 S237	R176-T212 HydrophobicContact CG-CG2 3.71Å; F177-T212 CarbonylContact O-C 3.59Å; F177-T212 VanDerWaalsContact O-CA 3.31Å; F177-T212 WeakPolarHBondContact O-CA 3.12Å; W178-T212 VanDerWaalsContact CD1-OG1 3.27Å; T212-S237 PolarHBondContact O-N 2.77Å
213	A	94.9	Very high	84.3	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	155.2	171.4	0	0	0	0	0	111.2	F102 R176 F177 Y179 Y215 E235	F102-A213 HydrophobicContact CE2-CB 3.64Å; F102-A213 HydrophobicContact CZ-CB 4.2Å; R176-A213 WeakPolarHBondContact CA-O 3.47Å; F177-A213 PolarHBondContact N-O 3.02Å; F177-A213 PolarHBondContact O-N 3.44Å; Y179-A213 HydrophobicContact CE1-CB 4.04Å; A213-Y215 HydrophobicContact CB-CD1 4.32Å; A213-Y215 HydrophobicContact CB-CE1 4.04Å; A213-E235 CarbonylContact C-O 3.51Å; A213-E235 WeakPolarHBondContact CA-O 3.32Å; A213-E235 WeakPolarHBondContact CB-O 3.05Å
214	I	95.4	Very high	86.1	Confident	20 Å²	20	53.5 Å²	53.5	10%	0.103	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	122.9	176	-49.3	168.5	0	0	0	107.7	L174 M175 R176 E235	L174-I214 HydrophobicContact CD2-CG2 4.03Å; M175-I214 WeakPolarHBondContact O-CA 3.31Å; R176-I214 HydrophobicContact CG-CG1 4.44Å; I214-E235 HydrophobicContact CB-CB 4.32Å; I214-E235 PolarHBondContact N-O 3.04Å; I214-E235 PolarHBondContact O-N 3.27Å
215	Y	97.8	Very high	87.8	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	137.3	175.3	-75.1	44.5	0	0	0	108.1	F102 V105 M175 F177 A213 F217 I231 R233 I234 H236	F102-Y215 AromaticContact CD2-CD1 3.81Å; F102-Y215 HydrophobicContact CD2-CD1 3.81Å; F102-Y215 HydrophobicContact CD2-CD2 4.4Å; F102-Y215 AromaticContact CD2-CE1 3.45Å; F102-Y215 HydrophobicContact CD2-CE1 3.45Å; F102-Y215 VanDerWaalsContact CD2-CE1 3.45Å; F102-Y215 HydrophobicContact CD2-CE2 4.05Å; F102-Y215 HydrophobicContact CD2-CG 4.33Å; F102-Y215 AromaticContact CD2-CZ 3.59Å; F102-Y215 HydrophobicContact CE2-CD1 4.27Å; F102-Y215 AromaticContact CE2-CE1 3.65Å; F102-Y215 HydrophobicContact CE2-CE1 3.65Å; F102-Y215 AromaticContact CE2-CZ 3.99Å; V105-Y215 HydrophobicContact CB-CE2 4.16Å; V105-Y215 HydrophobicContact CG1-CE2 3.83Å; M175-Y215 PolarHBondContact N-O 2.88Å; M175-Y215 PolarHBondContact O-N 3.41Å; F177-Y215 HydrophobicContact CD2-CD1 4.4Å; F177-Y215 HydrophobicContact CE2-CD1 4.47Å; F177-Y215 HydrophobicContact CE2-CG 4.35Å; A213-Y215 HydrophobicContact CB-CD1 4.32Å; A213-Y215 HydrophobicContact CB-CE1 4.04Å; Y215-F217 HydrophobicContact CD2-CZ 4.38Å; Y215-I231 HydrophobicContact CD2-CD1 3.99Å; Y215-I231 HydrophobicContact CD2-CG1 4.41Å; Y215-I231 HydrophobicContact CD2-CG2 4Å; Y215-I231 HydrophobicContact CE2-CD1 4.33Å; Y215-R233 CarbonylContact C-O 3.59Å; Y215-R233 VanDerWaalsContact CA-O 3.3Å; Y215-R233 WeakPolarHBondContact CA-O 3.37Å; Y215-I234 HydrophobicContact CD1-CG1 4.49Å; Y215-I234 HydrophobicContact CD1-CG2 4.44Å; Y215-I234 HydrophobicContact CD2-CD1 4.16Å; Y215-I234 HydrophobicContact CD2-CG1 3.88Å; Y215-I234 HydrophobicContact CE1-CB 4.45Å; Y215-I234 HydrophobicContact CE1-CG1 4.33Å; Y215-I234 HydrophobicContact CE1-CG2 3.75Å; Y215-I234 HydrophobicContact CE2-CD1 3.6Å; Y215-I234 HydrophobicContact CE2-CG1 3.74Å; Y215-I234 HydrophobicContact CE2-CG2 4.4Å; Y215-I234 HydrophobicContact CG-CG1 4.24Å; Y215-H236 AromaticContact CE1-CD2 3.92Å; Y215-H236 AromaticContact CE1-NE2 3.39Å; Y215-H236 WeakPolarHBondContact CE1-NE2 3.31Å; Y215-H236 AromaticContact CZ-NE2 3.59Å; Y215-H236 PolarHBondContact OH-NE2 3.09Å
216	E	97.9	Very high	89.4	Confident	41 Å²	41	44.5 Å²	44.5	19%	0.192	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	123.2	169	-168.8	176	-108.6	0	0	108.8	L174 I231 T232 R233	L174-E216 HydrophobicContact CD2-CB 3.65Å; L174-E216 HydrophobicContact CD2-CG 3.88Å; L174-E216 HydrophobicContact CG-CG 4.33Å; E216-I231 CarbonylContact O-C 3.57Å; E216-I231 VanDerWaalsContact O-CA 3.26Å; E216-I231 WeakPolarHBondContact O-CA 3.34Å; E216-T232 WeakPolarHBondContact CG-OG1 3.44Å; E216-T232 PolarHBondContact O-N 2.88Å; E216-T232 PolarHBondContact O-OG1 3.33Å; E216-T232 PolarHBondContact OE2-OG1 3.18Å; E216-R233 HydrophobicContact CB-CB 3.56Å; E216-R233 PolarHBondContact N-O 3.09Å
217	F	98.1	Very high	90.6	Very high	7 Å²	7	43.7 Å²	43.7	3%	0.031	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	125.9	174.4	-62.8	-94.2	0	0	0	108.3	F94 A98 A101 S172 I173 M175 F177 Y215 W229 I231	F94-F217 HydrophobicContact CE2-CB 4.24Å; F94-F217 HydrophobicContact CZ-CB 3.87Å; F94-F217 HydrophobicContact CZ-CD2 4.18Å; F94-F217 HydrophobicContact CZ-CG 4.12Å; A98-F217 HydrophobicContact CB-CD2 4.27Å; A98-F217 HydrophobicContact CB-CE1 4.38Å; A98-F217 HydrophobicContact CB-CE2 3.72Å; A98-F217 HydrophobicContact CB-CZ 3.79Å; A101-F217 HydrophobicContact CB-CE1 3.82Å; A101-F217 HydrophobicContact CB-CZ 4.27Å; S172-F217 CarbonylContact C-O 3.58Å; S172-F217 VanDerWaalsContact CA-O 3.28Å; S172-F217 WeakPolarHBondContact CA-O 3.25Å; I173-F217 PolarHBondContact N-O 3.4Å; I173-F217 PolarHBondContact O-N 2.94Å; M175-F217 HydrophobicContact CB-CD2 4.27Å; M175-F217 HydrophobicContact CB-CE2 3.95Å; M175-F217 HydrophobicContact CG-CD2 3.94Å; M175-F217 HydrophobicContact CG-CE2 3.94Å; F177-F217 HydrophobicContact CE2-CE2 4.34Å; F177-F217 HydrophobicContact CZ-CE2 4.29Å; Y215-F217 HydrophobicContact CD2-CZ 4.38Å; F217-W229 HydrophobicContact CB-CE3 3.91Å; F217-I231 HydrophobicContact CD1-CG1 3.69Å; F217-I231 HydrophobicContact CE1-CD1 3.9Å; F217-I231 HydrophobicContact CE1-CG1 3.54Å; F217-I231 HydrophobicContact CZ-CD1 4.47Å; F217-I231 HydrophobicContact CZ-CG1 4.26Å
218	Q	97.3	Very high	91.7	Very high	44 Å²	44	45.8 Å²	45.8	21%	0.206	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	137.4	178.9	-172	180	-75.8	0	0	110.5	F170 V171 T230 T232	F170-Q218 HydrophobicContact CB-CG 4.37Å; F170-Q218 HydrophobicContact CD1-CG 4.31Å; V171-Q218 CarbonylContact O-C 3.49Å; V171-Q218 VanDerWaalsContact O-CA 3.3Å; V171-Q218 WeakPolarHBondContact O-CA 3.43Å; Q218-T230 PolarHBondContact N-O 2.78Å; Q218-T230 PolarHBondContact O-N 2.78Å; Q218-T232 HydrophobicContact CB-CG2 3.61Å; Q218-T232 HydrophobicContact CG-CG2 4.38Å
219	R	96.4	Very high	92.5	Very high	37 Å²	37	47.9 Å²	47.9	14%	0.14	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	139.4	172.7	175	170.4	169.3	-153.1	2.1	110.6	D86 F170 V171 F221 P227 D228 W229	D86-R219 IonicContact OD2-CZ 3.53Å; D86-R219 IonicContact OD2-NH1 3.16Å; D86-R219 PolarHBondContact OD2-NH1 3.16Å; D86-R219 IonicContact OD2-NH2 3.5Å; D86-R219 PolarHBondContact OD2-NH2 2.89Å; F170-R219 WeakPolarHBondContact CA-O 3.42Å; V171-R219 PolarHBondContact N-O 2.93Å; V171-R219 PolarHBondContact O-N 2.83Å; R219-F221 HydrophobicContact CB-CE2 3.94Å; R219-F221 HydrophobicContact CB-CZ 4.4Å; R219-F221 HydrophobicContact CG-CD2 4.25Å; R219-F221 HydrophobicContact CG-CE1 4.48Å; R219-F221 HydrophobicContact CG-CE2 3.71Å; R219-F221 HydrophobicContact CG-CZ 3.86Å; R219-F221 VanDerWaalsContact CZ-CE1 3.43Å; R219-P227 WeakPolarHBondContact CD-O 3.46Å; R219-P227 PolarHBondContact NE-O 3.27Å; R219-D228 WeakPolarHBondContact CG-O 3.26Å; R219-W229 HydrophobicContact CB-CD2 3.53Å; R219-W229 HydrophobicContact CB-CE3 3.49Å; R219-W229 VanDerWaalsContact CB-CE3 3.49Å; R219-W229 HydrophobicContact CB-CG 4.09Å; R219-W229 HydrophobicContact CB-CH2 4.11Å; R219-W229 HydrophobicContact CB-CZ2 4.15Å; R219-W229 HydrophobicContact CB-CZ3 3.79Å; R219-W229 HydrophobicContact CG-CD2 4.43Å
220	E	95.6	Very high	93.2	Very high	38 Å²	38	49.9 Å²	49.9	18%	0.178	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	137.6	173	-168	172.6	157.5	0	0	110.4	R168 K169 F170 T222 V225	R168-E220 VanDerWaalsContact CD-OE1 3.26Å; R168-E220 WeakPolarHBondContact CD-OE1 3.17Å; R168-E220 WeakPolarHBondContact CG-OE1 3.49Å; R168-E220 IonicContact NH1-OE2 3.9Å; K169-E220 CarbonylContact O-C 3.45Å; K169-E220 WeakPolarHBondContact O-CA 3.31Å; F170-E220 HydrophobicContact CD1-CB 3.85Å; F170-E220 HydrophobicContact CD1-CG 3.96Å; F170-E220 HydrophobicContact CE1-CB 3.66Å; F170-E220 HydrophobicContact CE1-CG 3.52Å; F170-E220 VanDerWaalsContact CE1-OE2 3.27Å; F170-E220 WeakPolarHBondContact CE1-OE2 3.48Å; F170-E220 HydrophobicContact CZ-CG 4.01Å; E220-T222 WeakPolarHBondContact CG-OG1 3.31Å; E220-T222 WeakPolarHBondContact OE1-CB 3.35Å; E220-T222 PolarHBondContact OE1-OG1 2.87Å; E220-V225 HydrophobicContact CB-CG1 4.09Å; E220-V225 HydrophobicContact CG-CG1 4.33Å
221	F	94.1	Very high	93.8	Very high	36 Å²	36	48.5 Å²	48.5	16%	0.158	28%	0.276	C	S	.	.			trans	-117.3	19.9	-179	-73.2	-84.9	0	0	0	112.7	F85 D86 K169 V171 R219	F85-F221 HydrophobicContact CB-CD1 3.88Å; F85-F221 HydrophobicContact CB-CD2 4.38Å; F85-F221 HydrophobicContact CB-CE1 4.05Å; F85-F221 HydrophobicContact CB-CG 4.05Å; F85-F221 HydrophobicContact CB-CZ 4.35Å; F85-F221 HydrophobicContact CD1-CB 3.73Å; F85-F221 HydrophobicContact CD1-CD1 4.45Å; F85-F221 HydrophobicContact CD1-CD2 4.09Å; F85-F221 AromaticContact CD1-CG 3.83Å; F85-F221 HydrophobicContact CD1-CG 3.83Å; F85-F221 HydrophobicContact CE1-CB 4.47Å; F85-F221 HydrophobicContact CG-CG 4.4Å; D86-F221 HydrophobicContact CB-CE1 3.86Å; D86-F221 HydrophobicContact CB-CZ 4.34Å; K169-F221 HydrophobicContact CB-CB 4.38Å; K169-F221 PolarHBondContact O-N 2.72Å; V171-F221 HydrophobicContact CB-CD2 4.31Å; V171-F221 HydrophobicContact CB-CE2 3.83Å; V171-F221 HydrophobicContact CG2-CD2 3.76Å; V171-F221 HydrophobicContact CG2-CE2 3.56Å; R219-F221 HydrophobicContact CB-CE2 3.94Å; R219-F221 HydrophobicContact CB-CZ 4.4Å; R219-F221 HydrophobicContact CG-CD2 4.25Å; R219-F221 HydrophobicContact CG-CE1 4.48Å; R219-F221 HydrophobicContact CG-CE2 3.71Å; R219-F221 HydrophobicContact CG-CZ 3.86Å; R219-F221 VanDerWaalsContact CZ-CE1 3.43Å
222	T	92.1	Very high	94.1	Very high	42 Å²	42	50 Å²	50	26%	0.258	29%	0.285	S	S	.	.	S	Bend	trans	-70.4	141.5	172.2	-49.5	0	0	0	0	110	R168 K169 E220 G224 V225	R168-T222 WeakPolarHBondContact CA-OG1 3.17Å; R168-T222 WeakPolarHBondContact CB-OG1 3.09Å; R168-T222 HydrophobicContact CG-CG2 4.42Å; K169-T222 PolarHBondContact N-OG1 3.12Å; E220-T222 WeakPolarHBondContact CG-OG1 3.31Å; E220-T222 WeakPolarHBondContact OE1-CB 3.35Å; E220-T222 PolarHBondContact OE1-OG1 2.87Å; T222-G224 PolarHBondContact O-N 3.36Å; T222-V225 HydrophobicContact CG2-CG2 4.44Å; T222-V225 PolarHBondContact O-N 3.33Å
223	K	88.3	Confident	94.4	Very high	209 Å²	209	52.2 Å²	52.2	91%	0.909	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	129.6	-178.3	-68.7	-174	178.3	-177.6	0	110.9
224	G	87.8	Confident	94.4	Very high	89 Å²	89	52.8 Å²	52.8	92%	0.918	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.2	-1.5	178.1	0	0	0	0	0	115	T222	T222-G224 PolarHBondContact O-N 3.36Å
225	V	90.1	Very high	94.4	Very high	70 Å²	70	54.1 Å²	54.1	42%	0.424	30%	0.299	S	S	.	.	S	Bend	trans	-85.1	148.7	171.2	-177	0	0	0	0	109.8	E220 T222	E220-V225 HydrophobicContact CB-CG1 4.09Å; E220-V225 HydrophobicContact CG-CG1 4.33Å; T222-V225 HydrophobicContact CG2-CG2 4.44Å; T222-V225 PolarHBondContact O-N 3.33Å
226	A	89	Confident	94	Very high	55 Å²	55	54.1 Å²	54.1	46%	0.455	30%	0.299	S	S	.	.			trans	-62.6	141.4	176.5	0	0	0	0	0	110.9	D228	A226-D228 VanDerWaalsContact CB-OD2 3.32Å; A226-D228 WeakPolarHBondContact CB-OD2 3.36Å; A226-D228 PolarHBondContact O-N 3.37Å
227	P	88.5	Confident	93.3	Very high	83 Å²	83	54 Å²	54	54%	0.539	30%	0.303	S	S	.	.			trans	-78.8	29.2	-172	34.9	-37.9	0	0	0	113.8	R219	R219-P227 WeakPolarHBondContact CD-O 3.46Å; R219-P227 PolarHBondContact NE-O 3.27Å
228	D	93.3	Very high	92.2	Very high	100 Å²	100	55.7 Å²	55.7	54%	0.535	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-89.3	145.3	-166.4	-58.1	-40.8	0	0	0	112.8	R219 A226	R219-D228 WeakPolarHBondContact CG-O 3.26Å; A226-D228 VanDerWaalsContact CB-OD2 3.32Å; A226-D228 WeakPolarHBondContact CB-OD2 3.36Å; A226-D228 PolarHBondContact O-N 3.37Å
229	W	96.4	Very high	91	Very high	65 Å²	65	54 Å²	54	25%	0.246	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	117.1	171.1	-71	94.8	0	0	0	109.6	F89 F94 V171 I173 F217 R219	F89-W229 HydrophobicContact CE2-CZ2 4.25Å; F94-W229 HydrophobicContact CD2-CD2 4.4Å; F94-W229 AromaticContact CD2-CE2 3.95Å; F94-W229 HydrophobicContact CD2-CH2 4.42Å; F94-W229 AromaticContact CD2-CZ2 3.96Å; F94-W229 HydrophobicContact CD2-CZ2 3.96Å; F94-W229 AromaticContact CE2-CD2 3.78Å; F94-W229 HydrophobicContact CE2-CD2 3.78Å; F94-W229 AromaticContact CE2-CE2 3.77Å; F94-W229 AromaticContact CE2-CE3 3.87Å; F94-W229 HydrophobicContact CE2-CE3 3.87Å; F94-W229 HydrophobicContact CE2-CG 4.44Å; F94-W229 AromaticContact CE2-CH2 3.97Å; F94-W229 HydrophobicContact CE2-CH2 3.97Å; F94-W229 AromaticContact CE2-CZ2 3.87Å; F94-W229 HydrophobicContact CE2-CZ2 3.87Å; F94-W229 AromaticContact CE2-CZ3 3.97Å; F94-W229 HydrophobicContact CE2-CZ3 3.97Å; V171-W229 HydrophobicContact CB-CH2 4.4Å; V171-W229 HydrophobicContact CG1-CH2 4.12Å; I173-W229 HydrophobicContact CD1-CH2 3.77Å; I173-W229 HydrophobicContact CD1-CZ3 4.29Å; I173-W229 HydrophobicContact CG1-CH2 4.16Å; I173-W229 HydrophobicContact CG1-CZ3 4.26Å; F217-W229 HydrophobicContact CB-CE3 3.91Å; R219-W229 HydrophobicContact CB-CD2 3.53Å; R219-W229 HydrophobicContact CB-CE3 3.49Å; R219-W229 VanDerWaalsContact CB-CE3 3.49Å; R219-W229 HydrophobicContact CB-CG 4.09Å; R219-W229 HydrophobicContact CB-CH2 4.11Å; R219-W229 HydrophobicContact CB-CZ2 4.15Å; R219-W229 HydrophobicContact CB-CZ3 3.79Å; R219-W229 HydrophobicContact CG-CD2 4.43Å
230	T	97.1	Very high	89.8	Confident	47 Å²	47	52.5 Å²	52.5	29%	0.288	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	139.6	176	-55.2	0	0	0	0	110.3	A122 Q218 T232	A122-T230 HydrophobicContact CB-CG2 4.28Å; Q218-T230 PolarHBondContact N-O 2.78Å; Q218-T230 PolarHBondContact O-N 2.78Å; T230-T232 PolarHBondContact O-N 3.31Å
231	I	98.3	Very high	88.2	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.021	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	116.8	174.4	-62.8	157.6	0	0	0	110	V105 L120 V121 A122 Y215 E216 F217 R233 I234	V105-I231 HydrophobicContact CB-CD1 4.45Å; V105-I231 HydrophobicContact CG2-CD1 3.81Å; L120-I231 PolarHBondContact O-N 3.4Å; V121-I231 WeakPolarHBondContact CA-O 3.46Å; V121-I231 HydrophobicContact CG2-CB 4.31Å; V121-I231 HydrophobicContact CG2-CD1 4.4Å; A122-I231 PolarHBondContact N-O 2.79Å; Y215-I231 HydrophobicContact CD2-CD1 3.99Å; Y215-I231 HydrophobicContact CD2-CG1 4.41Å; Y215-I231 HydrophobicContact CD2-CG2 4Å; Y215-I231 HydrophobicContact CE2-CD1 4.33Å; E216-I231 CarbonylContact O-C 3.57Å; E216-I231 VanDerWaalsContact O-CA 3.26Å; E216-I231 WeakPolarHBondContact O-CA 3.34Å; F217-I231 HydrophobicContact CD1-CG1 3.69Å; F217-I231 HydrophobicContact CE1-CD1 3.9Å; F217-I231 HydrophobicContact CE1-CG1 3.54Å; F217-I231 HydrophobicContact CZ-CD1 4.47Å; F217-I231 HydrophobicContact CZ-CG1 4.26Å; I231-R233 WeakPolarHBondContact CG2-O 3.31Å; I231-I234 HydrophobicContact CG2-CD1 3.88Å; I231-I234 HydrophobicContact CG2-CG1 3.49Å; I231-I234 VanDerWaalsContact CG2-CG1 3.49Å
232	T	96.9	Very high	87.9	Confident	34 Å²	34	58.6 Å²	58.6	21%	0.209	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	-14.9	-177.3	47.3	0	0	0	0	114.1	A122 E216 Q218 T230	A122-T232 HydrophobicContact CB-CG2 4.42Å; E216-T232 WeakPolarHBondContact CG-OG1 3.44Å; E216-T232 PolarHBondContact O-N 2.88Å; E216-T232 PolarHBondContact O-OG1 3.33Å; E216-T232 PolarHBondContact OE2-OG1 3.18Å; Q218-T232 HydrophobicContact CB-CG2 3.61Å; Q218-T232 HydrophobicContact CG-CG2 4.38Å; T230-T232 PolarHBondContact O-N 3.31Å
233	R	96.6	Very high	87.7	Confident	75 Å²	75	59.5 Å²	59.5	28%	0.283	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	138.1	177.7	-170.8	175.4	171.1	-159.3	-7	110.2	Y215 E216 I231 E235	Y215-R233 CarbonylContact C-O 3.59Å; Y215-R233 VanDerWaalsContact CA-O 3.3Å; Y215-R233 WeakPolarHBondContact CA-O 3.37Å; E216-R233 HydrophobicContact CB-CB 3.56Å; E216-R233 PolarHBondContact N-O 3.09Å; I231-R233 WeakPolarHBondContact CG2-O 3.31Å; R233-E235 HydrophobicContact CG-CG 4.34Å; R233-E235 IonicContact CZ-OE1 3.72Å; R233-E235 IonicContact CZ-OE2 3.42Å; R233-E235 VanDerWaalsContact NE-CD 3.28Å; R233-E235 IonicContact NE-OE1 2.71Å; R233-E235 PolarHBondContact NE-OE1 3.22Å; R233-E235 IonicContact NE-OE2 2.72Å; R233-E235 IonicContact NH2-OE1 2.66Å; R233-E235 PolarHBondContact NH2-OE1 3.15Å; R233-E235 IonicContact NH2-OE2 3.68Å; R233-E235 PolarHBondContact NH2-OE2 2.89Å
234	I	96.5	Very high	87.6	Confident	12 Å²	12	51.2 Å²	51.2	6%	0.062	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	125.1	172.6	-66.8	-176.9	0	0	0	107.8	V105 L109 V121 L125 L129 Y215 I231	V105-I234 HydrophobicContact CG1-CD1 3.68Å; L109-I234 HydrophobicContact CD1-CD1 4.13Å; L109-I234 HydrophobicContact CD1-CG2 4.16Å; V121-I234 HydrophobicContact CG2-CD1 4.4Å; L125-I234 HydrophobicContact CD2-CB 4.4Å; L125-I234 HydrophobicContact CD2-CG1 4.15Å; L129-I234 HydrophobicContact CD1-CD1 3.97Å; L129-I234 HydrophobicContact CD2-CB 4.26Å; L129-I234 HydrophobicContact CD2-CG2 4.2Å; Y215-I234 HydrophobicContact CD1-CG1 4.49Å; Y215-I234 HydrophobicContact CD1-CG2 4.44Å; Y215-I234 HydrophobicContact CD2-CD1 4.16Å; Y215-I234 HydrophobicContact CD2-CG1 3.88Å; Y215-I234 HydrophobicContact CE1-CB 4.45Å; Y215-I234 HydrophobicContact CE1-CG1 4.33Å; Y215-I234 HydrophobicContact CE1-CG2 3.75Å; Y215-I234 HydrophobicContact CE2-CD1 3.6Å; Y215-I234 HydrophobicContact CE2-CG1 3.74Å; Y215-I234 HydrophobicContact CE2-CG2 4.4Å; Y215-I234 HydrophobicContact CG-CG1 4.24Å; I231-I234 HydrophobicContact CG2-CD1 3.88Å; I231-I234 HydrophobicContact CG2-CG1 3.49Å; I231-I234 VanDerWaalsContact CG2-CG1 3.49Å
235	E	94.1	Very high	87.6	Confident	48 Å²	48	48.9 Å²	48.9	22%	0.224	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	128.5	173.3	-63.6	177.1	167.5	0	0	108.2	A213 I214 R233	A213-E235 CarbonylContact C-O 3.51Å; A213-E235 WeakPolarHBondContact CA-O 3.32Å; A213-E235 WeakPolarHBondContact CB-O 3.05Å; I214-E235 HydrophobicContact CB-CB 4.32Å; I214-E235 PolarHBondContact N-O 3.04Å; I214-E235 PolarHBondContact O-N 3.27Å; R233-E235 HydrophobicContact CG-CG 4.34Å; R233-E235 IonicContact CZ-OE1 3.72Å; R233-E235 IonicContact CZ-OE2 3.42Å; R233-E235 VanDerWaalsContact NE-CD 3.28Å; R233-E235 IonicContact NE-OE1 2.71Å; R233-E235 PolarHBondContact NE-OE1 3.22Å; R233-E235 IonicContact NE-OE2 2.72Å; R233-E235 IonicContact NH2-OE1 2.66Å; R233-E235 PolarHBondContact NH2-OE1 3.15Å; R233-E235 IonicContact NH2-OE2 3.68Å; R233-E235 PolarHBondContact NH2-OE2 2.89Å
236	H	90.5	Very high	87.5	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	110.2	168.2	-75.7	-126.2	0	0	0	106.5	L144 Y179 Y215 S238 L239 L240	L144-H236 HydrophobicContact CD2-CB 3.86Å; L144-H236 WeakPolarHBondContact CD2-ND1 3.34Å; Y179-H236 AromaticContact CZ-ND1 3.86Å; Y179-H236 PolarHBondContact OH-ND1 3.13Å; Y215-H236 AromaticContact CE1-CD2 3.92Å; Y215-H236 AromaticContact CE1-NE2 3.39Å; Y215-H236 WeakPolarHBondContact CE1-NE2 3.31Å; Y215-H236 AromaticContact CZ-NE2 3.59Å; Y215-H236 PolarHBondContact OH-NE2 3.09Å; H236-S238 PolarHBondContact O-N 3.3Å; H236-L239 HydrophobicContact CB-CB 3.91Å; H236-L239 HydrophobicContact CB-CD1 4.41Å; H236-L239 PolarHBondContact O-N 2.76Å; H236-L240 HydrophobicContact CB-CB 4.2Å; H236-L240 HydrophobicContact CB-CD1 4.26Å; H236-L240 HydrophobicContact CB-CG 4.37Å; H236-L240 PolarHBondContact O-N 3.47Å
237	S	82.2	Confident	87.4	Confident	39 Å²	39	47.1 Å²	47.1	27%	0.273	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	127.4	-169.2	-61.5	0	0	0	0	111.5	M190 T212 L239	M190-S237 VanDerWaalsContact CE-O 3.32Å; M190-S237 WeakPolarHBondContact CE-O 3.48Å; T212-S237 PolarHBondContact O-N 2.77Å; S237-L239 PolarHBondContact O-N 3.09Å; S237-L239 VanDerWaalsContact O-N 3.17Å
238	S	74.4	Confident	87.3	Confident	42 Å²	42	44.6 Å²	44.6	29%	0.294	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	16.7	-171.3	41.9	0	0	0	0	116.8	M190 H236 D241	M190-S238 WeakPolarHBondContact CB-OG 3.5Å; M190-S238 WeakPolarHBondContact CE-OG 3.15Å; H236-S238 PolarHBondContact O-N 3.3Å; S238-D241 WeakPolarHBondContact CA-OD2 3.36Å; S238-D241 PolarHBondContact N-OD2 3.5Å
239	L	73.8	Confident	86.8	Confident	8 Å²	8	40.3 Å²	40.3	4%	0.042	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-38	165.9	-59.2	-176.3	0	0	0	113	L136 Y140 A143 L144 L185 M190 L211 H236 S237	L136-L239 WeakPolarHBondContact CD1-O 3.35Å; L136-L239 WeakPolarHBondContact CD2-O 3.47Å; Y140-L239 HydrophobicContact CD1-CD2 3.41Å; Y140-L239 VanDerWaalsContact CD1-CD2 3.41Å; Y140-L239 HydrophobicContact CE1-CD2 4Å; Y140-L239 HydrophobicContact CG-CD2 4.23Å; A143-L239 HydrophobicContact CB-CD1 4.22Å; L144-L239 HydrophobicContact CD2-CB 3.91Å; L144-L239 HydrophobicContact CD2-CD1 3.74Å; L144-L239 HydrophobicContact CD2-CG 4.5Å; L144-L239 HydrophobicContact CG-CD1 4.48Å; L185-L239 HydrophobicContact CD1-CD2 4.02Å; M190-L239 HydrophobicContact CE-CD2 3.6Å; M190-L239 HydrophobicContact CE-CG 3.82Å; M190-L239 HydrophobicContact SD-CD2 3.9Å; L211-L239 HydrophobicContact CD1-CD1 3.83Å; H236-L239 HydrophobicContact CB-CB 3.91Å; H236-L239 HydrophobicContact CB-CD1 4.41Å; H236-L239 PolarHBondContact O-N 2.76Å; S237-L239 PolarHBondContact O-N 3.09Å; S237-L239 VanDerWaalsContact O-N 3.17Å
240	L	71	Confident	86	Confident	6 Å²	6	38.3 Å²	38.3	3%	0.031	21%	0.208	C	C	.	.			trans	-135.1	21.7	-174.2	-71.4	174.1	0	0	0	113.3	L129 K132 L136 L144 H236	L129-L240 HydrophobicContact CD2-CD1 4.45Å; K132-L240 HydrophobicContact CB-CD2 3.85Å; K132-L240 PolarHBondContact NZ-O 3.07Å; L136-L240 HydrophobicContact CD1-CD2 3.68Å; L136-L240 HydrophobicContact CD1-CG 4.36Å; L144-L240 HydrophobicContact CD1-CD1 4.03Å; L144-L240 HydrophobicContact CD2-CD1 3.6Å; L144-L240 HydrophobicContact CD2-CG 3.9Å; L144-L240 HydrophobicContact CG-CD1 4.5Å; H236-L240 HydrophobicContact CB-CB 4.2Å; H236-L240 HydrophobicContact CB-CD1 4.26Å; H236-L240 HydrophobicContact CB-CG 4.37Å; H236-L240 PolarHBondContact O-N 3.47Å
241	D	60.9	Low	85	Confident	144 Å²	144	37.5 Å²	37.5	77%	0.77	20%	0.201	S	C	*	.			trans	-61.7	0	178.2	-67.2	-26.6	0	0	0	112.8	K132 S238	K132-D241 PolarHBondContact NZ-O 3.07Å; K132-D241 PolarHBondContact NZ-OXT 3.45Å; S238-D241 WeakPolarHBondContact CA-OD2 3.36Å; S238-D241 PolarHBondContact N-OD2 3.5Å

Retrieved 241 of 241 residues in 77.8 ms (Link to these results)

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