A0A096NJJ3_PAPAN Loading...

Alpha-1-antitrypsin

Inhibitor of serine proteases. Its primary target is elastase, but it also has a moderate affinity for plasmin and thrombin. Inhibits trypsin, chymotrypsin and plasminogen activator.

AlphaFold DB , UniProt , Accession A0A096NJJ3, Species PAPAN (Papio anubis, Olive baboon), Gene SERPINA11, Length 422 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	40.2	Very low	34.8	Very low	252 Å²	252	151.2 Å²	151.2	100%	1.241	84%	0.837	S	S	*	*				0	101.6	0	-73.9	173.4	157.9	0	0	107.1
2	G	32.1	Very low	34.4	Very low	75 Å²	75	144.8 Å²	144.8	77%	0.773	83%	0.831	S	S	*	*			trans	-87.6	-157.8	173.9	0	0	0	0	0	111.6
3	P	53.1	Low	34.5	Very low	121 Å²	121	146.4 Å²	146.4	79%	0.786	83%	0.832	S	S	*	*			cis	-131.3	151.8	-21	36.5	-18.3	0	0	0	112.3
4	A	36.4	Very low	34.3	Very low	86 Å²	86	147.8 Å²	147.8	71%	0.711	84%	0.835	S	S	*	*				54.8	134.7	106.3	0	0	0	0	0	117.9
5	W	31.6	Very low	34.3	Very low	244 Å²	244	144.7 Å²	144.7	92%	0.924	84%	0.836	S	S	*	*				178.3	140.5	109.8	-99.2	54.2	0	0	0	113.1
6	L	33.3	Very low	34.2	Very low	144 Å²	144	141.8 Å²	141.8	75%	0.754	83%	0.826	S	S	*	*			trans	-87.1	150.8	169.3	-98.5	90.8	0	0	0	110.8
7	W	32.5	Very low	34	Very low	218 Å²	218	141.6 Å²	141.6	83%	0.826	83%	0.827	S	S	*	*			trans	32.4	135.6	145	-65.1	84.4	0	0	0	122.8
8	L	30.9	Very low	33.8	Very low	150 Å²	150	143.7 Å²	143.7	79%	0.785	83%	0.827	S	S	*	*				174.8	138.3	110.1	-93.8	156.3	0	0	0	115.4
9	L	32.1	Very low	33.3	Very low	164 Å²	164	142.6 Å²	142.6	86%	0.859	83%	0.827	S	S	*	*			trans	14.8	142.3	148.2	-72.6	163.6	0	0	0	122.3
10	G	28.8	Very low	33.1	Very low	64 Å²	64	145.5 Å²	145.5	66%	0.66	83%	0.832	S	S	*	*			trans	176.1	87.5	157.3	0	0	0	0	0	117.4
11	T	32	Very low	32.9	Very low	145 Å²	145	143.7 Å²	143.7	89%	0.89	83%	0.829	S	S	*	*			trans	50.1	133.6	137.3	54.8	0	0	0	0	122.7
12	G	30.2	Very low	32.4	Very low	74 Å²	74	139.2 Å²	139.2	76%	0.763	81%	0.809	S	S	*	*			trans	-79.6	175.6	175.3	0	0	0	0	0	116.4
13	I	35.6	Very low	32.5	Very low	166 Å²	166	141.9 Å²	141.9	85%	0.851	81%	0.813	S	S	*	*			trans	-137.3	115	170.7	-64.5	-178.8	0	0	0	108.5
14	L	31.8	Very low	31.5	Very low	166 Å²	166	140 Å²	140	87%	0.869	81%	0.808	S	S	*	*			trans	-76.6	135.7	155.8	-92.7	146.9	0	0	0	107.9
15	A	33.5	Very low	31.4	Very low	102 Å²	102	145.3 Å²	145.3	84%	0.843	82%	0.817	S	S	*	*			trans	-122.4	116.6	164.6	0	0	0	0	0	109.4
16	S	32.8	Very low	31.2	Very low	97 Å²	97	137.2 Å²	137.2	68%	0.678	81%	0.809	S	S	*	*			trans	-129.7	123.8	173.2	48.8	0	0	0	0	107.9
17	V	31.7	Very low	31.1	Very low	140 Å²	140	138.2 Å²	138.2	85%	0.848	82%	0.816	S	S	*	*			trans	-154	102.8	157.6	-173.6	0	0	0	0	106.4
18	H	29.2	Very low	31.2	Very low	179 Å²	179	137.4 Å²	137.4	83%	0.829	82%	0.818	S	S	*	*				71.1	112.4	86.9	-97.2	65.3	0	0	0	116.8
19	C	26	Very low	31.2	Very low	122 Å²	122	135.9 Å²	135.9	82%	0.824	82%	0.82	S	S	*	*			trans	-3.8	142.3	154.4	-79	0	0	0	0	120.7
20	Q	28.5	Very low	31.4	Very low	200 Å²	200	136.3 Å²	136.3	94%	0.935	82%	0.822	S	S	*	*				-148.2	163.6	129.3	-106.9	173.5	22.6	0	0	111.7
21	S	28.9	Very low	31.8	Very low	109 Å²	109	142.2 Å²	142.2	76%	0.762	83%	0.833	S	S	*	*			trans	-98.6	160.9	-142.8	43.9	0	0	0	0	117.1
22	L	30.3	Very low	32	Very low	157 Å²	157	138.1 Å²	138.1	82%	0.822	82%	0.819	S	S	*	*			trans	-44.6	161.4	169.4	-83.6	119.7	0	0	0	115.9
23	P	33.4	Very low	32.3	Very low	132 Å²	132	140.9 Å²	140.9	86%	0.857	82%	0.823	S	S	*	*				-128.8	166.7	110	33	-21.3	0	0	0	114.4
24	A	33	Very low	32.5	Very low	81 Å²	81	141.7 Å²	141.7	67%	0.669	82%	0.824	S	S	*	*			trans	-95.2	160.9	-157.8	0	0	0	0	0	116.1
25	H	32.9	Very low	32.7	Very low	197 Å²	197	139.2 Å²	139.2	91%	0.912	82%	0.817	S	S	*	*			trans	78.2	126.2	145.9	-89.4	-50.7	0	0	0	123
26	G	28	Very low	33.2	Very low	74 Å²	74	140.4 Å²	140.4	76%	0.763	82%	0.816	S	S	*	*			trans	101.9	116	163.6	0	0	0	0	0	111.3
27	D	30.6	Very low	33.4	Very low	166 Å²	166	139 Å²	139	89%	0.888	82%	0.817	S	S	*	*			cis	-160.5	151	32.1	-146.5	-12.8	0	0	0	110
28	K	35.1	Very low	33.7	Very low	201 Å²	201	141.1 Å²	141.1	87%	0.874	82%	0.817	S	S	*	*			trans	-81.4	121.7	-177.1	-76.3	176.2	176.1	175.7	0	110.7
29	S	31.9	Very low	34.2	Very low	117 Å²	117	141.3 Å²	141.3	82%	0.818	82%	0.819	S	S	*	*			trans	-135.1	117.5	149	54.1	0	0	0	0	109.8	Q31	S29-Q31 PolarHBondContact O-N 2.77Å
30	L	35.4	Very low	34.8	Very low	173 Å²	173	143.4 Å²	143.4	91%	0.906	82%	0.821	S	S	*	*			trans	-74.5	111.3	177	-79.7	124.5	0	0	0	109.2
31	Q	36.3	Very low	35.7	Very low	189 Å²	189	139.3 Å²	139.3	88%	0.883	81%	0.814	S	S	*	*			trans	-97	114.9	154.6	-85.8	177	-8.9	0	0	107.9	S29	S29-Q31 PolarHBondContact O-N 2.77Å
32	G	37.8	Very low	36.8	Very low	59 Å²	59	142.6 Å²	142.6	61%	0.608	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-67.3	166.9	177.6	0	0	0	0	0	112.7	Q34	G32-Q34 PolarHBondContact O-N 3.15Å
33	P	36.7	Very low	39	Very low	131 Å²	131	140.9 Å²	140.9	85%	0.851	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-62.4	127.5	-179.6	-13.2	26.8	0	0	0	110.1
34	Q	38.5	Very low	41.5	Very low	184 Å²	184	137.4 Å²	137.4	86%	0.86	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-58.4	136.9	167.2	-76.3	-171.2	-57.1	0	0	109.3	G32	G32-Q34 PolarHBondContact O-N 3.15Å
35	P	36.7	Very low	44.3	Very low	113 Å²	113	135.9 Å²	135.9	73%	0.734	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-63.6	145.4	175.9	26.3	-31.7	0	0	0	109.6	G37	P35-G37 PolarHBondContact O-N 3.47Å; P35-G37 VanDerWaalsContact O-N 3.13Å
36	P	42.7	Very low	47.3	Very low	127 Å²	127	127.5 Å²	127.5	83%	0.825	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-57.8	122.3	175.9	24.4	-32.8	0	0	0	108.8	H38	P36-H38 PolarHBondContact O-N 3.06Å
37	G	37.7	Very low	50.5	Low	67 Å²	67	124.6 Å²	124.6	69%	0.691	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-52.4	132.7	176.2	0	0	0	0	0	109.9	P35 Q39	P35-G37 PolarHBondContact O-N 3.47Å; P35-G37 VanDerWaalsContact O-N 3.13Å; G37-Q39 PolarHBondContact O-N 2.91Å
38	H	38.1	Very low	53.6	Low	185 Å²	185	123.1 Å²	123.1	86%	0.856	70%	0.695	S	S	*	*			trans	-50.5	103.2	170.9	-80.2	-82.2	0	0	0	109.1	P36 L40	P36-H38 PolarHBondContact O-N 3.06Å; H38-L40 PolarHBondContact O-N 2.96Å
39	Q	39.1	Very low	56.3	Low	184 Å²	184	121.3 Å²	121.3	86%	0.86	68%	0.682	S	S	*	*			trans	-62.1	98.4	156	-77.1	-177	-20.9	0	0	105.4	G37 S41	G37-Q39 PolarHBondContact O-N 2.91Å; Q39-S41 VanDerWaalsContact C-N 3.35Å; Q39-S41 PolarHBondContact O-N 2.77Å
40	L	40.2	Very low	59.4	Low	166 Å²	166	115.8 Å²	115.8	87%	0.869	64%	0.643	S	S	*	*			trans	-49.6	105.8	164.7	-82.6	149.4	0	0	0	106.3	H38 E42	H38-L40 PolarHBondContact O-N 2.96Å; L40-E42 PolarHBondContact O-N 3.19Å
41	S	46.9	Very low	62.3	Low	113 Å²	113	107.9 Å²	107.9	79%	0.79	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-57.9	123.1	176.1	-54.9	0	0	0	0	107	Q39	Q39-S41 VanDerWaalsContact C-N 3.35Å; Q39-S41 PolarHBondContact O-N 2.77Å
42	E	52.2	Low	65.1	Low	179 Å²	179	102.8 Å²	102.8	84%	0.836	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-51.8	134.6	174.9	-74.5	-169.9	155.7	0	0	109	L40 A44	L40-E42 PolarHBondContact O-N 3.19Å; E42-A44 PolarHBondContact O-N 3.44Å
43	P	75.9	Confident	68	Low	121 Å²	121	101.3 Å²	101.3	79%	0.786	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-55.8	132.9	178.2	20.4	-29.2	0	0	0	108.8
44	A	85.8	Confident	70.8	Confident	59 Å²	59	95.2 Å²	95.2	49%	0.488	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-53.1	141.5	-178.4	0	0	0	0	0	110.8	E42 A46	E42-A44 PolarHBondContact O-N 3.44Å; A44-A46 PolarHBondContact O-N 2.84Å
45	P	92.1	Very high	73.6	Confident	48 Å²	48	87 Å²	87	31%	0.312	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-54.6	141.4	-179	-27	34.3	0	0	0	112.4	Y47 R48	P45-Y47 HydrophobicContact CB-CD1 3.58Å; P45-Y47 HydrophobicContact CB-CD2 4.47Å; P45-Y47 HydrophobicContact CB-CE1 3.18Å; P45-Y47 HydrophobicContact CB-CE2 4.13Å; P45-Y47 HydrophobicContact CB-CG 4.2Å; P45-Y47 VanDerWaalsContact CB-CZ 3.5Å; P45-Y47 HydrophobicContact CG-CE1 3.84Å; P45-Y47 PolarHBondContact O-N 3.05Å; P45-Y47 VanDerWaalsContact O-N 3.14Å; P45-R48 WeakPolarHBondContact O-CB 3.12Å; P45-R48 PolarHBondContact O-N 3.41Å
46	A	94.9	Very high	76.5	Confident	22 Å²	22	88.5 Å²	88.5	18%	0.182	48%	0.483	C	S	.	.	G	3₁₀ helix	trans	-59.1	-31.6	-173.4	0	0	0	0	0	112.9	A44 R48 R49 Q117	A44-A46 PolarHBondContact O-N 2.84Å; A46-R48 PolarHBondContact O-N 2.74Å; A46-R48 VanDerWaalsContact O-N 3.14Å; A46-R49 PolarHBondContact O-N 2.91Å; A46-Q117 HydrophobicContact CB-CG 4.17Å
47	Y	95.7	Very high	79	Confident	12 Å²	12	82.6 Å²	82.6	5%	0.047	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-57.5	-28.5	177.9	62.7	-111.7	0	0	0	113.4	P45 R49 I50 T51 S121 T125 T406 T407	P45-Y47 HydrophobicContact CB-CD1 3.58Å; P45-Y47 HydrophobicContact CB-CD2 4.47Å; P45-Y47 HydrophobicContact CB-CE1 3.18Å; P45-Y47 HydrophobicContact CB-CE2 4.13Å; P45-Y47 HydrophobicContact CB-CG 4.2Å; P45-Y47 VanDerWaalsContact CB-CZ 3.5Å; P45-Y47 HydrophobicContact CG-CE1 3.84Å; P45-Y47 PolarHBondContact O-N 3.05Å; P45-Y47 VanDerWaalsContact O-N 3.14Å; Y47-R49 PolarHBondContact O-N 3.05Å; Y47-I50 WeakPolarHBondContact O-CG1 3.4Å; Y47-I50 PolarHBondContact O-N 3.19Å; Y47-T51 PolarHBondContact O-N 3.49Å; Y47-T51 VanDerWaalsContact O-N 3.11Å; Y47-T51 PolarHBondContact O-OG1 3.35Å; Y47-S121 WeakPolarHBondContact CD1-OG 3.39Å; Y47-T125 HydrophobicContact CE1-CG2 4.21Å; Y47-T406 PolarHBondContact OH-O 2.79Å; Y47-T407 HydrophobicContact CD1-CG2 4.4Å; Y47-T407 HydrophobicContact CD2-CG2 4.37Å; Y47-T407 HydrophobicContact CE1-CG2 4.13Å; Y47-T407 VanDerWaalsContact CE2-CA 3.49Å; Y47-T407 HydrophobicContact CE2-CG2 4.13Å
48	R	94.9	Very high	81.8	Confident	136 Å²	136	79.4 Å²	79.4	51%	0.513	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-61.1	-22.2	-178.2	-70.3	-162.7	-177.5	161.8	-2	113.1	P45 A46 P52	P45-R48 WeakPolarHBondContact O-CB 3.12Å; P45-R48 PolarHBondContact O-N 3.41Å; A46-R48 PolarHBondContact O-N 2.74Å; A46-R48 VanDerWaalsContact O-N 3.14Å; R48-P52 WeakPolarHBondContact O-CD 3.15Å
49	R	93.1	Very high	84.6	Confident	163 Å²	163	71 Å²	71	62%	0.615	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-76.7	-25.2	177.9	-59.7	-176.6	-176	-166.6	0.9	112.9	A46 Y47	A46-R49 PolarHBondContact O-N 2.91Å; Y47-R49 PolarHBondContact O-N 3.05Å
50	I	96.3	Very high	87.2	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-25.8	-173.7	65.4	161.5	0	0	0	113.3	Y47 T53 I54 F105 F119 L122	Y47-I50 WeakPolarHBondContact O-CG1 3.4Å; Y47-I50 PolarHBondContact O-N 3.19Å; I50-T53 WeakPolarHBondContact O-CB 3.5Å; I50-T53 PolarHBondContact O-N 3.02Å; I50-I54 HydrophobicContact CD1-CD1 4.09Å; I50-I54 HydrophobicContact CG1-CD1 4.33Å; I50-I54 PolarHBondContact O-N 3.02Å; I50-F105 HydrophobicContact CB-CE1 3.8Å; I50-F105 HydrophobicContact CB-CZ 4.01Å; I50-F105 HydrophobicContact CG2-CE1 3.69Å; I50-F105 HydrophobicContact CG2-CZ 4.13Å; I50-F119 HydrophobicContact CD1-CB 4.3Å; I50-F119 HydrophobicContact CD1-CD1 3.98Å; I50-F119 HydrophobicContact CD1-CD2 3.59Å; I50-F119 HydrophobicContact CD1-CE1 4.16Å; I50-F119 HydrophobicContact CD1-CE2 3.79Å; I50-F119 HydrophobicContact CD1-CG 3.69Å; I50-F119 HydrophobicContact CD1-CZ 4.07Å; I50-L122 HydrophobicContact CD1-CD2 4.36Å
51	T	96.2	Very high	89.7	Confident	8 Å²	8	58.8 Å²	58.8	5%	0.049	31%	0.307	C	S	.	.	H	α-helix	trans	-56.6	-41	-176.9	-55.3	0	0	0	0	114.4	Y47 T53 I54 T55 T407 Q408	Y47-T51 PolarHBondContact O-N 3.49Å; Y47-T51 VanDerWaalsContact O-N 3.11Å; Y47-T51 PolarHBondContact O-OG1 3.35Å; T51-T53 VanDerWaalsContact C-N 3.32Å; T51-T53 PolarHBondContact O-N 3.43Å; T51-I54 PolarHBondContact O-N 2.79Å; T51-T55 PolarHBondContact O-N 2.82Å; T51-T55 PolarHBondContact O-OG1 2.85Å; T51-T55 VanDerWaalsContact O-OG1 3.07Å; T51-T407 PolarHBondContact OG1-O 3.49Å; T51-Q408 WeakPolarHBondContact CG2-O 3.49Å
52	P	96.3	Very high	92	Very high	82 Å²	82	53.4 Å²	53.4	53%	0.532	27%	0.269	S	S	.	.	H	α-helix	trans	-61.5	-39.6	175	-24.1	35.7	0	0	0	112.8	R48 T55 K56	R48-P52 WeakPolarHBondContact O-CD 3.15Å; P52-T55 WeakPolarHBondContact O-CB 3.22Å; P52-T55 PolarHBondContact O-N 2.98Å; P52-K56 PolarHBondContact O-N 2.8Å
53	T	97.1	Very high	93.9	Very high	28 Å²	28	48.1 Å²	48.1	17%	0.172	24%	0.244	C	C	.	.	H	α-helix	trans	-64.8	-44.1	177	-53.9	0	0	0	0	111.4	I50 T51 T55 K56 F57 L103 G104 F105	I50-T53 WeakPolarHBondContact O-CB 3.5Å; I50-T53 PolarHBondContact O-N 3.02Å; T51-T53 VanDerWaalsContact C-N 3.32Å; T51-T53 PolarHBondContact O-N 3.43Å; T53-T55 VanDerWaalsContact C-N 3.28Å; T53-T55 PolarHBondContact O-N 3.37Å; T53-K56 PolarHBondContact O-N 2.48Å; T53-F57 WeakPolarHBondContact O-CB 3.34Å; T53-F57 PolarHBondContact O-N 3.14Å; T53-L103 WeakPolarHBondContact CG2-O 3.11Å; T53-G104 VanDerWaalsContact CG2-C 3.43Å; T53-G104 WeakPolarHBondContact CG2-O 3.31Å; T53-F105 HydrophobicContact CG2-CD1 3.74Å; T53-F105 HydrophobicContact CG2-CD2 4.33Å; T53-F105 HydrophobicContact CG2-CE1 3.71Å; T53-F105 HydrophobicContact CG2-CE2 4.32Å; T53-F105 HydrophobicContact CG2-CG 4.04Å; T53-F105 HydrophobicContact CG2-CZ 4Å
54	I	97.2	Very high	94.6	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-58.1	-42.4	174.4	-64.6	171	0	0	0	110.7	I50 T51 F57 A58 P77 V78 F119 L122	I50-I54 HydrophobicContact CD1-CD1 4.09Å; I50-I54 HydrophobicContact CG1-CD1 4.33Å; I50-I54 PolarHBondContact O-N 3.02Å; T51-I54 PolarHBondContact O-N 2.79Å; I54-F57 PolarHBondContact O-N 2.85Å; I54-A58 WeakPolarHBondContact O-CB 3.44Å; I54-A58 PolarHBondContact O-N 2.93Å; I54-P77 HydrophobicContact CG2-CB 3.94Å; I54-V78 HydrophobicContact CG2-CG2 4.34Å; I54-F119 HydrophobicContact CD1-CE1 3.86Å; I54-F119 HydrophobicContact CD1-CZ 3.96Å; I54-F119 HydrophobicContact CG1-CZ 4.23Å; I54-L122 HydrophobicContact CD1-CD2 3.83Å
55	T	97.5	Very high	94.8	Very high	12 Å²	12	43.6 Å²	43.6	7%	0.074	20%	0.202	C	C	.	.	H	α-helix	trans	-64.6	-45.4	177.4	-57.9	0	0	0	0	111.2	T51 P52 T53 F57 A58 L59 L296 W403	T51-T55 PolarHBondContact O-N 2.82Å; T51-T55 PolarHBondContact O-OG1 2.85Å; T51-T55 VanDerWaalsContact O-OG1 3.07Å; P52-T55 WeakPolarHBondContact O-CB 3.22Å; P52-T55 PolarHBondContact O-N 2.98Å; T53-T55 VanDerWaalsContact C-N 3.28Å; T53-T55 PolarHBondContact O-N 3.37Å; T55-F57 VanDerWaalsContact C-N 3.34Å; T55-F57 PolarHBondContact O-N 3.14Å; T55-A58 VanDerWaalsContact O-CB 3.28Å; T55-A58 WeakPolarHBondContact O-CB 3.19Å; T55-A58 PolarHBondContact O-N 3.34Å; T55-L59 HydrophobicContact CG2-CD1 4.49Å; T55-L59 WeakPolarHBondContact O-CG 3.15Å; T55-L59 PolarHBondContact O-N 3.24Å; T55-L59 VanDerWaalsContact O-N 3.1Å; T55-L296 HydrophobicContact CG2-CD1 4.1Å; T55-W403 HydrophobicContact CG2-CH2 3.85Å
56	K	96.6	Very high	94.7	Very high	144 Å²	144	42.3 Å²	42.3	63%	0.626	20%	0.196	S	C	*	.	H	α-helix	trans	-61.7	-42.7	177.4	-172.4	179.1	179.2	-177.6	0	111.7	P52 T53 L59 R60	P52-K56 PolarHBondContact O-N 2.8Å; T53-K56 PolarHBondContact O-N 2.48Å; K56-L59 PolarHBondContact O-N 3.08Å; K56-R60 PolarHBondContact O-N 2.93Å; K56-R60 VanDerWaalsContact O-N 3.12Å
57	F	95.9	Very high	94.2	Very high	4 Å²	4	44.9 Å²	44.9	2%	0.018	22%	0.217	C	C	.	.	H	α-helix	trans	-58.3	-47.1	173.1	171.8	-101.9	0	0	0	111.6	T53 I54 T55 L59 R60 L61 I80 S81 L84 L103 I330 L332	T53-F57 WeakPolarHBondContact O-CB 3.34Å; T53-F57 PolarHBondContact O-N 3.14Å; I54-F57 PolarHBondContact O-N 2.85Å; T55-F57 VanDerWaalsContact C-N 3.34Å; T55-F57 PolarHBondContact O-N 3.14Å; F57-L59 VanDerWaalsContact C-N 3.31Å; F57-L59 PolarHBondContact O-N 3.31Å; F57-R60 PolarHBondContact O-N 2.81Å; F57-L61 HydrophobicContact CE1-CD2 4.01Å; F57-L61 HydrophobicContact CZ-CD2 4.1Å; F57-L61 WeakPolarHBondContact O-CB 3.29Å; F57-L61 PolarHBondContact O-N 2.92Å; F57-I80 HydrophobicContact CE1-CB 4.36Å; F57-I80 HydrophobicContact CE1-CG2 3.72Å; F57-I80 HydrophobicContact CZ-CG2 3.87Å; F57-S81 WeakPolarHBondContact CD1-OG 3.38Å; F57-L84 HydrophobicContact CZ-CD1 4.18Å; F57-L103 HydrophobicContact CD1-CD2 4.24Å; F57-L103 HydrophobicContact CD2-CD2 3.95Å; F57-L103 HydrophobicContact CE1-CD2 4.17Å; F57-L103 HydrophobicContact CE2-CD2 3.87Å; F57-L103 HydrophobicContact CG-CD2 4.14Å; F57-L103 HydrophobicContact CZ-CD2 3.99Å; F57-I330 HydrophobicContact CE2-CD1 3.57Å; F57-I330 HydrophobicContact CZ-CD1 4.09Å; F57-L332 HydrophobicContact CE2-CD1 4.17Å
58	A	96.3	Very high	93	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-54.1	-47.4	177.4	0	0	0	0	0	112.3	I54 T55 L61 Y62 F75 P77 L410 L413	I54-A58 WeakPolarHBondContact O-CB 3.44Å; I54-A58 PolarHBondContact O-N 2.93Å; T55-A58 VanDerWaalsContact O-CB 3.28Å; T55-A58 WeakPolarHBondContact O-CB 3.19Å; T55-A58 PolarHBondContact O-N 3.34Å; A58-L61 PolarHBondContact O-N 3.18Å; A58-Y62 WeakPolarHBondContact O-CB 3.4Å; A58-Y62 PolarHBondContact O-N 2.84Å; A58-F75 HydrophobicContact CB-CE2 4.48Å; A58-F75 WeakPolarHBondContact O-CZ 3.41Å; A58-P77 HydrophobicContact CB-CB 3.54Å; A58-P77 HydrophobicContact CB-CG 3.32Å; A58-L410 HydrophobicContact CB-CD2 3.77Å; A58-L413 HydrophobicContact CB-CD2 4.22Å
59	L	96.1	Very high	91.7	Very high	7 Å²	7	46 Å²	46	4%	0.037	23%	0.234	C	C	.	.	H	α-helix	trans	-69.1	-35.6	-176.9	-64.3	-178.4	0	0	0	112.2	T55 K56 F57 K63 L291 P293 L296 L413	T55-L59 HydrophobicContact CG2-CD1 4.49Å; T55-L59 WeakPolarHBondContact O-CG 3.15Å; T55-L59 PolarHBondContact O-N 3.24Å; T55-L59 VanDerWaalsContact O-N 3.1Å; K56-L59 PolarHBondContact O-N 3.08Å; F57-L59 VanDerWaalsContact C-N 3.31Å; F57-L59 PolarHBondContact O-N 3.31Å; L59-K63 WeakPolarHBondContact O-CG 3.36Å; L59-K63 PolarHBondContact O-N 3.4Å; L59-L291 HydrophobicContact CD2-CD2 3.67Å; L59-L291 HydrophobicContact CD2-CG 3.69Å; L59-P293 HydrophobicContact CD1-CG 4.05Å; L59-L296 HydrophobicContact CD1-CD1 3.96Å; L59-L296 HydrophobicContact CD2-CD1 4.33Å; L59-L413 HydrophobicContact CD2-CD2 4.08Å
60	R	93.9	Very high	90.8	Very high	92 Å²	92	43.7 Å²	43.7	35%	0.347	24%	0.24	S	C	.	.	H	α-helix	trans	-66.7	-47.7	172.9	-169.8	-178.4	65.7	-166.5	-3.4	111	K56 F57 Y62 K63 E64 G102	K56-R60 PolarHBondContact O-N 2.93Å; K56-R60 VanDerWaalsContact O-N 3.12Å; F57-R60 PolarHBondContact O-N 2.81Å; R60-Y62 VanDerWaalsContact C-N 3.34Å; R60-Y62 PolarHBondContact O-N 2.84Å; R60-K63 PolarHBondContact O-N 3.41Å; R60-E64 PolarHBondContact O-N 2.98Å; R60-G102 PolarHBondContact NH2-O 2.86Å
61	L	93.3	Very high	90.4	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-59.4	-44.3	177.7	174.3	57.7	0	0	0	112	F57 A58 K63 E64 L65 F75 I80 I326 I330	F57-L61 HydrophobicContact CE1-CD2 4.01Å; F57-L61 HydrophobicContact CZ-CD2 4.1Å; F57-L61 WeakPolarHBondContact O-CB 3.29Å; F57-L61 PolarHBondContact O-N 2.92Å; A58-L61 PolarHBondContact O-N 3.18Å; L61-K63 VanDerWaalsContact C-N 3.29Å; L61-K63 PolarHBondContact O-N 3.46Å; L61-E64 PolarHBondContact O-N 3.44Å; L61-L65 HydrophobicContact CD1-CD1 4.06Å; L61-L65 HydrophobicContact CD1-CG 4.11Å; L61-L65 HydrophobicContact CG-CD1 4.09Å; L61-L65 WeakPolarHBondContact O-CG 3.49Å; L61-L65 PolarHBondContact O-N 3.36Å; L61-L65 VanDerWaalsContact O-N 3.09Å; L61-F75 HydrophobicContact CB-CE2 4.39Å; L61-F75 HydrophobicContact CB-CZ 4.23Å; L61-F75 HydrophobicContact CD2-CD2 3.84Å; L61-F75 HydrophobicContact CD2-CE2 3.56Å; L61-F75 HydrophobicContact CD2-CZ 4.04Å; L61-F75 HydrophobicContact CG-CE1 4.47Å; L61-F75 HydrophobicContact CG-CE2 4.02Å; L61-F75 HydrophobicContact CG-CZ 3.95Å; L61-I80 HydrophobicContact CD2-CD1 3.7Å; L61-I326 HydrophobicContact CD1-CG2 3.35Å; L61-I330 HydrophobicContact CD1-CD1 4.34Å; L61-I330 HydrophobicContact CD1-CG2 4.07Å
62	Y	94.9	Very high	90.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-57.6	-41.6	176.1	175.4	-88.2	0	0	0	112.5	A58 R60 E64 L65 A66 I73 F75 E288 L291 L399 L413 K415	A58-Y62 WeakPolarHBondContact O-CB 3.4Å; A58-Y62 PolarHBondContact O-N 2.84Å; R60-Y62 VanDerWaalsContact C-N 3.34Å; R60-Y62 PolarHBondContact O-N 2.84Å; Y62-E64 PolarHBondContact O-N 3.3Å; Y62-L65 PolarHBondContact O-N 2.91Å; Y62-A66 HydrophobicContact CD1-CB 4.45Å; Y62-A66 HydrophobicContact CE1-CB 3.96Å; Y62-A66 VanDerWaalsContact O-CB 3.24Å; Y62-A66 WeakPolarHBondContact O-CB 3.02Å; Y62-A66 PolarHBondContact O-N 3.43Å; Y62-I73 HydrophobicContact CD2-CG2 4.15Å; Y62-I73 HydrophobicContact CE2-CB 4.49Å; Y62-I73 HydrophobicContact CE2-CD1 4.35Å; Y62-I73 HydrophobicContact CE2-CG2 4.25Å; Y62-F75 HydrophobicContact CD2-CE1 4.31Å; Y62-E288 HydrophobicContact CE1-CB 4.33Å; Y62-E288 HydrophobicContact CE1-CG 3.93Å; Y62-E288 PolarHBondContact OH-OE1 2.7Å; Y62-L291 HydrophobicContact CD1-CD2 4.18Å; Y62-L291 HydrophobicContact CE1-CD2 4.39Å; Y62-L399 HydrophobicContact CE2-CD2 4.39Å; Y62-L399 WeakPolarHBondContact OH-CD2 3.41Å; Y62-L413 HydrophobicContact CD2-CD1 4.17Å; Y62-L413 HydrophobicContact CD2-CD2 4.02Å; Y62-L413 HydrophobicContact CD2-CG 3.8Å; Y62-L413 HydrophobicContact CG-CD2 3.95Å; Y62-L413 HydrophobicContact CG-CG 4.24Å; Y62-K415 HydrophobicContact CE2-CB 4.15Å
63	K	92.3	Very high	90.3	Very high	69 Å²	69	41.8 Å²	41.8	30%	0.3	23%	0.23	S	C	.	.	H	α-helix	trans	-64	-40.3	-178.6	-76.6	175.1	176.8	-171.2	0	112.5	L59 R60 L61 A66 A67 E288 A289 L291	L59-K63 WeakPolarHBondContact O-CG 3.36Å; L59-K63 PolarHBondContact O-N 3.4Å; R60-K63 PolarHBondContact O-N 3.41Å; L61-K63 VanDerWaalsContact C-N 3.29Å; L61-K63 PolarHBondContact O-N 3.46Å; K63-A66 PolarHBondContact O-N 2.84Å; K63-A67 PolarHBondContact O-N 3.04Å; K63-E288 WeakPolarHBondContact CE-O 3.44Å; K63-A289 PolarHBondContact NZ-O 3.02Å; K63-L291 WeakPolarHBondContact CE-O 3.42Å; K63-L291 PolarHBondContact NZ-O 3.14Å
64	E	89.7	Confident	90.1	Very high	70 Å²	70	40.5 Å²	40.5	33%	0.327	22%	0.222	S	C	.	.	H	α-helix	trans	-67.3	-46.6	175	-61.7	-50.6	140.7	0	0	111.3	R60 L61 Y62 A66 A67 D68 I330	R60-E64 PolarHBondContact O-N 2.98Å; L61-E64 PolarHBondContact O-N 3.44Å; Y62-E64 PolarHBondContact O-N 3.3Å; E64-A66 PolarHBondContact O-N 2.77Å; E64-A67 WeakPolarHBondContact O-CB 2.99Å; E64-A67 PolarHBondContact O-N 3.41Å; E64-D68 PolarHBondContact O-N 3.19Å; E64-I330 HydrophobicContact CB-CG2 3.66Å; E64-I330 HydrophobicContact CG-CB 4.18Å; E64-I330 HydrophobicContact CG-CG2 3.23Å
65	L	89.8	Confident	89.9	Confident	14 Å²	14	40.5 Å²	40.5	7%	0.073	22%	0.222	C	C	.	.	H	α-helix	trans	-59.6	-35.7	176.4	-66.2	176	0	0	0	112.5	L61 Y62 D69 I73 F75 Y321 I326	L61-L65 HydrophobicContact CD1-CD1 4.06Å; L61-L65 HydrophobicContact CD1-CG 4.11Å; L61-L65 HydrophobicContact CG-CD1 4.09Å; L61-L65 WeakPolarHBondContact O-CG 3.49Å; L61-L65 PolarHBondContact O-N 3.36Å; L61-L65 VanDerWaalsContact O-N 3.09Å; Y62-L65 PolarHBondContact O-N 2.91Å; L65-D69 PolarHBondContact O-N 2.74Å; L65-D69 VanDerWaalsContact O-N 3.12Å; L65-I73 HydrophobicContact CB-CD1 4.16Å; L65-I73 HydrophobicContact CB-CG2 4.16Å; L65-I73 HydrophobicContact CD1-CG2 4.08Å; L65-F75 HydrophobicContact CD1-CD1 3.78Å; L65-F75 HydrophobicContact CD1-CE1 3.88Å; L65-Y321 HydrophobicContact CD1-CD1 4.44Å; L65-Y321 HydrophobicContact CD1-CE1 3.89Å; L65-Y321 HydrophobicContact CD2-CD1 4.02Å; L65-Y321 HydrophobicContact CD2-CE1 3.76Å; L65-Y321 HydrophobicContact CG-CE1 4.43Å; L65-I326 HydrophobicContact CD2-CD1 4.07Å; L65-I326 HydrophobicContact CD2-CG1 4.13Å; L65-I326 HydrophobicContact CD2-CG2 4Å
66	A	90.7	Very high	89.8	Confident	21 Å²	21	39.9 Å²	39.9	17%	0.174	22%	0.219	C	C	.	.	H	α-helix	trans	-76.7	-20.7	178.1	0	0	0	0	0	113.9	Y62 K63 E64 I73	Y62-A66 HydrophobicContact CD1-CB 4.45Å; Y62-A66 HydrophobicContact CE1-CB 3.96Å; Y62-A66 VanDerWaalsContact O-CB 3.24Å; Y62-A66 WeakPolarHBondContact O-CB 3.02Å; Y62-A66 PolarHBondContact O-N 3.43Å; K63-A66 PolarHBondContact O-N 2.84Å; E64-A66 PolarHBondContact O-N 2.77Å; A66-I73 HydrophobicContact CB-CD1 3.81Å
67	A	84.9	Confident	89.7	Confident	76 Å²	76	33 Å²	33	63%	0.628	19%	0.189	S	C	*	.	H	α-helix	trans	-73.2	-37.1	173.6	0	0	0	0	0	111.4	K63 E64	K63-A67 PolarHBondContact O-N 3.04Å; E64-A67 WeakPolarHBondContact O-CB 2.99Å; E64-A67 PolarHBondContact O-N 3.41Å
68	D	71.2	Confident	89.7	Confident	101 Å²	101	32.9 Å²	32.9	54%	0.54	19%	0.188	S	C	.	.	H	α-helix	trans	-89.9	-28.7	-174.6	-76	-6.6	0	0	0	113.9	E64 Q329	E64-D68 PolarHBondContact O-N 3.19Å; D68-Q329 PolarHBondContact OD2-NE2 2.99Å; D68-Q329 PolarHBondContact OD2-OE1 2.82Å
69	D	67.3	Low	89.5	Confident	72 Å²	72	32.9 Å²	32.9	39%	0.385	19%	0.188	S	C	.	.			trans	-121.9	117.6	-171.2	-162.9	-10.1	0	0	0	114.6	L65 G71 K415	L65-D69 PolarHBondContact O-N 2.74Å; L65-D69 VanDerWaalsContact O-N 3.12Å; D69-G71 PolarHBondContact O-N 3.1Å; D69-G71 WeakPolarHBondContact OD1-CA 3.41Å; D69-G71 PolarHBondContact OD1-N 2.85Å; D69-K415 PolarHBondContact O-NZ 3.07Å; D69-K415 VanDerWaalsContact O-NZ 3.11Å
70	P	72.6	Confident	89.3	Confident	114 Å²	114	32.6 Å²	32.6	74%	0.74	19%	0.187	S	C	*	.	S	Bend	trans	-72.2	-9.5	171.1	31.4	-35.3	0	0	0	113.6
71	G	89.7	Confident	89.3	Confident	22 Å²	22	28.3 Å²	28.3	23%	0.227	17%	0.17	C	C	.	.	S	Bend	trans	-89.8	-160.3	-174.5	0	0	0	0	0	115.7	D69 K415 V417	D69-G71 PolarHBondContact O-N 3.1Å; D69-G71 WeakPolarHBondContact OD1-CA 3.41Å; D69-G71 PolarHBondContact OD1-N 2.85Å; G71-K415 WeakPolarHBondContact O-CE 3.49Å; G71-V417 VanDerWaalsContact O-CG2 3.24Å; G71-V417 WeakPolarHBondContact O-CG2 3.33Å
72	N	93.9	Very high	89.3	Confident	27 Å²	27	28.2 Å²	28.2	14%	0.144	17%	0.17	C	C	.	.			trans	-68.5	137.7	177.2	-76.2	-9.3	0	0	0	110.5	I317 K415 V417 N418	N72-I317 HydrophobicContact CB-CD1 3.86Å; N72-I317 HydrophobicContact CB-CG1 4.27Å; N72-K415 WeakPolarHBondContact CA-O 3.16Å; N72-V417 PolarHBondContact OD1-N 3.38Å; N72-N418 PolarHBondContact ND2-O 2.75Å; N72-N418 PolarHBondContact OD1-N 2.86Å
73	I	94.5	Very high	89.1	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	132.8	173.2	-61.9	171.2	0	0	0	107	Y62 L65 A66 F75 Y321 G414 K415	Y62-I73 HydrophobicContact CD2-CG2 4.15Å; Y62-I73 HydrophobicContact CE2-CB 4.49Å; Y62-I73 HydrophobicContact CE2-CD1 4.35Å; Y62-I73 HydrophobicContact CE2-CG2 4.25Å; L65-I73 HydrophobicContact CB-CD1 4.16Å; L65-I73 HydrophobicContact CB-CG2 4.16Å; L65-I73 HydrophobicContact CD1-CG2 4.08Å; A66-I73 HydrophobicContact CB-CD1 3.81Å; I73-F75 HydrophobicContact CG2-CD1 4.11Å; I73-F75 HydrophobicContact CG2-CE1 4.24Å; I73-Y321 WeakPolarHBondContact CA-OH 3.42Å; I73-G414 CarbonylContact O-C 3.31Å; I73-G414 WeakPolarHBondContact O-CA 3.13Å; I73-K415 HydrophobicContact CB-CB 4.14Å; I73-K415 PolarHBondContact N-O 2.72Å; I73-K415 PolarHBondContact O-N 2.82Å
74	F	93.5	Very high	89	Confident	1 Å²	1	25 Å²	25	0%	0.004	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	108.1	177.1	-169.8	-105.4	0	0	0	113.4	I317 G319 Y321 A360 V362 L400 F412	F74-I317 HydrophobicContact CB-CD1 3.81Å; F74-I317 HydrophobicContact CB-CG1 3.73Å; F74-I317 HydrophobicContact CB-CG2 4.43Å; F74-I317 HydrophobicContact CD1-CG2 4.28Å; F74-I317 HydrophobicContact CD2-CD1 4.41Å; F74-I317 HydrophobicContact CD2-CG2 3.77Å; F74-I317 HydrophobicContact CE2-CG2 4.08Å; F74-I317 HydrophobicContact CG-CD1 4.34Å; F74-I317 HydrophobicContact CG-CG1 4.13Å; F74-I317 HydrophobicContact CG-CG2 3.89Å; F74-I317 HydrophobicContact CZ-CG2 4.46Å; F74-G319 VanDerWaalsContact O-CA 3.27Å; F74-G319 WeakPolarHBondContact O-CA 3.43Å; F74-Y321 PolarHBondContact N-OH 2.89Å; F74-Y321 WeakPolarHBondContact O-CE2 3.37Å; F74-A360 HydrophobicContact CD1-CB 3.85Å; F74-A360 HydrophobicContact CE1-CB 3.82Å; F74-V362 HydrophobicContact CD2-CG1 4.49Å; F74-V362 HydrophobicContact CE1-CB 4.07Å; F74-V362 HydrophobicContact CE1-CG1 3.89Å; F74-V362 HydrophobicContact CE2-CB 4.44Å; F74-V362 HydrophobicContact CE2-CG1 3.6Å; F74-V362 HydrophobicContact CZ-CB 3.62Å; F74-V362 HydrophobicContact CZ-CG1 3.24Å; F74-L400 HydrophobicContact CE2-CD2 4.04Å; F74-F412 AromaticContact CE1-CD1 3.51Å; F74-F412 HydrophobicContact CE1-CD1 3.51Å; F74-F412 AromaticContact CE1-CE1 3.93Å; F74-F412 HydrophobicContact CE1-CE1 3.93Å; F74-F412 HydrophobicContact CE1-CG 4.27Å; F74-F412 HydrophobicContact CE2-CB 3.68Å; F74-F412 HydrophobicContact CE2-CD1 4.12Å; F74-F412 HydrophobicContact CE2-CG 4.14Å; F74-F412 HydrophobicContact CZ-CB 3.62Å; F74-F412 AromaticContact CZ-CD1 3.23Å; F74-F412 HydrophobicContact CZ-CD1 3.23Å; F74-F412 HydrophobicContact CZ-CD2 4.46Å; F74-F412 AromaticContact CZ-CE1 3.95Å; F74-F412 HydrophobicContact CZ-CE1 3.95Å; F74-F412 AromaticContact CZ-CG 3.53Å; F74-F412 HydrophobicContact CZ-CG 3.53Å
75	F	93.4	Very high	89.2	Confident	1 Å²	1	21.7 Å²	21.7	0%	0.004	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	168.9	178.9	66.1	-84.1	0	0	0	111.4	A58 L61 Y62 L65 I73 P77 I80 Y321 F412 L413	A58-F75 HydrophobicContact CB-CE2 4.48Å; A58-F75 WeakPolarHBondContact O-CZ 3.41Å; L61-F75 HydrophobicContact CB-CE2 4.39Å; L61-F75 HydrophobicContact CB-CZ 4.23Å; L61-F75 HydrophobicContact CD2-CD2 3.84Å; L61-F75 HydrophobicContact CD2-CE2 3.56Å; L61-F75 HydrophobicContact CD2-CZ 4.04Å; L61-F75 HydrophobicContact CG-CE1 4.47Å; L61-F75 HydrophobicContact CG-CE2 4.02Å; L61-F75 HydrophobicContact CG-CZ 3.95Å; Y62-F75 HydrophobicContact CD2-CE1 4.31Å; L65-F75 HydrophobicContact CD1-CD1 3.78Å; L65-F75 HydrophobicContact CD1-CE1 3.88Å; I73-F75 HydrophobicContact CG2-CD1 4.11Å; I73-F75 HydrophobicContact CG2-CE1 4.24Å; F75-P77 HydrophobicContact CD2-CG 4.17Å; F75-P77 HydrophobicContact CE2-CB 4.49Å; F75-P77 HydrophobicContact CE2-CG 3.76Å; F75-I80 HydrophobicContact CB-CD1 4.14Å; F75-I80 HydrophobicContact CD2-CD1 3.82Å; F75-I80 HydrophobicContact CG-CD1 4.32Å; F75-Y321 HydrophobicContact CB-CD2 3.99Å; F75-Y321 HydrophobicContact CB-CE2 3.69Å; F75-F412 WeakPolarHBondContact O-CA 3.46Å; F75-L413 HydrophobicContact CE1-CB 4.33Å; F75-L413 HydrophobicContact CE1-CD2 4.34Å; F75-L413 HydrophobicContact CE1-CG 4.25Å; F75-L413 HydrophobicContact CZ-CB 4.18Å; F75-L413 HydrophobicContact CZ-CD2 3.89Å; F75-L413 HydrophobicContact CZ-CG 4.21Å; F75-L413 PolarHBondContact N-O 3.43Å; F75-L413 PolarHBondContact O-N 3.37Å
76	S	95	Very high	89.4	Confident	0 Å²	0	21 Å²	21	0%	0	14%	0.137	C	C	.	.			trans	-112.4	109.4	175.5	150.4	0	0	0	0	111.8	V78 S79 I80 I211 H358 L411	S76-V78 PolarHBondContact O-N 3.45Å; S76-S79 PolarHBondContact O-N 2.68Å; S76-S79 WeakPolarHBondContact OG-CB 3.21Å; S76-S79 PolarHBondContact OG-N 2.98Å; S76-I80 PolarHBondContact O-N 2.85Å; S76-I211 WeakPolarHBondContact OG-CD1 3.38Å; S76-H358 PolarHBondContact N-NE2 3.38Å; S76-L411 WeakPolarHBondContact CA-O 3.38Å; S76-L411 WeakPolarHBondContact CB-O 3.41Å; S76-L411 PolarHBondContact OG-O 2.8Å; S76-L411 VanDerWaalsContact OG-O 3.06Å
77	P	95.6	Very high	89.3	Confident	0 Å²	0	20 Å²	20	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-58.7	-47.5	178.9	-25.5	34.8	0	0	0	114.1	I54 A58 F75 S79 I80 S81 L410 L411 L413	I54-P77 HydrophobicContact CG2-CB 3.94Å; A58-P77 HydrophobicContact CB-CB 3.54Å; A58-P77 HydrophobicContact CB-CG 3.32Å; F75-P77 HydrophobicContact CD2-CG 4.17Å; F75-P77 HydrophobicContact CE2-CB 4.49Å; F75-P77 HydrophobicContact CE2-CG 3.76Å; P77-S79 VanDerWaalsContact C-N 3.26Å; P77-S79 PolarHBondContact O-N 3.09Å; P77-I80 PolarHBondContact O-N 2.79Å; P77-S81 WeakPolarHBondContact O-CB 3.34Å; P77-S81 PolarHBondContact O-N 2.81Å; P77-S81 PolarHBondContact O-OG 3.34Å; P77-S81 VanDerWaalsContact O-OG 3.07Å; P77-L410 HydrophobicContact CG-CD2 3.99Å; P77-L410 HydrophobicContact CG-CG 3.99Å; P77-L411 WeakPolarHBondContact CD-O 3.35Å; P77-L413 HydrophobicContact CG-CB 4.41Å
78	V	95	Very high	89.6	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-54.8	-46.3	179	167.6	0	0	0	0	110.8	I54 S76 T82 L122 L126 L410	I54-V78 HydrophobicContact CG2-CG2 4.34Å; S76-V78 PolarHBondContact O-N 3.45Å; V78-T82 WeakPolarHBondContact O-CB 3.39Å; V78-T82 PolarHBondContact O-N 2.74Å; V78-T82 PolarHBondContact O-OG1 3.03Å; V78-L122 HydrophobicContact CG1-CD2 4.12Å; V78-L122 HydrophobicContact CG2-CD2 4.49Å; V78-L126 HydrophobicContact CG1-CD1 3.86Å; V78-L410 WeakPolarHBondContact CG2-O 3.46Å
79	S	92.1	Very high	90.6	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-67.8	-45.3	-177	-150.2	0	0	0	0	112.3	S76 P77 T82 T83 N209	S76-S79 PolarHBondContact O-N 2.68Å; S76-S79 WeakPolarHBondContact OG-CB 3.21Å; S76-S79 PolarHBondContact OG-N 2.98Å; P77-S79 VanDerWaalsContact C-N 3.26Å; P77-S79 PolarHBondContact O-N 3.09Å; S79-T82 PolarHBondContact O-N 2.86Å; S79-T83 WeakPolarHBondContact O-CB 3.47Å; S79-T83 PolarHBondContact O-N 3.41Å; S79-T83 PolarHBondContact O-OG1 3.39Å; S79-N209 WeakPolarHBondContact CB-OD1 3.32Å; S79-N209 PolarHBondContact O-ND2 3.22Å; S79-N209 PolarHBondContact O-OD1 2.85Å; S79-N209 PolarHBondContact OG-ND2 3.39Å; S79-N209 PolarHBondContact OG-OD1 2.89Å
80	I	92.2	Very high	91.6	Very high	2 Å²	2	10.1 Å²	10.1	1%	0.01	7%	0.065	C	C	.	.	H	α-helix	trans	-62.9	-49.5	174.5	-66.6	176.4	0	0	0	111.1	F57 L61 F75 S76 P77 T82 T83 L84 L323 H358	F57-I80 HydrophobicContact CE1-CB 4.36Å; F57-I80 HydrophobicContact CE1-CG2 3.72Å; F57-I80 HydrophobicContact CZ-CG2 3.87Å; L61-I80 HydrophobicContact CD2-CD1 3.7Å; F75-I80 HydrophobicContact CB-CD1 4.14Å; F75-I80 HydrophobicContact CD2-CD1 3.82Å; F75-I80 HydrophobicContact CG-CD1 4.32Å; S76-I80 PolarHBondContact O-N 2.85Å; P77-I80 PolarHBondContact O-N 2.79Å; I80-T82 VanDerWaalsContact C-N 3.31Å; I80-T82 PolarHBondContact O-N 2.92Å; I80-T83 VanDerWaalsContact O-CB 3.3Å; I80-T83 WeakPolarHBondContact O-CB 3.39Å; I80-T83 PolarHBondContact O-N 3.1Å; I80-T83 VanDerWaalsContact O-N 3.12Å; I80-L84 HydrophobicContact CG2-CD1 3.97Å; I80-L84 HydrophobicContact CG2-CG 4.5Å; I80-L84 WeakPolarHBondContact O-CG 3.25Å; I80-L84 PolarHBondContact O-N 2.84Å; I80-L323 HydrophobicContact CD1-CD2 4.16Å; I80-L323 HydrophobicContact CG1-CD2 4.4Å; I80-L323 HydrophobicContact CG2-CD1 3.95Å; I80-L323 HydrophobicContact CG2-CD2 4.31Å; I80-H358 HydrophobicContact CD1-CB 4.31Å; I80-H358 HydrophobicContact CG1-CB 3.92Å; I80-H358 VanDerWaalsContact CG1-CG 3.45Å
81	S	94.6	Very high	92.4	Very high	1 Å²	1	5.4 Å²	5.4	1%	0.007	4%	0.036	C	C	.	.	H	α-helix	trans	-61.4	-41.7	-179.8	-58.8	0	0	0	0	111.5	F57 P77 T83 L84 T85	F57-S81 WeakPolarHBondContact CD1-OG 3.38Å; P77-S81 WeakPolarHBondContact O-CB 3.34Å; P77-S81 PolarHBondContact O-N 2.81Å; P77-S81 PolarHBondContact O-OG 3.34Å; P77-S81 VanDerWaalsContact O-OG 3.07Å; S81-T83 VanDerWaalsContact C-N 3.28Å; S81-T83 PolarHBondContact O-N 2.81Å; S81-L84 PolarHBondContact O-N 3.33Å; S81-T85 PolarHBondContact O-N 3.37Å; S81-T85 PolarHBondContact O-OG1 3.35Å
82	T	93.4	Very high	92.3	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-58	-42.9	175.1	-62.5	0	0	0	0	111.8	V78 S79 I80 T85 L86 L123 N139 Y161	V78-T82 WeakPolarHBondContact O-CB 3.39Å; V78-T82 PolarHBondContact O-N 2.74Å; V78-T82 PolarHBondContact O-OG1 3.03Å; S79-T82 PolarHBondContact O-N 2.86Å; I80-T82 VanDerWaalsContact C-N 3.31Å; I80-T82 PolarHBondContact O-N 2.92Å; T82-T85 PolarHBondContact O-N 3.02Å; T82-L86 VanDerWaalsContact O-CB 3.28Å; T82-L86 WeakPolarHBondContact O-CB 3.32Å; T82-L86 PolarHBondContact O-N 2.83Å; T82-L123 HydrophobicContact CG2-CD1 3.7Å; T82-L123 HydrophobicContact CG2-CD2 4.02Å; T82-L123 HydrophobicContact CG2-CG 4.35Å; T82-N139 VanDerWaalsContact CG2-ND2 3.27Å; T82-N139 WeakPolarHBondContact CG2-ND2 3.34Å; T82-Y161 HydrophobicContact CG2-CD1 3.68Å; T82-Y161 HydrophobicContact CG2-CE1 4.04Å
83	T	89.6	Confident	92	Very high	1 Å²	1	10.3 Å²	10.3	1%	0.006	6%	0.064	C	C	.	.	H	α-helix	trans	-62.4	-47.1	-179.7	-60.5	0	0	0	0	111.3	S79 I80 S81 L86 L87 L207 N209 V356	S79-T83 WeakPolarHBondContact O-CB 3.47Å; S79-T83 PolarHBondContact O-N 3.41Å; S79-T83 PolarHBondContact O-OG1 3.39Å; I80-T83 VanDerWaalsContact O-CB 3.3Å; I80-T83 WeakPolarHBondContact O-CB 3.39Å; I80-T83 PolarHBondContact O-N 3.1Å; I80-T83 VanDerWaalsContact O-N 3.12Å; S81-T83 VanDerWaalsContact C-N 3.28Å; S81-T83 PolarHBondContact O-N 2.81Å; T83-L86 PolarHBondContact O-N 3.47Å; T83-L87 WeakPolarHBondContact O-CB 3.44Å; T83-L87 PolarHBondContact O-N 3.19Å; T83-L207 HydrophobicContact CG2-CD2 3.26Å; T83-L207 HydrophobicContact CG2-CG 3.69Å; T83-L207 WeakPolarHBondContact O-CD2 3.33Å; T83-N209 HydrophobicContact CG2-CB 4.17Å; T83-N209 WeakPolarHBondContact OG1-CB 3.39Å; T83-N209 PolarHBondContact OG1-ND2 2.98Å; T83-V356 HydrophobicContact CG2-CG1 3.38Å
84	L	91.4	Very high	91.8	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-67.8	-42.5	179.4	-66.4	174.7	0	0	0	111.7	F57 I80 S81 L86 L87 S88 I99 L103 L323 L327 I335	F57-L84 HydrophobicContact CZ-CD1 4.18Å; I80-L84 HydrophobicContact CG2-CD1 3.97Å; I80-L84 HydrophobicContact CG2-CG 4.5Å; I80-L84 WeakPolarHBondContact O-CG 3.25Å; I80-L84 PolarHBondContact O-N 2.84Å; S81-L84 PolarHBondContact O-N 3.33Å; L84-L86 VanDerWaalsContact C-N 3.33Å; L84-L86 PolarHBondContact O-N 3.14Å; L84-L87 WeakPolarHBondContact O-CB 3.16Å; L84-L87 PolarHBondContact O-N 3.43Å; L84-L87 VanDerWaalsContact O-N 3.16Å; L84-S88 PolarHBondContact O-N 3.08Å; L84-I99 HydrophobicContact CB-CG2 3.99Å; L84-I99 VanDerWaalsContact O-CG2 3.27Å; L84-I99 WeakPolarHBondContact O-CG2 3.4Å; L84-L103 HydrophobicContact CB-CD1 3.96Å; L84-L103 HydrophobicContact CB-CD2 4.15Å; L84-L103 HydrophobicContact CB-CG 4.28Å; L84-L103 HydrophobicContact CD1-CD2 3.7Å; L84-L103 HydrophobicContact CD1-CG 4.39Å; L84-L323 HydrophobicContact CD2-CD1 4.45Å; L84-L327 HydrophobicContact CD1-CD1 4.28Å; L84-L327 HydrophobicContact CD1-CD2 3.87Å; L84-L327 HydrophobicContact CD2-CD1 3.58Å; L84-I335 HydrophobicContact CD2-CD1 4.32Å
85	T	93.8	Very high	91.5	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-69.5	-30.2	175.9	-44.6	0	0	0	0	112.5	S81 T82 L87 S88 L100 L103 I115 H116 F119 Y161	S81-T85 PolarHBondContact O-N 3.37Å; S81-T85 PolarHBondContact O-OG1 3.35Å; T82-T85 PolarHBondContact O-N 3.02Å; T85-L87 VanDerWaalsContact C-N 3.33Å; T85-S88 PolarHBondContact O-N 3.03Å; T85-S88 PolarHBondContact O-OG 3.24Å; T85-L100 HydrophobicContact CG2-CD2 3.7Å; T85-L103 WeakPolarHBondContact OG1-CD1 3.45Å; T85-I115 HydrophobicContact CG2-CG2 3.91Å; T85-H116 PolarHBondContact O-CE1 3.36Å; T85-F119 HydrophobicContact CG2-CD2 3.65Å; T85-F119 HydrophobicContact CG2-CE2 3.72Å; T85-F119 HydrophobicContact CG2-CG 4.46Å; T85-F119 WeakPolarHBondContact OG1-CE2 3.35Å; T85-F119 WeakPolarHBondContact OG1-CZ 3.5Å; T85-Y161 WeakPolarHBondContact CB-OH 3.41Å; T85-Y161 WeakPolarHBondContact CG2-OH 3.08Å; T85-Y161 PolarHBondContact O-OH 2.78Å
86	L	92.5	Very high	91.4	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-64.6	-41.4	170	179.5	157.8	0	0	0	110.8	T82 T83 L84 S88 L89 N139 I157 Y161 A163 L207	T82-L86 VanDerWaalsContact O-CB 3.28Å; T82-L86 WeakPolarHBondContact O-CB 3.32Å; T82-L86 PolarHBondContact O-N 2.83Å; T83-L86 PolarHBondContact O-N 3.47Å; L84-L86 VanDerWaalsContact C-N 3.33Å; L84-L86 PolarHBondContact O-N 3.14Å; L86-S88 VanDerWaalsContact C-N 3.32Å; L86-S88 PolarHBondContact O-N 2.84Å; L86-L89 WeakPolarHBondContact O-CB 2.91Å; L86-L89 PolarHBondContact O-N 2.99Å; L86-N139 HydrophobicContact CD1-CB 3.87Å; L86-I157 HydrophobicContact CD2-CG2 4.43Å; L86-I157 HydrophobicContact CG-CG2 4.27Å; L86-Y161 HydrophobicContact CB-CD1 3.98Å; L86-Y161 HydrophobicContact CB-CD2 4.42Å; L86-Y161 HydrophobicContact CB-CE1 4.13Å; L86-Y161 HydrophobicContact CB-CG 4.14Å; L86-Y161 HydrophobicContact CD1-CD1 4.39Å; L86-Y161 HydrophobicContact CD1-CG 4.05Å; L86-Y161 HydrophobicContact CG-CD2 4.48Å; L86-Y161 HydrophobicContact CG-CG 4.28Å; L86-A163 HydrophobicContact CD1-CB 3.48Å; L86-A163 VanDerWaalsContact CD1-CB 3.48Å; L86-L207 HydrophobicContact CD2-CD1 3.96Å; L86-L207 HydrophobicContact CD2-CD2 4.05Å
87	L	88.8	Confident	91.3	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-63.8	-38.2	178.2	-177.4	62.3	0	0	0	111.7	T83 L84 T85 L89 G90 I99 M205 L207 L336 F342 V356	T83-L87 WeakPolarHBondContact O-CB 3.44Å; T83-L87 PolarHBondContact O-N 3.19Å; L84-L87 WeakPolarHBondContact O-CB 3.16Å; L84-L87 PolarHBondContact O-N 3.43Å; L84-L87 VanDerWaalsContact O-N 3.16Å; T85-L87 VanDerWaalsContact C-N 3.33Å; L87-L89 VanDerWaalsContact C-N 3.26Å; L87-L89 PolarHBondContact O-N 3.24Å; L87-G90 PolarHBondContact O-N 3.2Å; L87-I99 HydrophobicContact CD2-CD1 4.38Å; L87-I99 HydrophobicContact CG-CD1 4.25Å; L87-M205 HydrophobicContact CD1-CE 3.41Å; L87-M205 VanDerWaalsContact CD1-CE 3.41Å; L87-M205 HydrophobicContact CD1-SD 4.43Å; L87-L207 HydrophobicContact CB-CD2 4.42Å; L87-L336 HydrophobicContact CD2-CD2 3.32Å; L87-F342 HydrophobicContact CD1-CD1 3.95Å; L87-F342 HydrophobicContact CD1-CE1 3.42Å; L87-F342 VanDerWaalsContact CD1-CE1 3.42Å; L87-F342 HydrophobicContact CD1-CE2 4.46Å; L87-F342 HydrophobicContact CD1-CZ 3.71Å; L87-F342 HydrophobicContact CD2-CE1 4.14Å; L87-F342 HydrophobicContact CD2-CZ 3.81Å; L87-F342 HydrophobicContact CG-CD1 4.43Å; L87-F342 HydrophobicContact CG-CE1 3.47Å; L87-F342 VanDerWaalsContact CG-CE1 3.47Å; L87-F342 HydrophobicContact CG-CZ 3.68Å; L87-V356 HydrophobicContact CD2-CG2 4.45Å
88	S	91.8	Very high	91	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-62.1	-29.7	178.2	84.7	0	0	0	0	113.3	L84 T85 L86 G90 A91 S96 H116	L84-S88 PolarHBondContact O-N 3.08Å; T85-S88 PolarHBondContact O-N 3.03Å; T85-S88 PolarHBondContact O-OG 3.24Å; L86-S88 VanDerWaalsContact C-N 3.32Å; L86-S88 PolarHBondContact O-N 2.84Å; S88-G90 PolarHBondContact O-N 2.89Å; S88-G90 VanDerWaalsContact O-N 3.16Å; S88-A91 WeakPolarHBondContact O-CB 3.45Å; S88-A91 PolarHBondContact O-N 2.76Å; S88-S96 WeakPolarHBondContact CB-OG 3.41Å; S88-S96 PolarHBondContact O-OG 3.2Å; S88-H116 PolarHBondContact OG-CE1 3.3Å
89	L	91.4	Very high	90.8	Very high	41 Å²	41	22.5 Å²	22.5	22%	0.215	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-26.7	172.9	-78	179.9	0	0	0	113.8	L86 L87 H116 Y153 I157 L160 Y161	L86-L89 WeakPolarHBondContact O-CB 2.91Å; L86-L89 PolarHBondContact O-N 2.99Å; L87-L89 VanDerWaalsContact C-N 3.26Å; L87-L89 PolarHBondContact O-N 3.24Å; L89-H116 WeakPolarHBondContact CD2-CE1 3.32Å; L89-H116 VanDerWaalsContact CG-CE1 3.47Å; L89-H116 WeakPolarHBondContact CG-CE1 3.34Å; L89-Y153 HydrophobicContact CB-CE2 4.19Å; L89-I157 HydrophobicContact CD1-CG2 4.21Å; L89-L160 HydrophobicContact CD1-CD1 3.94Å; L89-L160 HydrophobicContact CD2-CD1 4.07Å; L89-Y161 HydrophobicContact CD1-CD2 3.66Å; L89-Y161 HydrophobicContact CD1-CE2 3.34Å; L89-Y161 HydrophobicContact CG-CE2 4.06Å
90	G	88.8	Confident	91	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-8.1	179.3	0	0	0	0	0	113.2	L87 S88 Y153 F342 G344 V345	L87-G90 PolarHBondContact O-N 3.2Å; S88-G90 PolarHBondContact O-N 2.89Å; S88-G90 VanDerWaalsContact O-N 3.16Å; G90-Y153 VanDerWaalsContact CA-CE2 3.4Å; G90-F342 CarbonylContact O-C 3.53Å; G90-F342 VanDerWaalsContact O-C 3.31Å; G90-F342 VanDerWaalsContact O-CA 3.31Å; G90-F342 WeakPolarHBondContact O-CA 3.18Å; G90-G344 CarbonylContact O-C 3.58Å; G90-G344 WeakPolarHBondContact O-CA 3.24Å; G90-G344 PolarHBondContact O-N 3.22Å; G90-G344 VanDerWaalsContact O-N 3.09Å; G90-V345 PolarHBondContact O-N 3.01Å
91	A	89.3	Confident	91	Very high	14 Å²	14	27.3 Å²	27.3	12%	0.116	16%	0.156	C	C	.	.	S	Bend	trans	-91.9	153.6	-173.7	0	0	0	0	0	112	S88 T95 I99 D341 F342	S88-A91 WeakPolarHBondContact O-CB 3.45Å; S88-A91 PolarHBondContact O-N 2.76Å; A91-T95 HydrophobicContact CB-CG2 3.78Å; A91-I99 HydrophobicContact CB-CD1 4.47Å; A91-D341 CarbonylContact C-O 3.47Å; A91-D341 VanDerWaalsContact CA-O 3.24Å; A91-D341 WeakPolarHBondContact CA-O 3.38Å; A91-F342 HydrophobicContact CB-CD1 3.93Å; A91-F342 HydrophobicContact CB-CE1 3.8Å
92	Q	88.7	Confident	90.8	Very high	81 Å²	81	28 Å²	28	38%	0.379	16%	0.162	S	C	.	.			trans	-74.7	166.7	166	-68.2	-62.5	-19	0	0	111.3	D94 T95 S96 D341 S343	Q92-D94 VanDerWaalsContact C-N 3.34Å; Q92-D94 PolarHBondContact O-N 2.98Å; Q92-D94 VanDerWaalsContact O-N 3.15Å; Q92-T95 PolarHBondContact O-N 2.81Å; Q92-T95 VanDerWaalsContact O-N 3.09Å; Q92-S96 WeakPolarHBondContact O-CB 3.23Å; Q92-S96 PolarHBondContact O-N 2.99Å; Q92-D341 HydrophobicContact CB-CB 4.08Å; Q92-D341 HydrophobicContact CG-CB 4.07Å; Q92-D341 WeakPolarHBondContact CG-OD1 3.35Å; Q92-D341 VanDerWaalsContact CG-OD2 3.31Å; Q92-D341 WeakPolarHBondContact CG-OD2 3.28Å; Q92-D341 PolarHBondContact N-O 3Å; Q92-S343 WeakPolarHBondContact CG-OG 3.36Å; Q92-S343 PolarHBondContact NE2-OG 3.08Å
93	A	87.4	Confident	90.8	Very high	71 Å²	71	28 Å²	28	59%	0.587	16%	0.163	S	C	*	.	H	α-helix	trans	-47.4	-48.9	-169.2	0	0	0	0	0	114.1	S96 A97	A93-S96 PolarHBondContact O-N 3.26Å; A93-A97 VanDerWaalsContact O-CB 3.24Å; A93-A97 WeakPolarHBondContact O-CB 3.37Å; A93-A97 PolarHBondContact O-N 3.06Å
94	D	88.7	Confident	91	Very high	135 Å²	135	29.8 Å²	29.8	72%	0.722	18%	0.181	S	C	*	.	H	α-helix	trans	-66.8	-46.5	-178.3	-63.2	-18.7	0	0	0	111.9	Q92 A97 L98	Q92-D94 VanDerWaalsContact C-N 3.34Å; Q92-D94 PolarHBondContact O-N 2.98Å; Q92-D94 VanDerWaalsContact O-N 3.15Å; D94-A97 PolarHBondContact O-N 3.31Å; D94-L98 VanDerWaalsContact O-CG 3.3Å; D94-L98 WeakPolarHBondContact O-CG 3.14Å; D94-L98 PolarHBondContact O-N 2.54Å
95	T	88.3	Confident	91.2	Very high	13 Å²	13	30 Å²	30	8%	0.08	18%	0.182	C	C	.	.	H	α-helix	trans	-67.5	-38.4	177.9	-56.7	0	0	0	0	111.9	A91 Q92 L98 I99 A340 D341 F342	A91-T95 HydrophobicContact CB-CG2 3.78Å; Q92-T95 PolarHBondContact O-N 2.81Å; Q92-T95 VanDerWaalsContact O-N 3.09Å; T95-L98 PolarHBondContact O-N 2.85Å; T95-I99 HydrophobicContact CG2-CD1 4.22Å; T95-I99 VanDerWaalsContact O-CG1 3.31Å; T95-I99 WeakPolarHBondContact O-CG1 3.34Å; T95-I99 PolarHBondContact O-N 3.23Å; T95-I99 VanDerWaalsContact O-N 3.16Å; T95-A340 HydrophobicContact CG2-CB 3.86Å; T95-D341 PolarHBondContact OG1-N 3.21Å; T95-F342 HydrophobicContact CG2-CE1 4.28Å; T95-F342 HydrophobicContact CG2-CZ 4.15Å
96	S	91.5	Very high	91.3	Very high	1 Å²	1	33 Å²	33	1%	0.007	20%	0.198	C	C	.	.	H	α-helix	trans	-62.4	-47.5	174.4	-173.7	0	0	0	0	110.4	S88 Q92 A93 L98 I99 L100 E112	S88-S96 WeakPolarHBondContact CB-OG 3.41Å; S88-S96 PolarHBondContact O-OG 3.2Å; Q92-S96 WeakPolarHBondContact O-CB 3.23Å; Q92-S96 PolarHBondContact O-N 2.99Å; A93-S96 PolarHBondContact O-N 3.26Å; S96-L98 PolarHBondContact O-N 3.43Å; S96-I99 PolarHBondContact O-N 2.59Å; S96-L100 WeakPolarHBondContact O-CG 3.03Å; S96-L100 PolarHBondContact O-N 3.14Å; S96-E112 PolarHBondContact OG-OE1 3.48Å
97	A	92.1	Very high	91.4	Very high	26 Å²	26	35 Å²	35	22%	0.215	21%	0.208	C	C	.	.	H	α-helix	trans	-59.2	-46.4	179	0	0	0	0	0	111.7	A93 D94 I99 L100 E101 L107	A93-A97 VanDerWaalsContact O-CB 3.24Å; A93-A97 WeakPolarHBondContact O-CB 3.37Å; A93-A97 PolarHBondContact O-N 3.06Å; D94-A97 PolarHBondContact O-N 3.31Å; A97-I99 VanDerWaalsContact C-N 3.31Å; A97-I99 PolarHBondContact O-N 2.91Å; A97-L100 PolarHBondContact O-N 3.32Å; A97-E101 VanDerWaalsContact O-CB 3.31Å; A97-E101 WeakPolarHBondContact O-CB 3.35Å; A97-E101 WeakPolarHBondContact O-CG 3.34Å; A97-E101 PolarHBondContact O-N 3.26Å; A97-L107 HydrophobicContact CB-CD1 3.71Å
98	L	90.2	Very high	91.6	Very high	84 Å²	84	41 Å²	41	44%	0.44	25%	0.245	S	C	.	.	H	α-helix	trans	-56.1	-43.8	176.2	-73.4	170.8	0	0	0	112.6	D94 T95 S96 G102 I335	D94-L98 VanDerWaalsContact O-CG 3.3Å; D94-L98 WeakPolarHBondContact O-CG 3.14Å; D94-L98 PolarHBondContact O-N 2.54Å; T95-L98 PolarHBondContact O-N 2.85Å; S96-L98 PolarHBondContact O-N 3.43Å; L98-G102 PolarHBondContact O-N 3.32Å; L98-I335 HydrophobicContact CB-CG2 3.87Å
99	I	91.4	Very high	91.7	Very high	0 Å²	0	48 Å²	48	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-64.6	-47.7	178.4	-67.4	164.3	0	0	0	110.9	L84 L87 A91 T95 S96 A97 L103 I335 F342	L84-I99 HydrophobicContact CB-CG2 3.99Å; L84-I99 VanDerWaalsContact O-CG2 3.27Å; L84-I99 WeakPolarHBondContact O-CG2 3.4Å; L87-I99 HydrophobicContact CD2-CD1 4.38Å; L87-I99 HydrophobicContact CG-CD1 4.25Å; A91-I99 HydrophobicContact CB-CD1 4.47Å; T95-I99 HydrophobicContact CG2-CD1 4.22Å; T95-I99 VanDerWaalsContact O-CG1 3.31Å; T95-I99 WeakPolarHBondContact O-CG1 3.34Å; T95-I99 PolarHBondContact O-N 3.23Å; T95-I99 VanDerWaalsContact O-N 3.16Å; S96-I99 PolarHBondContact O-N 2.59Å; A97-I99 VanDerWaalsContact C-N 3.31Å; A97-I99 PolarHBondContact O-N 2.91Å; I99-L103 WeakPolarHBondContact O-CG 3.4Å; I99-L103 PolarHBondContact O-N 2.85Å; I99-I335 HydrophobicContact CG1-CB 3.78Å; I99-I335 HydrophobicContact CG1-CD1 4.47Å; I99-I335 HydrophobicContact CG1-CG2 3.73Å; I99-F342 HydrophobicContact CD1-CE1 4.22Å; I99-F342 HydrophobicContact CD1-CZ 4.29Å
100	L	94.4	Very high	91.8	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-71.3	-43.3	-175.5	-63.6	176.5	0	0	0	112.3	T85 S96 A97 G102 L103 G104 F105 L107 E112 I115	T85-L100 HydrophobicContact CG2-CD2 3.7Å; S96-L100 WeakPolarHBondContact O-CG 3.03Å; S96-L100 PolarHBondContact O-N 3.14Å; A97-L100 PolarHBondContact O-N 3.32Å; L100-G102 VanDerWaalsContact C-N 3.32Å; L100-L103 WeakPolarHBondContact O-CB 3.23Å; L100-L103 PolarHBondContact O-N 3.09Å; L100-G104 PolarHBondContact O-N 3.29Å; L100-F105 HydrophobicContact CB-CD2 4.47Å; L100-F105 WeakPolarHBondContact O-CB 3.43Å; L100-F105 VanDerWaalsContact O-CD2 3.32Å; L100-F105 WeakPolarHBondContact O-CD2 3.27Å; L100-F105 PolarHBondContact O-N 3.33Å; L100-L107 HydrophobicContact CB-CD2 3.94Å; L100-L107 HydrophobicContact CD1-CD2 4.04Å; L100-E112 HydrophobicContact CD1-CB 4.15Å; L100-E112 HydrophobicContact CD1-CG 3.65Å; L100-I115 HydrophobicContact CB-CD1 4.48Å; L100-I115 HydrophobicContact CD1-CD1 4.23Å; L100-I115 HydrophobicContact CD2-CG2 4.23Å
101	E	93.1	Very high	92.1	Very high	104 Å²	104	50.5 Å²	50.5	49%	0.486	30%	0.296	S	S	.	.	H	α-helix	trans	-65.7	-38.6	175.8	-70.3	-176	165.8	0	0	111.4	A97 L103 G104 F105 L107	A97-E101 VanDerWaalsContact O-CB 3.31Å; A97-E101 WeakPolarHBondContact O-CB 3.35Å; A97-E101 WeakPolarHBondContact O-CG 3.34Å; A97-E101 PolarHBondContact O-N 3.26Å; E101-L103 VanDerWaalsContact C-N 3.3Å; E101-L103 PolarHBondContact O-N 2.95Å; E101-G104 WeakPolarHBondContact O-CA 3.44Å; E101-G104 PolarHBondContact O-N 3.02Å; E101-F105 WeakPolarHBondContact CA-O 3.45Å; E101-L107 HydrophobicContact CG-CD1 3.87Å; E101-L107 HydrophobicContact CG-CG 3.94Å
102	G	91.1	Very high	92.4	Very high	14 Å²	14	53.4 Å²	53.4	14%	0.144	31%	0.307	C	S	.	.	H	α-helix	trans	-69.9	-26	174.9	0	0	0	0	0	112.8	R60 L98 L100 G104 L332	R60-G102 PolarHBondContact NH2-O 2.86Å; L98-G102 PolarHBondContact O-N 3.32Å; L100-G102 VanDerWaalsContact C-N 3.32Å; G102-G104 PolarHBondContact O-N 3.49Å; G102-L332 VanDerWaalsContact CA-CD2 3.41Å; G102-L332 WeakPolarHBondContact O-CD1 3.26Å
103	L	92.9	Very high	92.7	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.01	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-10.7	163.3	-74.8	170.8	0	0	0	113.3	T53 F57 L84 T85 I99 L100 E101 F105	T53-L103 WeakPolarHBondContact CG2-O 3.11Å; F57-L103 HydrophobicContact CD1-CD2 4.24Å; F57-L103 HydrophobicContact CD2-CD2 3.95Å; F57-L103 HydrophobicContact CE1-CD2 4.17Å; F57-L103 HydrophobicContact CE2-CD2 3.87Å; F57-L103 HydrophobicContact CG-CD2 4.14Å; F57-L103 HydrophobicContact CZ-CD2 3.99Å; L84-L103 HydrophobicContact CB-CD1 3.96Å; L84-L103 HydrophobicContact CB-CD2 4.15Å; L84-L103 HydrophobicContact CB-CG 4.28Å; L84-L103 HydrophobicContact CD1-CD2 3.7Å; L84-L103 HydrophobicContact CD1-CG 4.39Å; T85-L103 WeakPolarHBondContact OG1-CD1 3.45Å; I99-L103 WeakPolarHBondContact O-CG 3.4Å; I99-L103 PolarHBondContact O-N 2.85Å; L100-L103 WeakPolarHBondContact O-CB 3.23Å; L100-L103 PolarHBondContact O-N 3.09Å; E101-L103 VanDerWaalsContact C-N 3.3Å; E101-L103 PolarHBondContact O-N 2.95Å; L103-F105 HydrophobicContact CB-CD2 3.8Å; L103-F105 HydrophobicContact CB-CE2 3.84Å; L103-F105 HydrophobicContact CD1-CD2 4.44Å; L103-F105 HydrophobicContact CD1-CE2 4.04Å
104	G	93.9	Very high	93.1	Very high	37 Å²	37	52 Å²	52	38%	0.381	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.5	12.3	178.9	0	0	0	0	0	114.1	T53 L100 E101 G102	T53-G104 VanDerWaalsContact CG2-C 3.43Å; T53-G104 WeakPolarHBondContact CG2-O 3.31Å; L100-G104 PolarHBondContact O-N 3.29Å; E101-G104 WeakPolarHBondContact O-CA 3.44Å; E101-G104 PolarHBondContact O-N 3.02Å; G102-G104 PolarHBondContact O-N 3.49Å
105	F	95.6	Very high	93.5	Very high	7 Å²	7	45.5 Å²	45.5	3%	0.031	27%	0.267	C	S	.	.			trans	-77.8	131.4	174.8	-65.9	-71.5	0	0	0	110.8	I50 T53 L100 E101 L103 L107 I115 F119	I50-F105 HydrophobicContact CB-CE1 3.8Å; I50-F105 HydrophobicContact CB-CZ 4.01Å; I50-F105 HydrophobicContact CG2-CE1 3.69Å; I50-F105 HydrophobicContact CG2-CZ 4.13Å; T53-F105 HydrophobicContact CG2-CD1 3.74Å; T53-F105 HydrophobicContact CG2-CD2 4.33Å; T53-F105 HydrophobicContact CG2-CE1 3.71Å; T53-F105 HydrophobicContact CG2-CE2 4.32Å; T53-F105 HydrophobicContact CG2-CG 4.04Å; T53-F105 HydrophobicContact CG2-CZ 4Å; L100-F105 HydrophobicContact CB-CD2 4.47Å; L100-F105 WeakPolarHBondContact O-CB 3.43Å; L100-F105 VanDerWaalsContact O-CD2 3.32Å; L100-F105 WeakPolarHBondContact O-CD2 3.27Å; L100-F105 PolarHBondContact O-N 3.33Å; E101-F105 WeakPolarHBondContact CA-O 3.45Å; L103-F105 HydrophobicContact CB-CD2 3.8Å; L103-F105 HydrophobicContact CB-CE2 3.84Å; L103-F105 HydrophobicContact CD1-CD2 4.44Å; L103-F105 HydrophobicContact CD1-CE2 4.04Å; F105-L107 HydrophobicContact CB-CD2 4.48Å; F105-I115 HydrophobicContact CB-CD1 3.61Å; F105-I115 HydrophobicContact CD1-CD1 3.92Å; F105-I115 HydrophobicContact CD1-CG1 4.02Å; F105-I115 HydrophobicContact CD1-CG2 4.38Å; F105-I115 HydrophobicContact CD2-CD1 4.01Å; F105-I115 HydrophobicContact CD2-CG2 4.06Å; F105-I115 HydrophobicContact CE1-CG1 4.39Å; F105-I115 HydrophobicContact CE1-CG2 4.11Å; F105-I115 HydrophobicContact CE2-CG2 3.75Å; F105-I115 HydrophobicContact CG-CD1 3.58Å; F105-I115 HydrophobicContact CG-CG1 4.16Å; F105-I115 HydrophobicContact CG-CG2 4.38Å; F105-I115 HydrophobicContact CZ-CG2 3.79Å; F105-F119 HydrophobicContact CE2-CE2 4.05Å; F105-F119 HydrophobicContact CE2-CZ 4.5Å; F105-F119 AromaticContact CZ-CE2 3.85Å; F105-F119 HydrophobicContact CZ-CE2 3.85Å; F105-F119 HydrophobicContact CZ-CZ 4.31Å
106	N	95.3	Very high	93.9	Very high	63 Å²	63	45.4 Å²	45.4	34%	0.337	27%	0.266	S	S	.	.			trans	-87.5	106.4	166.8	-177.6	-10	0	0	0	108.6	T108 E109 T110	N106-T108 VanDerWaalsContact CG-OG1 3.31Å; N106-T108 PolarHBondContact ND2-OG1 2.71Å; N106-T108 PolarHBondContact O-N 3.01Å; N106-T108 WeakPolarHBondContact OD1-CB 3.15Å; N106-T108 PolarHBondContact OD1-N 2.89Å; N106-T108 PolarHBondContact OD1-OG1 2.75Å; N106-E109 HydrophobicContact CB-CB 4.21Å; N106-E109 HydrophobicContact CB-CG 4.31Å; N106-E109 VanDerWaalsContact ND2-CD 3.25Å; N106-E109 WeakPolarHBondContact ND2-CG 3.24Å; N106-E109 PolarHBondContact ND2-OE1 3.27Å; N106-E109 PolarHBondContact O-N 3.09Å; N106-T110 PolarHBondContact O-N 3.16Å
107	L	94.6	Very high	94.2	Very high	42 Å²	42	50.7 Å²	50.7	22%	0.22	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-17.5	-176.1	-60.8	-179	0	0	0	113.6	A97 L100 E101 F105 I115	A97-L107 HydrophobicContact CB-CD1 3.71Å; L100-L107 HydrophobicContact CB-CD2 3.94Å; L100-L107 HydrophobicContact CD1-CD2 4.04Å; E101-L107 HydrophobicContact CG-CD1 3.87Å; E101-L107 HydrophobicContact CG-CG 3.94Å; F105-L107 HydrophobicContact CB-CD2 4.48Å; L107-I115 HydrophobicContact CD2-CD1 3.63Å
108	T	94.2	Very high	94.4	Very high	127 Å²	127	49.4 Å²	49.4	78%	0.779	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-29.6	172.5	69.1	0	0	0	0	112.5	N106	N106-T108 VanDerWaalsContact CG-OG1 3.31Å; N106-T108 PolarHBondContact ND2-OG1 2.71Å; N106-T108 PolarHBondContact O-N 3.01Å; N106-T108 WeakPolarHBondContact OD1-CB 3.15Å; N106-T108 PolarHBondContact OD1-N 2.89Å; N106-T108 PolarHBondContact OD1-OG1 2.75Å
109	E	93.5	Very high	94.7	Very high	147 Å²	147	45.4 Å²	45.4	69%	0.687	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-38	179.7	-69.5	173.6	-156.8	0	0	112	N106	N106-E109 HydrophobicContact CB-CB 4.21Å; N106-E109 HydrophobicContact CB-CG 4.31Å; N106-E109 VanDerWaalsContact ND2-CD 3.25Å; N106-E109 WeakPolarHBondContact ND2-CG 3.24Å; N106-E109 PolarHBondContact ND2-OE1 3.27Å; N106-E109 PolarHBondContact O-N 3.09Å
110	T	93.8	Very high	95	Very high	28 Å²	28	50.5 Å²	50.5	17%	0.172	28%	0.278	C	S	.	.	S	Bend	trans	-123.3	96.6	-178.1	-51.5	0	0	0	0	109.5	N106 N114 I115	N106-T110 PolarHBondContact O-N 3.16Å; T110-N114 HydrophobicContact CG2-CB 4.22Å; T110-I115 HydrophobicContact CG2-CD1 4.43Å; T110-I115 HydrophobicContact CG2-CG1 3.62Å
111	P	95.1	Very high	95.1	Very high	65 Å²	65	51.9 Å²	51.9	42%	0.422	29%	0.288	S	S	.	.			trans	-54.5	144.9	175.9	-26.9	33.4	0	0	0	112.3	A113 N114 I115	P111-A113 VanDerWaalsContact C-N 3.28Å; P111-A113 PolarHBondContact O-N 2.94Å; P111-N114 WeakPolarHBondContact O-CA 3.3Å; P111-N114 WeakPolarHBondContact O-CB 3.43Å; P111-N114 PolarHBondContact O-N 3.15Å; P111-I115 PolarHBondContact O-N 3.08Å
112	E	95.1	Very high	95.2	Very high	75 Å²	75	47 Å²	47	35%	0.35	27%	0.265	S	S	.	.	H	α-helix	trans	-50	-44.6	-178.5	177.6	169	-173.9	0	0	113.3	S96 L100 N114 I115 H116	S96-E112 PolarHBondContact OG-OE1 3.48Å; L100-E112 HydrophobicContact CD1-CB 4.15Å; L100-E112 HydrophobicContact CD1-CG 3.65Å; E112-N114 PolarHBondContact O-N 3.26Å; E112-I115 WeakPolarHBondContact O-CA 3.49Å; E112-I115 WeakPolarHBondContact O-CB 3.44Å; E112-I115 PolarHBondContact O-N 3.08Å; E112-H116 WeakPolarHBondContact CG-NE2 3.27Å; E112-H116 PolarHBondContact O-CD2 2.91Å; E112-H116 PolarHBondContact O-N 3.1Å; E112-H116 IonicContact OE1-NE2 2.75Å
113	A	94.5	Very high	95.4	Very high	70 Å²	70	47.2 Å²	47.2	58%	0.579	26%	0.263	S	S	*	.	H	α-helix	trans	-56.6	-37.9	176.1	0	0	0	0	0	113	P111 Q117	P111-A113 VanDerWaalsContact C-N 3.28Å; P111-A113 PolarHBondContact O-N 2.94Å; A113-Q117 WeakPolarHBondContact O-CB 3.39Å; A113-Q117 PolarHBondContact O-N 3.32Å
114	N	96	Very high	95.4	Very high	51 Å²	51	53.1 Å²	53.1	27%	0.273	29%	0.29	S	S	.	.	H	α-helix	trans	-72.4	-31	177.4	-67.9	-14.3	0	0	0	111.7	T110 P111 E112 G118	T110-N114 HydrophobicContact CG2-CB 4.22Å; P111-N114 WeakPolarHBondContact O-CA 3.3Å; P111-N114 WeakPolarHBondContact O-CB 3.43Å; P111-N114 PolarHBondContact O-N 3.15Å; E112-N114 PolarHBondContact O-N 3.26Å; N114-G118 PolarHBondContact O-N 2.89Å
115	I	97.5	Very high	95.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.3	-53.3	174.2	-59.1	172.7	0	0	0	109	T85 L100 F105 L107 T110 P111 E112 Q117 G118 F119	T85-I115 HydrophobicContact CG2-CG2 3.91Å; L100-I115 HydrophobicContact CB-CD1 4.48Å; L100-I115 HydrophobicContact CD1-CD1 4.23Å; L100-I115 HydrophobicContact CD2-CG2 4.23Å; F105-I115 HydrophobicContact CB-CD1 3.61Å; F105-I115 HydrophobicContact CD1-CD1 3.92Å; F105-I115 HydrophobicContact CD1-CG1 4.02Å; F105-I115 HydrophobicContact CD1-CG2 4.38Å; F105-I115 HydrophobicContact CD2-CD1 4.01Å; F105-I115 HydrophobicContact CD2-CG2 4.06Å; F105-I115 HydrophobicContact CE1-CG1 4.39Å; F105-I115 HydrophobicContact CE1-CG2 4.11Å; F105-I115 HydrophobicContact CE2-CG2 3.75Å; F105-I115 HydrophobicContact CG-CD1 3.58Å; F105-I115 HydrophobicContact CG-CG1 4.16Å; F105-I115 HydrophobicContact CG-CG2 4.38Å; F105-I115 HydrophobicContact CZ-CG2 3.79Å; L107-I115 HydrophobicContact CD2-CD1 3.63Å; T110-I115 HydrophobicContact CG2-CD1 4.43Å; T110-I115 HydrophobicContact CG2-CG1 3.62Å; P111-I115 PolarHBondContact O-N 3.08Å; E112-I115 WeakPolarHBondContact O-CA 3.49Å; E112-I115 WeakPolarHBondContact O-CB 3.44Å; E112-I115 PolarHBondContact O-N 3.08Å; I115-Q117 VanDerWaalsContact C-N 3.33Å; I115-Q117 PolarHBondContact O-N 3.38Å; I115-G118 WeakPolarHBondContact O-CA 3.34Å; I115-G118 PolarHBondContact O-N 3.47Å; I115-F119 HydrophobicContact CG2-CD2 3.92Å; I115-F119 HydrophobicContact CG2-CE2 3.81Å; I115-F119 WeakPolarHBondContact O-CD2 3.38Å; I115-F119 PolarHBondContact O-N 3.2Å
116	H	96.8	Very high	95.3	Very high	11 Å²	11	53.1 Å²	53.1	5%	0.051	28%	0.283	C	S	.	.	H	α-helix	trans	-60.5	-41	178	-66.3	-65.7	0	0	0	112.5	T85 S88 L89 E112 G118 F119 R120 L160 Y161	T85-H116 PolarHBondContact O-CE1 3.36Å; S88-H116 PolarHBondContact OG-CE1 3.3Å; L89-H116 WeakPolarHBondContact CD2-CE1 3.32Å; L89-H116 VanDerWaalsContact CG-CE1 3.47Å; L89-H116 WeakPolarHBondContact CG-CE1 3.34Å; E112-H116 WeakPolarHBondContact CG-NE2 3.27Å; E112-H116 PolarHBondContact O-CD2 2.91Å; E112-H116 PolarHBondContact O-N 3.1Å; E112-H116 IonicContact OE1-NE2 2.75Å; H116-G118 VanDerWaalsContact C-N 3.3Å; H116-G118 PolarHBondContact O-N 3.48Å; H116-F119 PolarHBondContact O-N 3.27Å; H116-R120 PolarHBondContact O-N 3Å; H116-L160 HydrophobicContact CB-CD1 4.25Å; H116-L160 HydrophobicContact CB-CD2 4.47Å; H116-Y161 AromaticContact ND1-CE2 3.84Å; H116-Y161 AromaticContact ND1-CZ 3.74Å; H116-Y161 PolarHBondContact ND1-OH 3.5Å
117	Q	96.7	Very high	95.1	Very high	111 Å²	111	53.4 Å²	53.4	52%	0.519	29%	0.294	S	S	.	.	H	α-helix	trans	-62.5	-38	173.6	-172.2	-178.4	8.4	0	0	112	A46 A113 I115 R120 S121	A46-Q117 HydrophobicContact CB-CG 4.17Å; A113-Q117 WeakPolarHBondContact O-CB 3.39Å; A113-Q117 PolarHBondContact O-N 3.32Å; I115-Q117 VanDerWaalsContact C-N 3.33Å; I115-Q117 PolarHBondContact O-N 3.38Å; Q117-R120 PolarHBondContact O-N 2.81Å; Q117-S121 WeakPolarHBondContact O-CB 3.45Å; Q117-S121 PolarHBondContact O-N 3.42Å
118	G	97.2	Very high	94.9	Very high	0 Å²	0	56 Å²	56	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-59.2	-46.8	172.9	0	0	0	0	0	112	N114 I115 H116 S121 L122	N114-G118 PolarHBondContact O-N 2.89Å; I115-G118 WeakPolarHBondContact O-CA 3.34Å; I115-G118 PolarHBondContact O-N 3.47Å; H116-G118 VanDerWaalsContact C-N 3.3Å; H116-G118 PolarHBondContact O-N 3.48Å; G118-S121 PolarHBondContact O-N 3.33Å; G118-L122 WeakPolarHBondContact O-CB 3.38Å; G118-L122 PolarHBondContact O-N 3.45Å
119	F	96.7	Very high	94.5	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-67	-41.5	177.6	-84.1	-80.5	0	0	0	112.3	I50 I54 T85 F105 I115 H116 S121 L122 L123 Y161	I50-F119 HydrophobicContact CD1-CB 4.3Å; I50-F119 HydrophobicContact CD1-CD1 3.98Å; I50-F119 HydrophobicContact CD1-CD2 3.59Å; I50-F119 HydrophobicContact CD1-CE1 4.16Å; I50-F119 HydrophobicContact CD1-CE2 3.79Å; I50-F119 HydrophobicContact CD1-CG 3.69Å; I50-F119 HydrophobicContact CD1-CZ 4.07Å; I54-F119 HydrophobicContact CD1-CE1 3.86Å; I54-F119 HydrophobicContact CD1-CZ 3.96Å; I54-F119 HydrophobicContact CG1-CZ 4.23Å; T85-F119 HydrophobicContact CG2-CD2 3.65Å; T85-F119 HydrophobicContact CG2-CE2 3.72Å; T85-F119 HydrophobicContact CG2-CG 4.46Å; T85-F119 WeakPolarHBondContact OG1-CE2 3.35Å; T85-F119 WeakPolarHBondContact OG1-CZ 3.5Å; F105-F119 HydrophobicContact CE2-CE2 4.05Å; F105-F119 HydrophobicContact CE2-CZ 4.5Å; F105-F119 AromaticContact CZ-CE2 3.85Å; F105-F119 HydrophobicContact CZ-CE2 3.85Å; F105-F119 HydrophobicContact CZ-CZ 4.31Å; I115-F119 HydrophobicContact CG2-CD2 3.92Å; I115-F119 HydrophobicContact CG2-CE2 3.81Å; I115-F119 WeakPolarHBondContact O-CD2 3.38Å; I115-F119 PolarHBondContact O-N 3.2Å; H116-F119 PolarHBondContact O-N 3.27Å; F119-S121 VanDerWaalsContact C-N 3.31Å; F119-S121 PolarHBondContact O-N 3.04Å; F119-L122 PolarHBondContact O-N 3.4Å; F119-L123 WeakPolarHBondContact O-CB 3.31Å; F119-L123 VanDerWaalsContact O-CG 3.3Å; F119-L123 WeakPolarHBondContact O-CG 3.37Å; F119-L123 PolarHBondContact O-N 2.95Å; F119-Y161 HydrophobicContact CB-CE1 3.83Å; F119-Y161 HydrophobicContact CG-CE1 4.23Å
120	R	96.4	Very high	94.2	Very high	107 Å²	107	51.5 Å²	51.5	40%	0.404	30%	0.295	S	S	.	.	H	α-helix	trans	-56.3	-48.5	172.3	178	179.5	173.4	173.4	11.5	111.3	H116 Q117 L122 H124 E159 L160	H116-R120 PolarHBondContact O-N 3Å; Q117-R120 PolarHBondContact O-N 2.81Å; R120-L122 VanDerWaalsContact C-N 3.33Å; R120-L122 PolarHBondContact O-N 3Å; R120-H124 WeakPolarHBondContact O-CB 3.31Å; R120-H124 PolarHBondContact O-N 2.99Å; R120-E159 IonicContact CZ-OE1 3.87Å; R120-E159 IonicContact NH1-OE1 3.34Å; R120-E159 PolarHBondContact NH1-OE1 2.68Å; R120-E159 IonicContact NH2-OE1 3.74Å; R120-E159 PolarHBondContact NH2-OE1 3.34Å; R120-L160 WeakPolarHBondContact CA-O 3.23Å; R120-L160 HydrophobicContact CB-CD2 4.23Å; R120-L160 WeakPolarHBondContact CB-O 3.3Å
121	S	96.8	Very high	93.7	Very high	29 Å²	29	56.7 Å²	56.7	20%	0.203	33%	0.328	C	S	.	.	H	α-helix	trans	-61.1	-42.9	177.9	-177.2	0	0	0	0	111.3	Y47 Q117 G118 F119 T125	Y47-S121 WeakPolarHBondContact CD1-OG 3.39Å; Q117-S121 WeakPolarHBondContact O-CB 3.45Å; Q117-S121 PolarHBondContact O-N 3.42Å; G118-S121 PolarHBondContact O-N 3.33Å; F119-S121 VanDerWaalsContact C-N 3.31Å; F119-S121 PolarHBondContact O-N 3.04Å; S121-T125 WeakPolarHBondContact O-CB 3.5Å; S121-T125 PolarHBondContact O-N 2.55Å; S121-T125 VanDerWaalsContact O-N 3.07Å; S121-T125 PolarHBondContact O-OG1 2.93Å
122	L	96.2	Very high	93.4	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-63	-55.4	179.1	177.4	58.3	0	0	0	111.3	I50 I54 V78 G118 F119 R120 H124 T125 L126 T407 S409	I50-L122 HydrophobicContact CD1-CD2 4.36Å; I54-L122 HydrophobicContact CD1-CD2 3.83Å; V78-L122 HydrophobicContact CG1-CD2 4.12Å; V78-L122 HydrophobicContact CG2-CD2 4.49Å; G118-L122 WeakPolarHBondContact O-CB 3.38Å; G118-L122 PolarHBondContact O-N 3.45Å; F119-L122 PolarHBondContact O-N 3.4Å; R120-L122 VanDerWaalsContact C-N 3.33Å; R120-L122 PolarHBondContact O-N 3Å; L122-H124 VanDerWaalsContact C-N 3.32Å; L122-H124 PolarHBondContact O-N 3.48Å; L122-T125 PolarHBondContact O-N 2.89Å; L122-T125 VanDerWaalsContact O-N 3.14Å; L122-L126 HydrophobicContact CD1-CD1 3.87Å; L122-L126 HydrophobicContact CD1-CD2 4.41Å; L122-L126 HydrophobicContact CD1-CG 3.95Å; L122-L126 HydrophobicContact CG-CD1 4.01Å; L122-L126 HydrophobicContact CG-CG 4.4Å; L122-L126 WeakPolarHBondContact O-CG 3.49Å; L122-L126 PolarHBondContact O-N 3.3Å; L122-T407 HydrophobicContact CD1-CG2 3.86Å; L122-S409 VanDerWaalsContact CD1-OG 3.23Å; L122-S409 WeakPolarHBondContact CD1-OG 3.09Å
123	L	94.4	Very high	93.1	Very high	19 Å²	19	57.3 Å²	57.3	10%	0.099	32%	0.324	C	S	.	.	H	α-helix	trans	-62.7	-40	-177.1	-66.4	171.5	0	0	0	111.7	T82 F119 L126 A127 V137 Y161	T82-L123 HydrophobicContact CG2-CD1 3.7Å; T82-L123 HydrophobicContact CG2-CD2 4.02Å; T82-L123 HydrophobicContact CG2-CG 4.35Å; F119-L123 WeakPolarHBondContact O-CB 3.31Å; F119-L123 VanDerWaalsContact O-CG 3.3Å; F119-L123 WeakPolarHBondContact O-CG 3.37Å; F119-L123 PolarHBondContact O-N 2.95Å; L123-L126 PolarHBondContact O-N 2.94Å; L123-A127 WeakPolarHBondContact O-CB 3.07Å; L123-A127 PolarHBondContact O-N 2.91Å; L123-V137 HydrophobicContact CD2-CB 4.21Å; L123-V137 HydrophobicContact CD2-CG1 3.95Å; L123-Y161 HydrophobicContact CD1-CD1 3.79Å; L123-Y161 HydrophobicContact CD1-CG 4.43Å
124	H	93.7	Very high	92.8	Very high	126 Å²	126	57 Å²	57	58%	0.583	31%	0.311	S	S	*	.	H	α-helix	trans	-60	-46.7	173.9	-180	-86.4	0	0	0	111.3	R120 L122 A127 L128	R120-H124 WeakPolarHBondContact O-CB 3.31Å; R120-H124 PolarHBondContact O-N 2.99Å; L122-H124 VanDerWaalsContact C-N 3.32Å; L122-H124 PolarHBondContact O-N 3.48Å; H124-A127 PolarHBondContact O-N 2.91Å; H124-L128 PolarHBondContact O-N 2.95Å
125	T	94.1	Very high	92.4	Very high	32 Å²	32	55.6 Å²	55.6	20%	0.196	30%	0.303	C	S	.	.	H	α-helix	trans	-65.4	-41.3	178.6	-62.1	0	0	0	0	112.3	Y47 S121 L122 A127 L128 T406 T407	Y47-T125 HydrophobicContact CE1-CG2 4.21Å; S121-T125 WeakPolarHBondContact O-CB 3.5Å; S121-T125 PolarHBondContact O-N 2.55Å; S121-T125 VanDerWaalsContact O-N 3.07Å; S121-T125 PolarHBondContact O-OG1 2.93Å; L122-T125 PolarHBondContact O-N 2.89Å; L122-T125 VanDerWaalsContact O-N 3.14Å; T125-A127 VanDerWaalsContact C-N 3.28Å; T125-A127 PolarHBondContact O-N 3.03Å; T125-L128 HydrophobicContact CG2-CD1 4.47Å; T125-L128 WeakPolarHBondContact O-CB 3.24Å; T125-L128 WeakPolarHBondContact O-CG 3.45Å; T125-L128 PolarHBondContact O-N 3.49Å; T125-T406 HydrophobicContact CG2-CG2 4.34Å; T125-T407 HydrophobicContact CG2-CG2 3.45Å; T125-T407 VanDerWaalsContact CG2-CG2 3.45Å
126	L	92.6	Very high	91.7	Very high	12 Å²	12	58.4 Å²	58.4	6%	0.063	32%	0.315	C	S	.	.	H	α-helix	trans	-68.2	-27.4	177.4	-65.6	-178.9	0	0	0	113	V78 L122 L123 L128 L135 V137 E404 T407 L411	V78-L126 HydrophobicContact CG1-CD1 3.86Å; L122-L126 HydrophobicContact CD1-CD1 3.87Å; L122-L126 HydrophobicContact CD1-CD2 4.41Å; L122-L126 HydrophobicContact CD1-CG 3.95Å; L122-L126 HydrophobicContact CG-CD1 4.01Å; L122-L126 HydrophobicContact CG-CG 4.4Å; L122-L126 WeakPolarHBondContact O-CG 3.49Å; L122-L126 PolarHBondContact O-N 3.3Å; L123-L126 PolarHBondContact O-N 2.94Å; L126-L128 VanDerWaalsContact C-N 3.33Å; L126-L135 HydrophobicContact CB-CD2 3.98Å; L126-L135 HydrophobicContact CD1-CD2 4.44Å; L126-L135 HydrophobicContact CD2-CD2 3.73Å; L126-L135 HydrophobicContact CG-CD2 4.25Å; L126-V137 HydrophobicContact CD1-CG2 4.33Å; L126-E404 HydrophobicContact CD2-CB 4.05Å; L126-E404 HydrophobicContact CD2-CG 3.79Å; L126-T407 HydrophobicContact CD2-CG2 4.04Å; L126-L411 HydrophobicContact CD1-CD2 4.43Å; L126-L411 HydrophobicContact CD2-CD2 4.41Å
127	A	90.6	Very high	91.2	Very high	69 Å²	69	59.4 Å²	59.4	57%	0.57	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-4.1	177.8	0	0	0	0	0	113.8	L123 H124 T125	L123-A127 WeakPolarHBondContact O-CB 3.07Å; L123-A127 PolarHBondContact O-N 2.91Å; H124-A127 PolarHBondContact O-N 2.91Å; T125-A127 VanDerWaalsContact C-N 3.28Å; T125-A127 PolarHBondContact O-N 3.03Å
128	L	90.7	Very high	90.5	Very high	98 Å²	98	54.5 Å²	54.5	51%	0.513	30%	0.301	S	S	.	.	S	Bend	trans	-61.3	127.9	177.7	-70.8	176.3	0	0	0	110.1	H124 T125 L126 S130	H124-L128 PolarHBondContact O-N 2.95Å; T125-L128 HydrophobicContact CG2-CD1 4.47Å; T125-L128 WeakPolarHBondContact O-CB 3.24Å; T125-L128 WeakPolarHBondContact O-CG 3.45Å; T125-L128 PolarHBondContact O-N 3.49Å; L126-L128 VanDerWaalsContact C-N 3.33Å; L128-S130 PolarHBondContact O-N 2.78Å
129	P	87	Confident	89.9	Confident	128 Å²	128	54.8 Å²	54.8	83%	0.831	30%	0.303	S	S	*	.			trans	-58.2	132.1	-179.7	-24.9	33.4	0	0	0	112
130	S	86.8	Confident	89.4	Confident	51 Å²	51	54.9 Å²	54.9	36%	0.357	30%	0.303	S	S	.	.			trans	-134.4	128.6	173.8	168.1	0	0	0	0	110.4	L128 K132 L133	L128-S130 PolarHBondContact O-N 2.78Å; S130-K132 PolarHBondContact O-N 3.16Å; S130-K132 PolarHBondContact OG-N 3.5Å; S130-L133 VanDerWaalsContact CB-O 3.28Å; S130-L133 WeakPolarHBondContact CB-O 3.46Å; S130-L133 PolarHBondContact OG-N 3.09Å
131	P	83.3	Confident	89	Confident	136 Å²	136	49.8 Å²	49.8	88%	0.883	28%	0.284	S	S	*	.	S	Bend	trans	-72.2	-10	179.3	28.4	-33.4	0	0	0	113.1
132	K	88.8	Confident	88.7	Confident	137 Å²	137	49 Å²	49	60%	0.596	28%	0.277	S	S	*	.	S	Bend	trans	-111.1	-26.4	-175.1	-52.9	-180	178.8	171.3	0	113	S130 R269	S130-K132 PolarHBondContact O-N 3.16Å; S130-K132 PolarHBondContact OG-N 3.5Å; K132-R269 CarbonylContact C-O 3.47Å; K132-R269 VanDerWaalsContact C-O 3.26Å; K132-R269 HydrophobicContact CB-CB 4.3Å; K132-R269 WeakPolarHBondContact CB-O 3.23Å
133	L	87.9	Confident	88.4	Confident	16 Å²	16	49.2 Å²	49.2	8%	0.084	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	114.8	178.9	167.9	62.7	0	0	0	108.4	S130 L135 F213 A215 A272 E404	S130-L133 VanDerWaalsContact CB-O 3.28Å; S130-L133 WeakPolarHBondContact CB-O 3.46Å; S130-L133 PolarHBondContact OG-N 3.09Å; L133-L135 HydrophobicContact CD1-CB 4.41Å; L133-L135 HydrophobicContact CG-CB 4.34Å; L133-F213 HydrophobicContact CD1-CD2 3.68Å; L133-F213 HydrophobicContact CD1-CE2 3.3Å; L133-F213 HydrophobicContact CD1-CZ 4.07Å; L133-A215 HydrophobicContact CD1-CB 3.8Å; L133-A272 HydrophobicContact CD1-CB 4.35Å; L133-A272 HydrophobicContact CD2-CB 4.11Å; L133-E404 HydrophobicContact CD2-CG 4.44Å
134	E	88.1	Confident	88.1	Confident	64 Å²	64	48.4 Å²	48.4	30%	0.299	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	110.6	169.6	-174.3	175.2	-171.8	0	0	108	Y189 F212 K214	E134-Y189 WeakPolarHBondContact OE1-CE2 3.42Å; E134-Y189 PolarHBondContact OE1-OH 3.15Å; E134-F212 HydrophobicContact CB-CE1 4.49Å; E134-F212 HydrophobicContact CG-CD1 4.38Å; E134-F212 HydrophobicContact CG-CE1 3.84Å; E134-K214 HydrophobicContact CB-CB 4.08Å; E134-K214 HydrophobicContact CB-CD 4.39Å; E134-K214 HydrophobicContact CB-CG 4.29Å; E134-K214 PolarHBondContact N-O 3.47Å; E134-K214 PolarHBondContact O-N 2.86Å; E134-K214 WeakPolarHBondContact OE2-CD 3.19Å; E134-K214 WeakPolarHBondContact OE2-CE 3.43Å; E134-K214 IonicContact OE2-NZ 3.66Å; E134-K214 PolarHBondContact OE2-NZ 3.46Å
135	L	88.3	Confident	87.9	Confident	22 Å²	22	48 Å²	48	12%	0.115	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	130.7	178.7	177.5	63.5	0	0	0	108.4	L126 L133 I211 F212 F213 L411	L126-L135 HydrophobicContact CB-CD2 3.98Å; L126-L135 HydrophobicContact CD1-CD2 4.44Å; L126-L135 HydrophobicContact CD2-CD2 3.73Å; L126-L135 HydrophobicContact CG-CD2 4.25Å; L133-L135 HydrophobicContact CD1-CB 4.41Å; L133-L135 HydrophobicContact CG-CB 4.34Å; L135-I211 HydrophobicContact CD1-CD1 4.13Å; L135-I211 HydrophobicContact CD1-CG1 4.11Å; L135-F212 WeakPolarHBondContact CA-O 3.39Å; L135-F212 WeakPolarHBondContact CD1-O 3.3Å; L135-F213 HydrophobicContact CD1-CB 4.29Å; L135-F213 HydrophobicContact CD1-CD2 4.28Å; L135-L411 HydrophobicContact CD1-CD1 4.12Å; L135-L411 HydrophobicContact CD2-CD1 4.04Å; L135-L411 HydrophobicContact CD2-CD2 3.98Å
136	K	82.4	Confident	87.6	Confident	59 Å²	59	53.3 Å²	53.3	26%	0.257	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	117.6	176.2	-172.5	174.8	-179.8	-177.4	0	109.5	Q187 I211 F212	K136-Q187 WeakPolarHBondContact CD-O 3.47Å; K136-Q187 WeakPolarHBondContact CE-O 3.37Å; K136-Q187 PolarHBondContact NZ-O 2.58Å; K136-I211 CarbonylContact O-C 3.59Å; K136-I211 VanDerWaalsContact O-CA 3.31Å; K136-I211 WeakPolarHBondContact O-CA 3.26Å; K136-F212 HydrophobicContact CB-CB 4.33Å; K136-F212 HydrophobicContact CB-CD1 4.49Å; K136-F212 PolarHBondContact N-O 3.4Å; K136-F212 PolarHBondContact O-N 3.14Å
137	V	86.1	Confident	87.3	Confident	32 Å²	32	53.7 Å²	53.7	19%	0.194	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	124.1	168.9	-176.5	0	0	0	0	106.6	L123 L126 I211	L123-V137 HydrophobicContact CD2-CB 4.21Å; L123-V137 HydrophobicContact CD2-CG1 3.95Å; L126-V137 HydrophobicContact CD1-CG2 4.33Å; V137-I211 HydrophobicContact CG2-CD1 3.96Å; V137-I211 HydrophobicContact CG2-CG1 4.03Å
138	G	82.1	Confident	87.3	Confident	7 Å²	7	58.9 Å²	58.9	7%	0.072	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	139	-177.5	0	0	0	0	0	112.2	N209 Y210	G138-N209 PolarHBondContact O-ND2 3.03Å; G138-Y210 PolarHBondContact N-O 2.88Å; G138-Y210 PolarHBondContact O-N 2.85Å; G138-Y210 VanDerWaalsContact O-N 3.09Å
139	N	84.4	Confident	87.3	Confident	7 Å²	7	56.2 Å²	56.2	4%	0.037	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	132.3	175.6	-57.9	-71.6	0	0	0	108.5	T82 L86 A163 N209	T82-N139 VanDerWaalsContact CG2-ND2 3.27Å; T82-N139 WeakPolarHBondContact CG2-ND2 3.34Å; L86-N139 HydrophobicContact CD1-CB 3.87Å; N139-A163 HydrophobicContact CB-CB 3.99Å; N139-N209 PolarHBondContact OD1-ND2 2.84Å
140	S	85.8	Confident	87.5	Confident	1 Å²	1	56 Å²	56	1%	0.007	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	127.1	177.9	-66.4	0	0	0	0	110.6	Y183 A208	S140-Y183 WeakPolarHBondContact OG-CE1 3.31Å; S140-Y183 PolarHBondContact OG-OH 2.99Å; S140-A208 PolarHBondContact N-O 3.15Å; S140-A208 PolarHBondContact O-N 2.64Å
141	L	89	Confident	87.8	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129.2	-178	-171.1	70.9	0	0	0	108.9	L143 Y153 I157 F164 A165 F166 M205 L207	L141-L143 HydrophobicContact CD1-CD2 4.47Å; L141-L143 HydrophobicContact CD2-CD1 4.04Å; L141-L143 HydrophobicContact CD2-CD2 3.88Å; L141-L143 HydrophobicContact CD2-CG 3.96Å; L141-L143 HydrophobicContact CG-CD2 3.98Å; L141-L143 HydrophobicContact CG-CG 4.05Å; L141-Y153 HydrophobicContact CD2-CE1 3.66Å; L141-I157 HydrophobicContact CD2-CD1 4.39Å; L141-F164 PolarHBondContact N-O 2.98Å; L141-A165 HydrophobicContact CB-CB 4.25Å; L141-A165 HydrophobicContact CD2-CB 4.23Å; L141-A165 CarbonylContact O-C 3.55Å; L141-A165 VanDerWaalsContact O-CA 3.25Å; L141-A165 WeakPolarHBondContact O-CA 3.27Å; L141-F166 PolarHBondContact O-N 2.52Å; L141-M205 HydrophobicContact CD1-CG 3.58Å; L141-M205 HydrophobicContact CD1-SD 3.69Å; L141-M205 HydrophobicContact CG-CG 4.45Å; L141-L207 HydrophobicContact CB-CD1 4.36Å; L141-L207 HydrophobicContact CD1-CB 4.26Å; L141-L207 HydrophobicContact CD1-CD1 3.92Å
142	F	89.9	Confident	88.3	Confident	12 Å²	12	59.9 Å²	59.9	5%	0.053	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	116.7	174.1	-61.2	-87.3	0	0	0	107.9	F166 A168 F170 I180 Y183 M205 V206 A208	F142-F166 WeakPolarHBondContact CA-O 3.14Å; F142-F166 HydrophobicContact CD1-CB 3.68Å; F142-F166 HydrophobicContact CD1-CD2 4.14Å; F142-F166 HydrophobicContact CD1-CG 4.28Å; F142-F166 HydrophobicContact CE1-CB 3.84Å; F142-F166 AromaticContact CE1-CD2 3.65Å; F142-F166 HydrophobicContact CE1-CD2 3.65Å; F142-F166 AromaticContact CE1-CG 3.96Å; F142-F166 HydrophobicContact CE1-CG 3.96Å; F142-F166 AromaticContact CZ-CD2 3.98Å; F142-F166 HydrophobicContact CZ-CD2 3.98Å; F142-A168 HydrophobicContact CB-CB 4.09Å; F142-F170 HydrophobicContact CB-CZ 3.97Å; F142-I180 HydrophobicContact CB-CD1 4.13Å; F142-I180 HydrophobicContact CD1-CD1 3.97Å; F142-I180 HydrophobicContact CD1-CG1 3.66Å; F142-I180 HydrophobicContact CD2-CD1 4Å; F142-I180 HydrophobicContact CD2-CG1 4.09Å; F142-I180 HydrophobicContact CD2-CG2 4.01Å; F142-I180 HydrophobicContact CE1-CB 4.4Å; F142-I180 HydrophobicContact CE1-CD1 4.42Å; F142-I180 HydrophobicContact CE1-CG1 3.65Å; F142-I180 HydrophobicContact CE1-CG2 4.35Å; F142-I180 HydrophobicContact CE2-CB 4.32Å; F142-I180 HydrophobicContact CE2-CD1 4.45Å; F142-I180 HydrophobicContact CE2-CG1 4.06Å; F142-I180 HydrophobicContact CE2-CG2 3.44Å; F142-I180 VanDerWaalsContact CE2-CG2 3.44Å; F142-I180 HydrophobicContact CG-CD1 3.75Å; F142-I180 HydrophobicContact CG-CG1 3.89Å; F142-I180 HydrophobicContact CZ-CB 4.16Å; F142-I180 HydrophobicContact CZ-CG1 3.85Å; F142-I180 HydrophobicContact CZ-CG2 3.64Å; F142-Y183 AromaticContact CZ-CD1 3.94Å; F142-Y183 HydrophobicContact CZ-CD1 3.94Å; F142-Y183 HydrophobicContact CZ-CE1 4.36Å; F142-Y183 HydrophobicContact CZ-CG 4.44Å; F142-M205 CarbonylContact O-C 3.56Å; F142-M205 WeakPolarHBondContact O-CA 2.8Å; F142-V206 HydrophobicContact CB-CB 4.23Å; F142-V206 PolarHBondContact N-O 2.88Å; F142-V206 PolarHBondContact O-N 2.79Å; F142-A208 HydrophobicContact CD2-CB 4.42Å; F142-A208 HydrophobicContact CE2-CB 3.92Å
143	L	89.9	Confident	88.5	Confident	6 Å²	6	53.6 Å²	53.6	3%	0.031	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	137.5	-177.2	-64.3	175.7	0	0	0	109.4	L141 K145 L147 P149 A165 F166 S167 A168 M205 V345	L141-L143 HydrophobicContact CD1-CD2 4.47Å; L141-L143 HydrophobicContact CD2-CD1 4.04Å; L141-L143 HydrophobicContact CD2-CD2 3.88Å; L141-L143 HydrophobicContact CD2-CG 3.96Å; L141-L143 HydrophobicContact CG-CD2 3.98Å; L141-L143 HydrophobicContact CG-CG 4.05Å; L143-K145 PolarHBondContact O-N 3.05Å; L143-L147 HydrophobicContact CB-CD1 4.41Å; L143-L147 HydrophobicContact CD2-CD1 4.29Å; L143-P149 HydrophobicContact CD1-CB 3.76Å; L143-P149 HydrophobicContact CD1-CG 3.88Å; L143-A165 HydrophobicContact CD1-CB 4.26Å; L143-F166 PolarHBondContact N-O 3.22Å; L143-S167 CarbonylContact O-C 3.26Å; L143-S167 WeakPolarHBondContact O-CA 3.19Å; L143-A168 PolarHBondContact O-N 3.34Å; L143-M205 HydrophobicContact CD2-CB 4.15Å; L143-M205 HydrophobicContact CD2-CG 3.81Å; L143-M205 HydrophobicContact CD2-SD 3.97Å; L143-V345 HydrophobicContact CD1-CG1 4.26Å; L143-V345 HydrophobicContact CD2-CG1 4.18Å
144	D	89.3	Confident	88.8	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.011	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.1	136.3	175.1	-173.7	-79	0	0	0	110.2	R146 L147 A168 F170 L204	D144-R146 VanDerWaalsContact CG-NE 3.34Å; D144-R146 VanDerWaalsContact CG-NH2 3.35Å; D144-R146 PolarHBondContact O-N 3.26Å; D144-R146 WeakPolarHBondContact OD1-CB 3.18Å; D144-R146 WeakPolarHBondContact OD1-CG 3.37Å; D144-R146 IonicContact OD1-CZ 3.6Å; D144-R146 PolarHBondContact OD1-N 2.8Å; D144-R146 IonicContact OD1-NE 2.74Å; D144-R146 PolarHBondContact OD1-NE 3.38Å; D144-R146 IonicContact OD1-NH2 3.61Å; D144-R146 IonicContact OD2-CZ 3.52Å; D144-R146 IonicContact OD2-NE 3.41Å; D144-R146 PolarHBondContact OD2-NE 2.72Å; D144-R146 IonicContact OD2-NH2 2.79Å; D144-R146 PolarHBondContact OD2-NH2 3.47Å; D144-L147 HydrophobicContact CB-CD1 4.42Å; D144-L147 HydrophobicContact CB-CG 4.25Å; D144-L147 VanDerWaalsContact O-CB 3.29Å; D144-L147 WeakPolarHBondContact O-CB 3.2Å; D144-L147 PolarHBondContact O-N 3.47Å; D144-A168 CarbonylContact C-O 3.47Å; D144-A168 WeakPolarHBondContact CA-O 3.32Å; D144-F170 HydrophobicContact CB-CD2 3.79Å; D144-F170 HydrophobicContact CB-CE2 4.14Å; D144-L204 HydrophobicContact CB-CD2 3.98Å; D144-L204 PolarHBondContact N-O 2.85Å
145	K	89.6	Confident	89.1	Confident	117 Å²	117	55.6 Å²	55.6	51%	0.509	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-18.6	-179	71	-173.7	-172.7	-169.2	0	115.1	L143 L147 S167 A168 N169	L143-K145 PolarHBondContact O-N 3.05Å; K145-L147 VanDerWaalsContact C-N 3.3Å; K145-S167 WeakPolarHBondContact CA-OG 3.14Å; K145-S167 WeakPolarHBondContact CB-OG 3.21Å; K145-A168 PolarHBondContact N-O 3.3Å; K145-N169 HydrophobicContact CD-CB 4.21Å; K145-N169 WeakPolarHBondContact CE-OD1 3.39Å; K145-N169 PolarHBondContact NZ-OD1 3.36Å
146	R	86.9	Confident	89.4	Confident	143 Å²	143	55.5 Å²	55.5	54%	0.54	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-21.3	174.8	-63.2	169.8	-74.5	-178.8	-3.5	112.1	D144	D144-R146 VanDerWaalsContact CG-NE 3.34Å; D144-R146 VanDerWaalsContact CG-NH2 3.35Å; D144-R146 PolarHBondContact O-N 3.26Å; D144-R146 WeakPolarHBondContact OD1-CB 3.18Å; D144-R146 WeakPolarHBondContact OD1-CG 3.37Å; D144-R146 IonicContact OD1-CZ 3.6Å; D144-R146 PolarHBondContact OD1-N 2.8Å; D144-R146 IonicContact OD1-NE 2.74Å; D144-R146 PolarHBondContact OD1-NE 3.38Å; D144-R146 IonicContact OD1-NH2 3.61Å; D144-R146 IonicContact OD2-CZ 3.52Å; D144-R146 IonicContact OD2-NE 3.41Å; D144-R146 PolarHBondContact OD2-NE 2.72Å; D144-R146 IonicContact OD2-NH2 2.79Å; D144-R146 PolarHBondContact OD2-NH2 3.47Å
147	L	86.9	Confident	90	Very high	21 Å²	21	52.7 Å²	52.7	11%	0.11	25%	0.245	C	C	.	.			trans	-80.8	143.6	-179.7	-59.2	-177.3	0	0	0	111.4	L143 D144 K145 P149 L204 T346 N350	L143-L147 HydrophobicContact CB-CD1 4.41Å; L143-L147 HydrophobicContact CD2-CD1 4.29Å; D144-L147 HydrophobicContact CB-CD1 4.42Å; D144-L147 HydrophobicContact CB-CG 4.25Å; D144-L147 VanDerWaalsContact O-CB 3.29Å; D144-L147 WeakPolarHBondContact O-CB 3.2Å; D144-L147 PolarHBondContact O-N 3.47Å; K145-L147 VanDerWaalsContact C-N 3.3Å; L147-P149 WeakPolarHBondContact O-CD 3.39Å; L147-L204 HydrophobicContact CD1-CB 4.23Å; L147-L204 WeakPolarHBondContact CD1-O 3.24Å; L147-L204 HydrophobicContact CD2-CD2 4.45Å; L147-T346 HydrophobicContact CB-CG2 3.89Å; L147-T346 HydrophobicContact CD1-CG2 4.12Å; L147-T346 HydrophobicContact CD2-CG2 4.18Å; L147-T346 HydrophobicContact CG-CG2 4.28Å; L147-N350 WeakPolarHBondContact CD2-ND2 3.46Å
148	K	89.2	Confident	90.3	Very high	177 Å²	177	57.2 Å²	57.2	77%	0.77	26%	0.261	S	S	*	.			trans	-114.9	92.6	172.1	-66.5	-176.5	-178.8	-179.9	0	108.4
149	P	90.9	Very high	90.9	Very high	43 Å²	43	62.3 Å²	62.3	28%	0.279	28%	0.283	S	S	.	.			trans	-64	143.5	179.9	25.1	-33	0	0	0	111.2	L143 L147 L154 V345	L143-P149 HydrophobicContact CD1-CB 3.76Å; L143-P149 HydrophobicContact CD1-CG 3.88Å; L147-P149 WeakPolarHBondContact O-CD 3.39Å; P149-L154 HydrophobicContact CB-CD1 4.37Å; P149-L154 HydrophobicContact CB-CD2 3.93Å; P149-L154 HydrophobicContact CB-CG 4.14Å; P149-L154 HydrophobicContact CG-CD1 4.08Å; P149-L154 HydrophobicContact CG-CD2 4.1Å; P149-L154 HydrophobicContact CG-CG 4.35Å; P149-V345 CarbonylContact C-O 3.58Å; P149-V345 VanDerWaalsContact CA-O 3.23Å; P149-V345 WeakPolarHBondContact CA-O 3.43Å
150	R	92.3	Very high	91.4	Very high	123 Å²	123	63.5 Å²	63.5	46%	0.464	29%	0.29	S	S	.	.			trans	-68.7	135.6	175.1	-69.4	179.2	169.8	175.8	-2.8	109.6	H152 Y153 L154 V345 G347	R150-H152 VanDerWaalsContact C-N 3.3Å; R150-H152 PolarHBondContact O-N 3.06Å; R150-Y153 WeakPolarHBondContact O-CB 3.29Å; R150-Y153 PolarHBondContact O-N 3.32Å; R150-L154 PolarHBondContact O-N 3.38Å; R150-V345 PolarHBondContact N-O 3.5Å; R150-G347 VanDerWaalsContact NE-CA 3.25Å
151	Q	93.8	Very high	91.8	Very high	121 Å²	121	64 Å²	64	57%	0.565	29%	0.291	S	S	*	.	H	α-helix	trans	-58.1	-42.6	-179.4	-171.5	58.1	48.4	0	0	112.2	Y153 L154 D155	Q151-Y153 VanDerWaalsContact C-N 3.26Å; Q151-Y153 PolarHBondContact O-N 2.99Å; Q151-L154 WeakPolarHBondContact O-CB 3.3Å; Q151-L154 PolarHBondContact O-N 3.4Å; Q151-L154 VanDerWaalsContact O-N 3.08Å; Q151-D155 PolarHBondContact NE2-OD1 2.93Å; Q151-D155 VanDerWaalsContact O-CG 3.25Å; Q151-D155 PolarHBondContact O-N 2.99Å
152	H	93.1	Very high	91.9	Very high	148 Å²	148	66.3 Å²	66.3	69%	0.685	32%	0.316	S	S	*	.	H	α-helix	trans	-55	-39.6	175.5	173.8	-85.2	0	0	0	113.1	R150 S156	R150-H152 VanDerWaalsContact C-N 3.3Å; R150-H152 PolarHBondContact O-N 3.06Å; H152-S156 PolarHBondContact CE1-OG 3.46Å; H152-S156 WeakPolarHBondContact O-CB 3.13Å; H152-S156 PolarHBondContact O-N 3.49Å; H152-S156 PolarHBondContact O-OG 3.04Å
153	Y	92.2	Very high	91.9	Very high	4 Å²	4	65.8 Å²	65.8	2%	0.016	31%	0.314	C	S	.	.	H	α-helix	trans	-66.8	-45.2	177.3	175.1	-102.7	0	0	0	110.9	L89 G90 L141 R150 Q151 D155 S156 I157 V345	L89-Y153 HydrophobicContact CB-CE2 4.19Å; G90-Y153 VanDerWaalsContact CA-CE2 3.4Å; L141-Y153 HydrophobicContact CD2-CE1 3.66Å; R150-Y153 WeakPolarHBondContact O-CB 3.29Å; R150-Y153 PolarHBondContact O-N 3.32Å; Q151-Y153 VanDerWaalsContact C-N 3.26Å; Q151-Y153 PolarHBondContact O-N 2.99Å; Y153-D155 VanDerWaalsContact C-N 3.33Å; Y153-D155 PolarHBondContact O-N 3.37Å; Y153-S156 PolarHBondContact O-N 3.12Å; Y153-I157 HydrophobicContact CD2-CG2 4.24Å; Y153-I157 HydrophobicContact CE1-CD1 4.19Å; Y153-I157 HydrophobicContact CE1-CG2 4.07Å; Y153-I157 HydrophobicContact CE2-CG2 3.71Å; Y153-I157 PolarHBondContact O-N 3.36Å; Y153-V345 HydrophobicContact CD1-CB 4.44Å; Y153-V345 HydrophobicContact CD1-CG1 3.97Å; Y153-V345 HydrophobicContact CE1-CB 4.37Å; Y153-V345 HydrophobicContact CE1-CG1 3.79Å; Y153-V345 HydrophobicContact CE1-CG2 4.12Å; Y153-V345 HydrophobicContact CE2-CG2 4.14Å
154	L	93.9	Very high	91.9	Very high	41 Å²	41	70.6 Å²	70.6	22%	0.215	33%	0.334	C	S	.	.	H	α-helix	trans	-59.8	-42	176.3	-61.8	-178.5	0	0	0	112.5	P149 R150 Q151 I157 K158 A165	P149-L154 HydrophobicContact CB-CD1 4.37Å; P149-L154 HydrophobicContact CB-CD2 3.93Å; P149-L154 HydrophobicContact CB-CG 4.14Å; P149-L154 HydrophobicContact CG-CD1 4.08Å; P149-L154 HydrophobicContact CG-CD2 4.1Å; P149-L154 HydrophobicContact CG-CG 4.35Å; R150-L154 PolarHBondContact O-N 3.38Å; Q151-L154 WeakPolarHBondContact O-CB 3.3Å; Q151-L154 PolarHBondContact O-N 3.4Å; Q151-L154 VanDerWaalsContact O-N 3.08Å; L154-I157 HydrophobicContact CD2-CD1 4.4Å; L154-I157 VanDerWaalsContact O-CG1 3.3Å; L154-I157 WeakPolarHBondContact O-CG1 3.31Å; L154-K158 WeakPolarHBondContact O-CB 3.11Å; L154-K158 PolarHBondContact O-N 2.96Å; L154-A165 HydrophobicContact CD2-CB 3.55Å
155	D	95.4	Very high	91.9	Very high	81 Å²	81	72.1 Å²	72.1	43%	0.433	35%	0.348	S	S	.	.	H	α-helix	trans	-66.3	-42.4	177.8	-63.2	-25.5	0	0	0	110.7	Q151 Y153 K158 E159	Q151-D155 PolarHBondContact NE2-OD1 2.93Å; Q151-D155 VanDerWaalsContact O-CG 3.25Å; Q151-D155 PolarHBondContact O-N 2.99Å; Y153-D155 VanDerWaalsContact C-N 3.33Å; Y153-D155 PolarHBondContact O-N 3.37Å; D155-K158 PolarHBondContact O-N 2.84Å; D155-E159 WeakPolarHBondContact O-CB 3.41Å; D155-E159 PolarHBondContact O-N 3.47Å
156	S	94.4	Very high	92	Very high	20 Å²	20	70 Å²	70	14%	0.14	34%	0.338	C	S	.	.	H	α-helix	trans	-63.2	-48.1	179.4	-61.7	0	0	0	0	112.5	H152 Y153 K158 E159 L160	H152-S156 PolarHBondContact CE1-OG 3.46Å; H152-S156 WeakPolarHBondContact O-CB 3.13Å; H152-S156 PolarHBondContact O-N 3.49Å; H152-S156 PolarHBondContact O-OG 3.04Å; Y153-S156 PolarHBondContact O-N 3.12Å; S156-K158 VanDerWaalsContact C-N 3.25Å; S156-K158 PolarHBondContact O-N 3.4Å; S156-E159 PolarHBondContact O-N 3.16Å; S156-L160 VanDerWaalsContact O-CB 3.3Å; S156-L160 WeakPolarHBondContact O-CB 3.3Å; S156-L160 PolarHBondContact O-N 2.88Å
157	I	94	Very high	92.3	Very high	1 Å²	1	67.7 Å²	67.7	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-66	-30.9	179.1	66.5	173.9	0	0	0	111.9	L86 L89 L141 Y153 L154 Y161 G162 A163 A165	L86-I157 HydrophobicContact CD2-CG2 4.43Å; L86-I157 HydrophobicContact CG-CG2 4.27Å; L89-I157 HydrophobicContact CD1-CG2 4.21Å; L141-I157 HydrophobicContact CD2-CD1 4.39Å; Y153-I157 HydrophobicContact CD2-CG2 4.24Å; Y153-I157 HydrophobicContact CE1-CD1 4.19Å; Y153-I157 HydrophobicContact CE1-CG2 4.07Å; Y153-I157 HydrophobicContact CE2-CG2 3.71Å; Y153-I157 PolarHBondContact O-N 3.36Å; L154-I157 HydrophobicContact CD2-CD1 4.4Å; L154-I157 VanDerWaalsContact O-CG1 3.3Å; L154-I157 WeakPolarHBondContact O-CG1 3.31Å; I157-Y161 CarbonylContact O-C 3.58Å; I157-Y161 WeakPolarHBondContact O-CA 3.41Å; I157-Y161 VanDerWaalsContact O-CB 3.3Å; I157-Y161 WeakPolarHBondContact O-CB 3.45Å; I157-Y161 PolarHBondContact O-N 2.82Å; I157-Y161 VanDerWaalsContact O-N 3.1Å; I157-G162 PolarHBondContact O-N 3.34Å; I157-A163 HydrophobicContact CB-CB 4.26Å; I157-A163 PolarHBondContact O-N 2.8Å; I157-A163 VanDerWaalsContact O-N 3.08Å; I157-A165 HydrophobicContact CD1-CB 4.16Å
158	K	94.4	Very high	92.5	Very high	126 Å²	126	67 Å²	67	55%	0.548	34%	0.341	S	S	.	.	H	α-helix	trans	-71.8	-47.7	176	-176.7	-178.9	177.1	-175	0	111.2	L154 D155 S156 G162 A163	L154-K158 WeakPolarHBondContact O-CB 3.11Å; L154-K158 PolarHBondContact O-N 2.96Å; D155-K158 PolarHBondContact O-N 2.84Å; S156-K158 VanDerWaalsContact C-N 3.25Å; S156-K158 PolarHBondContact O-N 3.4Å; K158-G162 VanDerWaalsContact O-CA 3.29Å; K158-G162 WeakPolarHBondContact O-CA 3.31Å; K158-G162 PolarHBondContact O-N 3.4Å; K158-G162 VanDerWaalsContact O-N 3.08Å; K158-A163 WeakPolarHBondContact CA-O 3.49Å
159	E	94.3	Very high	92.5	Very high	114 Å²	114	60.6 Å²	60.6	53%	0.533	32%	0.316	S	S	.	.	H	α-helix	trans	-69.7	-45.3	-177.1	-175.9	-178.5	172.7	0	0	112.5	R120 D155 S156	R120-E159 IonicContact CZ-OE1 3.87Å; R120-E159 IonicContact NH1-OE1 3.34Å; R120-E159 PolarHBondContact NH1-OE1 2.68Å; R120-E159 IonicContact NH2-OE1 3.74Å; R120-E159 PolarHBondContact NH2-OE1 3.34Å; D155-E159 WeakPolarHBondContact O-CB 3.41Å; D155-E159 PolarHBondContact O-N 3.47Å; S156-E159 PolarHBondContact O-N 3.16Å
160	L	94.1	Very high	92.4	Very high	33 Å²	33	58.5 Å²	58.5	17%	0.173	30%	0.302	C	S	.	.	H	α-helix	trans	-85.7	-33.8	-172.9	-65	166.4	0	0	0	112.2	L89 H116 R120 S156	L89-L160 HydrophobicContact CD1-CD1 3.94Å; L89-L160 HydrophobicContact CD2-CD1 4.07Å; H116-L160 HydrophobicContact CB-CD1 4.25Å; H116-L160 HydrophobicContact CB-CD2 4.47Å; R120-L160 WeakPolarHBondContact CA-O 3.23Å; R120-L160 HydrophobicContact CB-CD2 4.23Å; R120-L160 WeakPolarHBondContact CB-O 3.3Å; S156-L160 VanDerWaalsContact O-CB 3.3Å; S156-L160 WeakPolarHBondContact O-CB 3.3Å; S156-L160 PolarHBondContact O-N 2.88Å
161	Y	93.8	Very high	92.2	Very high	10 Å²	10	55.8 Å²	55.8	4%	0.039	30%	0.299	C	S	.	.	H	α-helix	trans	-120.3	-5.5	-170.1	-67.1	-89.7	0	0	0	114.6	T82 T85 L86 L89 H116 F119 L123 I157 A163	T82-Y161 HydrophobicContact CG2-CD1 3.68Å; T82-Y161 HydrophobicContact CG2-CE1 4.04Å; T85-Y161 WeakPolarHBondContact CB-OH 3.41Å; T85-Y161 WeakPolarHBondContact CG2-OH 3.08Å; T85-Y161 PolarHBondContact O-OH 2.78Å; L86-Y161 HydrophobicContact CB-CD1 3.98Å; L86-Y161 HydrophobicContact CB-CD2 4.42Å; L86-Y161 HydrophobicContact CB-CE1 4.13Å; L86-Y161 HydrophobicContact CB-CG 4.14Å; L86-Y161 HydrophobicContact CD1-CD1 4.39Å; L86-Y161 HydrophobicContact CD1-CG 4.05Å; L86-Y161 HydrophobicContact CG-CD2 4.48Å; L86-Y161 HydrophobicContact CG-CG 4.28Å; L89-Y161 HydrophobicContact CD1-CD2 3.66Å; L89-Y161 HydrophobicContact CD1-CE2 3.34Å; L89-Y161 HydrophobicContact CG-CE2 4.06Å; H116-Y161 AromaticContact ND1-CE2 3.84Å; H116-Y161 AromaticContact ND1-CZ 3.74Å; H116-Y161 PolarHBondContact ND1-OH 3.5Å; F119-Y161 HydrophobicContact CB-CE1 3.83Å; F119-Y161 HydrophobicContact CG-CE1 4.23Å; L123-Y161 HydrophobicContact CD1-CD1 3.79Å; L123-Y161 HydrophobicContact CD1-CG 4.43Å; I157-Y161 CarbonylContact O-C 3.58Å; I157-Y161 WeakPolarHBondContact O-CA 3.41Å; I157-Y161 VanDerWaalsContact O-CB 3.3Å; I157-Y161 WeakPolarHBondContact O-CB 3.45Å; I157-Y161 PolarHBondContact O-N 2.82Å; I157-Y161 VanDerWaalsContact O-N 3.1Å; Y161-A163 PolarHBondContact O-N 2.8Å; Y161-A163 VanDerWaalsContact O-N 3.15Å
162	G	91.2	Very high	91.9	Very high	50 Å²	50	53 Å²	53	52%	0.515	29%	0.289	S	S	.	.			trans	59.4	21.8	-171.7	0	0	0	0	0	112.8	I157 K158	I157-G162 PolarHBondContact O-N 3.34Å; K158-G162 VanDerWaalsContact O-CA 3.29Å; K158-G162 WeakPolarHBondContact O-CA 3.31Å; K158-G162 PolarHBondContact O-N 3.4Å; K158-G162 VanDerWaalsContact O-N 3.08Å
163	A	91.3	Very high	91.5	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.008	27%	0.272	C	S	.	.			trans	-90.5	152.9	-174.7	0	0	0	0	0	111.2	L86 N139 I157 K158 Y161	L86-A163 HydrophobicContact CD1-CB 3.48Å; L86-A163 VanDerWaalsContact CD1-CB 3.48Å; N139-A163 HydrophobicContact CB-CB 3.99Å; I157-A163 HydrophobicContact CB-CB 4.26Å; I157-A163 PolarHBondContact O-N 2.8Å; I157-A163 VanDerWaalsContact O-N 3.08Å; K158-A163 WeakPolarHBondContact CA-O 3.49Å; Y161-A163 PolarHBondContact O-N 2.8Å; Y161-A163 VanDerWaalsContact O-N 3.15Å
164	F	88.4	Confident	91.3	Very high	106 Å²	106	53 Å²	53	47%	0.465	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	145.4	175.4	-64.1	-84.2	0	0	0	110.3	L141 F166	L141-F164 PolarHBondContact N-O 2.98Å; F164-F166 HydrophobicContact CB-CE2 3.9Å; F164-F166 HydrophobicContact CB-CZ 3.84Å
165	A	90.9	Very high	91.1	Very high	35 Å²	35	53.9 Å²	53.9	29%	0.289	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	136.1	170.2	0	0	0	0	0	110.5	L141 L143 L154 I157	L141-A165 HydrophobicContact CB-CB 4.25Å; L141-A165 HydrophobicContact CD2-CB 4.23Å; L141-A165 CarbonylContact O-C 3.55Å; L141-A165 VanDerWaalsContact O-CA 3.25Å; L141-A165 WeakPolarHBondContact O-CA 3.27Å; L143-A165 HydrophobicContact CD1-CB 4.26Å; L154-A165 HydrophobicContact CD2-CB 3.55Å; I157-A165 HydrophobicContact CD1-CB 4.16Å
166	F	91.5	Very high	90.8	Very high	72 Å²	72	50.2 Å²	50.2	32%	0.316	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	146.5	177.8	-58.5	-79.7	0	0	0	109.7	L141 F142 L143 F164 Y183	L141-F166 PolarHBondContact O-N 2.52Å; F142-F166 WeakPolarHBondContact CA-O 3.14Å; F142-F166 HydrophobicContact CD1-CB 3.68Å; F142-F166 HydrophobicContact CD1-CD2 4.14Å; F142-F166 HydrophobicContact CD1-CG 4.28Å; F142-F166 HydrophobicContact CE1-CB 3.84Å; F142-F166 AromaticContact CE1-CD2 3.65Å; F142-F166 HydrophobicContact CE1-CD2 3.65Å; F142-F166 AromaticContact CE1-CG 3.96Å; F142-F166 HydrophobicContact CE1-CG 3.96Å; F142-F166 AromaticContact CZ-CD2 3.98Å; F142-F166 HydrophobicContact CZ-CD2 3.98Å; L143-F166 PolarHBondContact N-O 3.22Å; F164-F166 HydrophobicContact CB-CE2 3.9Å; F164-F166 HydrophobicContact CB-CZ 3.84Å; F166-Y183 HydrophobicContact CE2-CE1 4.33Å; F166-Y183 HydrophobicContact CE2-CE2 4.02Å; F166-Y183 AromaticContact CE2-CZ 3.77Å; F166-Y183 AromaticContact CZ-CE2 3.73Å; F166-Y183 HydrophobicContact CZ-CE2 3.73Å; F166-Y183 AromaticContact CZ-CZ 3.88Å
167	S	92.1	Very high	90.5	Very high	94 Å²	94	49.8 Å²	49.8	66%	0.657	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	134.3	170.3	-173.4	0	0	0	0	110	L143 K145	L143-S167 CarbonylContact O-C 3.26Å; L143-S167 WeakPolarHBondContact O-CA 3.19Å; K145-S167 WeakPolarHBondContact CA-OG 3.14Å; K145-S167 WeakPolarHBondContact CB-OG 3.21Å
168	A	90.9	Very high	90.2	Very high	6 Å²	6	57.6 Å²	57.6	5%	0.05	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	153.1	-177.5	0	0	0	0	0	111.4	F142 L143 D144 K145 F170 T176	F142-A168 HydrophobicContact CB-CB 4.09Å; L143-A168 PolarHBondContact O-N 3.34Å; D144-A168 CarbonylContact C-O 3.47Å; D144-A168 WeakPolarHBondContact CA-O 3.32Å; K145-A168 PolarHBondContact N-O 3.3Å; A168-F170 HydrophobicContact CB-CD1 4.41Å; A168-F170 HydrophobicContact CB-CD2 4.5Å; A168-F170 HydrophobicContact CB-CE1 3.88Å; A168-F170 HydrophobicContact CB-CE2 4Å; A168-F170 HydrophobicContact CB-CZ 3.66Å; A168-T176 HydrophobicContact CB-CG2 3.89Å
169	N	90.6	Very high	90	Very high	43 Å²	43	57 Å²	57	23%	0.23	32%	0.316	C	S	.	.			trans	-111.1	78.4	178.1	-175.8	40.7	0	0	0	110.6	K145 T171 D172 T176	K145-N169 HydrophobicContact CD-CB 4.21Å; K145-N169 WeakPolarHBondContact CE-OD1 3.39Å; K145-N169 PolarHBondContact NZ-OD1 3.36Å; N169-T171 PolarHBondContact O-N 3.43Å; N169-T171 PolarHBondContact OD1-OG1 3.34Å; N169-D172 WeakPolarHBondContact ND2-CB 3.27Å; N169-D172 CarbonylContact O-C 3.53Å; N169-D172 PolarHBondContact O-N 2.94Å; N169-T176 VanDerWaalsContact C-OG1 3.31Å; N169-T176 PolarHBondContact O-OG1 3.43Å
170	F	87.8	Confident	89.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-12	-174.7	-61.4	-59.6	0	0	0	114.5	F142 D144 A168 D172 T176 I180 F199 T203 V206	F142-F170 HydrophobicContact CB-CZ 3.97Å; D144-F170 HydrophobicContact CB-CD2 3.79Å; D144-F170 HydrophobicContact CB-CE2 4.14Å; A168-F170 HydrophobicContact CB-CD1 4.41Å; A168-F170 HydrophobicContact CB-CD2 4.5Å; A168-F170 HydrophobicContact CB-CE1 3.88Å; A168-F170 HydrophobicContact CB-CE2 4Å; A168-F170 HydrophobicContact CB-CZ 3.66Å; F170-D172 VanDerWaalsContact C-N 3.26Å; F170-D172 PolarHBondContact O-N 2.97Å; F170-T176 HydrophobicContact CD1-CG2 3.86Å; F170-T176 HydrophobicContact CE1-CG2 3.92Å; F170-I180 HydrophobicContact CE1-CD1 4.33Å; F170-F199 HydrophobicContact CB-CD2 4.42Å; F170-F199 AromaticContact CD1-CD2 3.63Å; F170-F199 HydrophobicContact CD1-CD2 3.63Å; F170-F199 AromaticContact CD1-CE2 3.55Å; F170-F199 HydrophobicContact CD1-CE2 3.55Å; F170-F199 HydrophobicContact CD1-CG 4.43Å; F170-F199 HydrophobicContact CD1-CZ 4.31Å; F170-F199 HydrophobicContact CE1-CD2 4.37Å; F170-F199 HydrophobicContact CE1-CE2 4.29Å; F170-F199 HydrophobicContact CG-CD2 4.42Å; F170-T203 HydrophobicContact CD1-CG2 4.39Å; F170-T203 HydrophobicContact CD2-CG2 4.25Å; F170-T203 WeakPolarHBondContact CD2-O 3.49Å; F170-T203 HydrophobicContact CE1-CG2 4.48Å; F170-T203 HydrophobicContact CE2-CG2 4.31Å; F170-T203 HydrophobicContact CG-CG2 4.28Å; F170-T203 HydrophobicContact CZ-CG2 4.43Å; F170-V206 HydrophobicContact CD1-CG2 4.32Å; F170-V206 HydrophobicContact CE1-CB 4.18Å; F170-V206 HydrophobicContact CE1-CG2 3.4Å; F170-V206 HydrophobicContact CE2-CG2 4.41Å; F170-V206 HydrophobicContact CZ-CB 3.97Å; F170-V206 HydrophobicContact CZ-CG2 3.45Å; F170-V206 VanDerWaalsContact CZ-CG2 3.45Å
171	T	87.2	Confident	89.3	Confident	66 Å²	66	51.5 Å²	51.5	41%	0.405	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-24.7	169.1	66.5	0	0	0	0	113.1	N169	N169-T171 PolarHBondContact O-N 3.43Å; N169-T171 PolarHBondContact OD1-OG1 3.34Å
172	D	88.8	Confident	89.1	Confident	63 Å²	63	54.1 Å²	54.1	34%	0.337	31%	0.305	S	S	.	.	S	Bend	trans	-105.2	77.6	167.9	-177.9	-1.8	0	0	0	108.7	N169 F170 V174 T175 T176	N169-D172 WeakPolarHBondContact ND2-CB 3.27Å; N169-D172 CarbonylContact O-C 3.53Å; N169-D172 PolarHBondContact O-N 2.94Å; F170-D172 VanDerWaalsContact C-N 3.26Å; F170-D172 PolarHBondContact O-N 2.97Å; D172-V174 VanDerWaalsContact C-N 3.33Å; D172-V174 PolarHBondContact O-N 3.26Å; D172-T175 VanDerWaalsContact CG-CB 3.45Å; D172-T175 VanDerWaalsContact CG-OG1 3.24Å; D172-T175 WeakPolarHBondContact OD1-CB 3.31Å; D172-T175 PolarHBondContact OD1-N 3.27Å; D172-T175 VanDerWaalsContact OD1-N 3.15Å; D172-T175 PolarHBondContact OD1-OG1 3.34Å; D172-T175 VanDerWaalsContact OD1-OG1 3.06Å; D172-T175 WeakPolarHBondContact OD2-CB 3.48Å; D172-T175 PolarHBondContact OD2-OG1 2.83Å; D172-T176 WeakPolarHBondContact O-CB 3.49Å; D172-T176 PolarHBondContact O-N 3.41Å; D172-T176 PolarHBondContact O-OG1 2.71Å
173	S	84.6	Confident	88.9	Confident	49 Å²	49	53.3 Å²	53.3	34%	0.343	29%	0.287	S	S	.	.	H	α-helix	trans	-65	-36.6	-173	58.3	0	0	0	0	113.1	G177 F199	S173-G177 WeakPolarHBondContact O-CA 2.98Å; S173-G177 PolarHBondContact O-N 2.74Å; S173-F199 VanDerWaalsContact O-CZ 3.31Å; S173-F199 WeakPolarHBondContact O-CZ 3.17Å
174	V	86.9	Confident	88.5	Confident	101 Å²	101	53.3 Å²	53.3	61%	0.612	29%	0.287	S	S	*	.	H	α-helix	trans	-65.9	-50.3	-178.9	179	0	0	0	0	111.1	D172 R178	D172-V174 VanDerWaalsContact C-N 3.33Å; D172-V174 PolarHBondContact O-N 3.26Å; V174-R178 PolarHBondContact O-N 3.09Å
175	T	89.8	Confident	88.4	Confident	61 Å²	61	54.8 Å²	54.8	37%	0.374	29%	0.289	S	S	.	.	H	α-helix	trans	-68.3	-44.4	-179.9	-55.1	0	0	0	0	111.1	D172 G177 R178 Q179	D172-T175 VanDerWaalsContact CG-CB 3.45Å; D172-T175 VanDerWaalsContact CG-OG1 3.24Å; D172-T175 WeakPolarHBondContact OD1-CB 3.31Å; D172-T175 PolarHBondContact OD1-N 3.27Å; D172-T175 VanDerWaalsContact OD1-N 3.15Å; D172-T175 PolarHBondContact OD1-OG1 3.34Å; D172-T175 VanDerWaalsContact OD1-OG1 3.06Å; D172-T175 WeakPolarHBondContact OD2-CB 3.48Å; D172-T175 PolarHBondContact OD2-OG1 2.83Å; T175-G177 PolarHBondContact O-N 3.44Å; T175-R178 PolarHBondContact O-N 3.28Å; T175-Q179 WeakPolarHBondContact O-CG 3.45Å; T175-Q179 PolarHBondContact O-N 2.88Å
176	T	89.6	Confident	88.3	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.018	30%	0.304	C	S	.	.	H	α-helix	trans	-63	-43.2	-180	-63	0	0	0	0	111.3	A168 N169 F170 D172 R178 Q179 I180 F199	A168-T176 HydrophobicContact CB-CG2 3.89Å; N169-T176 VanDerWaalsContact C-OG1 3.31Å; N169-T176 PolarHBondContact O-OG1 3.43Å; F170-T176 HydrophobicContact CD1-CG2 3.86Å; F170-T176 HydrophobicContact CE1-CG2 3.92Å; D172-T176 WeakPolarHBondContact O-CB 3.49Å; D172-T176 PolarHBondContact O-N 3.41Å; D172-T176 PolarHBondContact O-OG1 2.71Å; T176-R178 VanDerWaalsContact C-N 3.33Å; T176-R178 PolarHBondContact O-N 2.84Å; T176-Q179 PolarHBondContact O-N 2.76Å; T176-I180 HydrophobicContact CG2-CD1 3.84Å; T176-I180 HydrophobicContact CG2-CG1 4.46Å; T176-I180 WeakPolarHBondContact O-CG1 3.48Å; T176-I180 PolarHBondContact O-N 3.16Å; T176-F199 HydrophobicContact CG2-CE2 4.33Å; T176-F199 HydrophobicContact CG2-CZ 4.13Å
177	G	87.9	Confident	87.9	Confident	11 Å²	11	59.9 Å²	59.9	11%	0.113	30%	0.301	C	S	.	.	H	α-helix	trans	-61.4	-43.3	178.8	0	0	0	0	0	111.5	S173 T175 Q179 I180 N181	S173-G177 WeakPolarHBondContact O-CA 2.98Å; S173-G177 PolarHBondContact O-N 2.74Å; T175-G177 PolarHBondContact O-N 3.44Å; G177-Q179 PolarHBondContact O-N 3.06Å; G177-I180 PolarHBondContact O-N 2.92Å; G177-N181 WeakPolarHBondContact O-CB 3.34Å; G177-N181 PolarHBondContact O-N 2.94Å
178	R	88.7	Confident	87.3	Confident	165 Å²	165	55.4 Å²	55.4	62%	0.623	27%	0.27	S	S	*	.	H	α-helix	trans	-60.2	-46.1	174	-171.3	-174.6	-59.1	179.3	2.1	112.1	V174 T175 T176 I180 N181 D182	V174-R178 PolarHBondContact O-N 3.09Å; T175-R178 PolarHBondContact O-N 3.28Å; T176-R178 VanDerWaalsContact C-N 3.33Å; T176-R178 PolarHBondContact O-N 2.84Å; R178-I180 VanDerWaalsContact C-N 3.34Å; R178-I180 PolarHBondContact O-N 2.99Å; R178-N181 PolarHBondContact O-N 3.42Å; R178-D182 WeakPolarHBondContact O-CB 3.5Å; R178-D182 VanDerWaalsContact O-CG 3.29Å; R178-D182 PolarHBondContact O-N 3Å
179	Q	89.7	Confident	87	Confident	114 Å²	114	61.8 Å²	61.8	53%	0.533	29%	0.293	S	S	.	.	H	α-helix	trans	-61.1	-42.2	-179.7	-74.1	175.7	-14.7	0	0	112.5	T175 T176 G177 Y183	T175-Q179 WeakPolarHBondContact O-CG 3.45Å; T175-Q179 PolarHBondContact O-N 2.88Å; T176-Q179 PolarHBondContact O-N 2.76Å; G177-Q179 PolarHBondContact O-N 3.06Å; Q179-Y183 WeakPolarHBondContact O-CB 3.3Å; Q179-Y183 PolarHBondContact O-N 3.34Å
180	I	87.1	Confident	86.7	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.01	30%	0.298	C	S	.	.	H	α-helix	trans	-69.6	-45.1	178.3	-60.3	168.3	0	0	0	110.5	F142 F170 T176 G177 R178 D182 Y183 V184 L196 A208	F142-I180 HydrophobicContact CB-CD1 4.13Å; F142-I180 HydrophobicContact CD1-CD1 3.97Å; F142-I180 HydrophobicContact CD1-CG1 3.66Å; F142-I180 HydrophobicContact CD2-CD1 4Å; F142-I180 HydrophobicContact CD2-CG1 4.09Å; F142-I180 HydrophobicContact CD2-CG2 4.01Å; F142-I180 HydrophobicContact CE1-CB 4.4Å; F142-I180 HydrophobicContact CE1-CD1 4.42Å; F142-I180 HydrophobicContact CE1-CG1 3.65Å; F142-I180 HydrophobicContact CE1-CG2 4.35Å; F142-I180 HydrophobicContact CE2-CB 4.32Å; F142-I180 HydrophobicContact CE2-CD1 4.45Å; F142-I180 HydrophobicContact CE2-CG1 4.06Å; F142-I180 HydrophobicContact CE2-CG2 3.44Å; F142-I180 VanDerWaalsContact CE2-CG2 3.44Å; F142-I180 HydrophobicContact CG-CD1 3.75Å; F142-I180 HydrophobicContact CG-CG1 3.89Å; F142-I180 HydrophobicContact CZ-CB 4.16Å; F142-I180 HydrophobicContact CZ-CG1 3.85Å; F142-I180 HydrophobicContact CZ-CG2 3.64Å; F170-I180 HydrophobicContact CE1-CD1 4.33Å; T176-I180 HydrophobicContact CG2-CD1 3.84Å; T176-I180 HydrophobicContact CG2-CG1 4.46Å; T176-I180 WeakPolarHBondContact O-CG1 3.48Å; T176-I180 PolarHBondContact O-N 3.16Å; G177-I180 PolarHBondContact O-N 2.92Å; R178-I180 VanDerWaalsContact C-N 3.34Å; R178-I180 PolarHBondContact O-N 2.99Å; I180-D182 VanDerWaalsContact C-N 3.34Å; I180-D182 PolarHBondContact O-N 2.98Å; I180-Y183 WeakPolarHBondContact O-CB 3.42Å; I180-Y183 PolarHBondContact O-N 3.19Å; I180-Y183 VanDerWaalsContact O-N 3.14Å; I180-V184 HydrophobicContact CG2-CG2 4.43Å; I180-V184 WeakPolarHBondContact O-CG2 3.38Å; I180-V184 PolarHBondContact O-N 2.94Å; I180-L196 HydrophobicContact CB-CD1 3.4Å; I180-L196 VanDerWaalsContact CB-CD1 3.4Å; I180-L196 HydrophobicContact CB-CG 4.36Å; I180-L196 HydrophobicContact CD1-CD1 3.63Å; I180-L196 HydrophobicContact CG1-CD1 4.08Å; I180-L196 HydrophobicContact CG2-CD1 3.37Å; I180-L196 HydrophobicContact CG2-CD2 3.92Å; I180-L196 HydrophobicContact CG2-CG 3.82Å; I180-A208 HydrophobicContact CG2-CB 4.44Å
181	N	86.9	Confident	86.1	Confident	29 Å²	29	64.1 Å²	64.1	16%	0.155	31%	0.311	C	S	.	.	H	α-helix	trans	-60	-43.9	176	-76.9	-11.6	0	0	0	111.5	G177 R178 Y183 V184 R185 D194 C195	G177-N181 WeakPolarHBondContact O-CB 3.34Å; G177-N181 PolarHBondContact O-N 2.94Å; R178-N181 PolarHBondContact O-N 3.42Å; N181-Y183 VanDerWaalsContact C-N 3.29Å; N181-Y183 PolarHBondContact O-N 2.83Å; N181-V184 PolarHBondContact O-N 3.05Å; N181-R185 WeakPolarHBondContact O-CB 3.28Å; N181-R185 PolarHBondContact O-N 2.8Å; N181-D194 PolarHBondContact ND2-OD1 2.9Å; N181-D194 VanDerWaalsContact ND2-OD1 3.08Å; N181-C195 PolarHBondContact OD1-N 2.99Å
182	D	89.1	Confident	85.4	Confident	65 Å²	65	61 Å²	61	35%	0.348	29%	0.292	S	S	.	.	H	α-helix	trans	-62.2	-37.5	175.7	-78.1	-20.2	0	0	0	112.1	R178 I180 R186	R178-D182 WeakPolarHBondContact O-CB 3.5Å; R178-D182 VanDerWaalsContact O-CG 3.29Å; R178-D182 PolarHBondContact O-N 3Å; I180-D182 VanDerWaalsContact C-N 3.34Å; I180-D182 PolarHBondContact O-N 2.98Å; D182-R186 WeakPolarHBondContact O-CB 3.01Å; D182-R186 WeakPolarHBondContact O-CG 3.47Å; D182-R186 PolarHBondContact O-N 3.22Å
183	Y	87.3	Confident	84.8	Confident	34 Å²	34	60.6 Å²	60.6	13%	0.133	29%	0.292	C	S	.	.	H	α-helix	trans	-63.2	-53	173.9	171.1	-91.6	0	0	0	111.1	S140 F142 F166 Q179 I180 N181 R185 R186 Q187 Y210	S140-Y183 WeakPolarHBondContact OG-CE1 3.31Å; S140-Y183 PolarHBondContact OG-OH 2.99Å; F142-Y183 AromaticContact CZ-CD1 3.94Å; F142-Y183 HydrophobicContact CZ-CD1 3.94Å; F142-Y183 HydrophobicContact CZ-CE1 4.36Å; F142-Y183 HydrophobicContact CZ-CG 4.44Å; F166-Y183 HydrophobicContact CE2-CE1 4.33Å; F166-Y183 HydrophobicContact CE2-CE2 4.02Å; F166-Y183 AromaticContact CE2-CZ 3.77Å; F166-Y183 AromaticContact CZ-CE2 3.73Å; F166-Y183 HydrophobicContact CZ-CE2 3.73Å; F166-Y183 AromaticContact CZ-CZ 3.88Å; Q179-Y183 WeakPolarHBondContact O-CB 3.3Å; Q179-Y183 PolarHBondContact O-N 3.34Å; I180-Y183 WeakPolarHBondContact O-CB 3.42Å; I180-Y183 PolarHBondContact O-N 3.19Å; I180-Y183 VanDerWaalsContact O-N 3.14Å; N181-Y183 VanDerWaalsContact C-N 3.29Å; N181-Y183 PolarHBondContact O-N 2.83Å; Y183-R185 VanDerWaalsContact C-N 3.31Å; Y183-R185 PolarHBondContact O-N 2.82Å; Y183-R186 PolarHBondContact O-N 3.39Å; Y183-Q187 HydrophobicContact CD1-CG 4.29Å; Y183-Q187 HydrophobicContact CD2-CG 4.44Å; Y183-Q187 HydrophobicContact CE1-CG 3.88Å; Y183-Q187 HydrophobicContact CE2-CG 4.05Å; Y183-Q187 VanDerWaalsContact O-CG 3.32Å; Y183-Q187 WeakPolarHBondContact O-CG 3.41Å; Y183-Q187 PolarHBondContact O-N 3.43Å; Y183-Y210 HydrophobicContact CE1-CE1 4.41Å
184	V	83.3	Confident	84.3	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-61.4	-41.6	179.9	177.8	0	0	0	0	111.1	I180 N181 R186 Q187 T188 V192 C195 A208 Y210	I180-V184 HydrophobicContact CG2-CG2 4.43Å; I180-V184 WeakPolarHBondContact O-CG2 3.38Å; I180-V184 PolarHBondContact O-N 2.94Å; N181-V184 PolarHBondContact O-N 3.05Å; V184-R186 PolarHBondContact O-N 2.89Å; V184-Q187 PolarHBondContact O-N 2.84Å; V184-Q187 VanDerWaalsContact O-N 3.14Å; V184-T188 HydrophobicContact CG1-CG2 4.34Å; V184-T188 WeakPolarHBondContact O-CG2 3.21Å; V184-T188 PolarHBondContact O-N 2.97Å; V184-T188 PolarHBondContact O-OG1 3.06Å; V184-V192 HydrophobicContact CG1-CB 4.31Å; V184-V192 HydrophobicContact CG1-CG1 4.34Å; V184-C195 HydrophobicContact CG1-CB 4.4Å; V184-C195 WeakPolarHBondContact CG1-SG 3.35Å; V184-A208 HydrophobicContact CG2-CB 4.26Å; V184-Y210 HydrophobicContact CG1-CD1 3.86Å; V184-Y210 HydrophobicContact CG1-CG 4.06Å; V184-Y210 HydrophobicContact CG2-CD1 4.21Å
185	R	86.8	Confident	83.3	Confident	136 Å²	136	58.9 Å²	58.9	51%	0.513	28%	0.276	S	S	.	.	H	α-helix	trans	-58	-45.7	175.8	-171.7	-177.9	-178.2	176.1	2.3	111.9	N181 Y183 Q187 T188 Y189 G190 V192 V193	N181-R185 WeakPolarHBondContact O-CB 3.28Å; N181-R185 PolarHBondContact O-N 2.8Å; Y183-R185 VanDerWaalsContact C-N 3.31Å; Y183-R185 PolarHBondContact O-N 2.82Å; R185-Q187 VanDerWaalsContact C-N 3.35Å; R185-T188 PolarHBondContact O-N 3.2Å; R185-T188 PolarHBondContact O-OG1 3.2Å; R185-Y189 PolarHBondContact O-N 3.05Å; R185-G190 PolarHBondContact O-N 3.45Å; R185-V192 WeakPolarHBondContact CA-O 3.42Å; R185-V193 HydrophobicContact CG-CG1 4.16Å
186	R	88.3	Confident	82.4	Confident	161 Å²	161	57.3 Å²	57.3	61%	0.608	27%	0.265	S	S	*	.	H	α-helix	trans	-63.9	-40.5	175.6	-77.2	-173.6	-65.7	-96.5	-1.6	112	D182 Y183 V184 T188 Y189	D182-R186 WeakPolarHBondContact O-CB 3.01Å; D182-R186 WeakPolarHBondContact O-CG 3.47Å; D182-R186 PolarHBondContact O-N 3.22Å; Y183-R186 PolarHBondContact O-N 3.39Å; V184-R186 PolarHBondContact O-N 2.89Å; R186-T188 PolarHBondContact O-N 2.77Å; R186-Y189 PolarHBondContact O-N 3.27Å
187	Q	82.5	Confident	81.3	Confident	54 Å²	54	58.5 Å²	58.5	25%	0.252	27%	0.272	S	S	.	.	H	α-helix	trans	-68.2	-23.3	-179.2	-67	-60.1	-28.7	0	0	113.4	K136 Y183 V184 R185 Y210	K136-Q187 WeakPolarHBondContact CD-O 3.47Å; K136-Q187 WeakPolarHBondContact CE-O 3.37Å; K136-Q187 PolarHBondContact NZ-O 2.58Å; Y183-Q187 HydrophobicContact CD1-CG 4.29Å; Y183-Q187 HydrophobicContact CD2-CG 4.44Å; Y183-Q187 HydrophobicContact CE1-CG 3.88Å; Y183-Q187 HydrophobicContact CE2-CG 4.05Å; Y183-Q187 VanDerWaalsContact O-CG 3.32Å; Y183-Q187 WeakPolarHBondContact O-CG 3.41Å; Y183-Q187 PolarHBondContact O-N 3.43Å; V184-Q187 PolarHBondContact O-N 2.84Å; V184-Q187 VanDerWaalsContact O-N 3.14Å; R185-Q187 VanDerWaalsContact C-N 3.35Å; Q187-Y210 HydrophobicContact CB-CE1 4.11Å; Q187-Y210 HydrophobicContact CB-CE2 3.65Å; Q187-Y210 VanDerWaalsContact CB-OH 3.24Å; Q187-Y210 WeakPolarHBondContact CB-OH 3.47Å; Q187-Y210 HydrophobicContact CG-CE1 4.41Å; Q187-Y210 VanDerWaalsContact CG-OH 3.27Å; Q187-Y210 WeakPolarHBondContact CG-OH 3.12Å
188	T	80.2	Confident	80.5	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	17.2	-177.1	60.2	0	0	0	0	113.1	V184 R185 R186 G190 Q191 V192 Y210	V184-T188 HydrophobicContact CG1-CG2 4.34Å; V184-T188 WeakPolarHBondContact O-CG2 3.21Å; V184-T188 PolarHBondContact O-N 2.97Å; V184-T188 PolarHBondContact O-OG1 3.06Å; R185-T188 PolarHBondContact O-N 3.2Å; R185-T188 PolarHBondContact O-OG1 3.2Å; R186-T188 PolarHBondContact O-N 2.77Å; T188-G190 PolarHBondContact O-N 2.97Å; T188-G190 VanDerWaalsContact O-N 3.1Å; T188-Q191 WeakPolarHBondContact O-CB 3.4Å; T188-Q191 WeakPolarHBondContact O-CG 3.06Å; T188-Q191 PolarHBondContact O-N 3.07Å; T188-V192 HydrophobicContact CG2-CB 3.84Å; T188-V192 HydrophobicContact CG2-CG2 3.63Å; T188-V192 WeakPolarHBondContact OG1-CB 3.2Å; T188-V192 PolarHBondContact OG1-N 2.86Å; T188-V192 VanDerWaalsContact OG1-N 3.14Å; T188-V192 PolarHBondContact OG1-O 3.33Å; T188-Y210 HydrophobicContact CG2-CD2 3.33Å; T188-Y210 HydrophobicContact CG2-CE2 3.97Å; T188-Y210 HydrophobicContact CG2-CG 3.8Å
189	Y	84.3	Confident	79.9	Confident	140 Å²	140	60.3 Å²	60.3	55%	0.549	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	30.6	179.9	-47.7	-73.6	0	0	0	114.2	E134 R185 R186 F212	E134-Y189 WeakPolarHBondContact OE1-CE2 3.42Å; E134-Y189 PolarHBondContact OE1-OH 3.15Å; R185-Y189 PolarHBondContact O-N 3.05Å; R186-Y189 PolarHBondContact O-N 3.27Å; Y189-F212 HydrophobicContact CD2-CD1 4.05Å; Y189-F212 AromaticContact CD2-CE1 3.7Å; Y189-F212 HydrophobicContact CD2-CE1 3.7Å; Y189-F212 AromaticContact CD2-CZ 4Å; Y189-F212 HydrophobicContact CD2-CZ 4Å; Y189-F212 HydrophobicContact CE2-CD1 4.03Å; Y189-F212 AromaticContact CE2-CE1 3.74Å; Y189-F212 HydrophobicContact CE2-CE1 3.74Å; Y189-F212 HydrophobicContact CE2-CZ 4.45Å
190	G	83.3	Confident	79.2	Confident	31 Å²	31	56.9 Å²	56.9	32%	0.32	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.5	-5.2	179.6	0	0	0	0	0	115.6	R185 T188	R185-G190 PolarHBondContact O-N 3.45Å; T188-G190 PolarHBondContact O-N 2.97Å; T188-G190 VanDerWaalsContact O-N 3.1Å
191	Q	76.4	Confident	78.7	Confident	60 Å²	60	63.3 Å²	63.3	28%	0.28	30%	0.303	S	S	.	.	S	Bend	trans	-75.8	-36.7	-174.2	-65.3	-66.3	-24	0	0	112.7	T188 F212	T188-Q191 WeakPolarHBondContact O-CB 3.4Å; T188-Q191 WeakPolarHBondContact O-CG 3.06Å; T188-Q191 PolarHBondContact O-N 3.07Å; Q191-F212 HydrophobicContact CB-CD2 4.3Å; Q191-F212 HydrophobicContact CB-CE2 4.49Å; Q191-F212 HydrophobicContact CG-CD2 4.12Å; Q191-F212 HydrophobicContact CG-CE2 3.81Å
192	V	72.9	Confident	78.2	Confident	2 Å²	2	65.9 Å²	65.9	1%	0.012	32%	0.317	C	S	.	.	S	Bend	trans	-106.4	110.6	179.8	-163	0	0	0	0	108.4	V184 R185 T188 C195 K359	V184-V192 HydrophobicContact CG1-CB 4.31Å; V184-V192 HydrophobicContact CG1-CG1 4.34Å; R185-V192 WeakPolarHBondContact CA-O 3.42Å; T188-V192 HydrophobicContact CG2-CB 3.84Å; T188-V192 HydrophobicContact CG2-CG2 3.63Å; T188-V192 WeakPolarHBondContact OG1-CB 3.2Å; T188-V192 PolarHBondContact OG1-N 2.86Å; T188-V192 VanDerWaalsContact OG1-N 3.14Å; T188-V192 PolarHBondContact OG1-O 3.33Å; V192-C195 WeakPolarHBondContact CG1-SG 3.28Å; V192-K359 HydrophobicContact CG1-CB 3.81Å; V192-K359 HydrophobicContact CG1-CD 3.69Å; V192-K359 HydrophobicContact CG1-CG 3.63Å
193	V	76	Confident	78	Confident	54 Å²	54	62.8 Å²	62.8	33%	0.327	30%	0.301	S	S	.	.			trans	-115.5	154.4	177.7	-64.9	0	0	0	0	110.1	R185 C195 K359	R185-V193 HydrophobicContact CG-CG1 4.16Å; V193-C195 PolarHBondContact O-N 3Å; V193-K359 WeakPolarHBondContact O-CD 3.3Å; V193-K359 VanDerWaalsContact O-CE 3.23Å; V193-K359 WeakPolarHBondContact O-CE 3.44Å; V193-K359 PolarHBondContact O-NZ 3.29Å
194	D	72.8	Confident	77.7	Confident	108 Å²	108	62.4 Å²	62.4	58%	0.578	30%	0.301	S	S	*	.			trans	47.5	64.6	172.5	-55.4	-38.5	0	0	0	113.7	N181 K359	N181-D194 PolarHBondContact ND2-OD1 2.9Å; N181-D194 VanDerWaalsContact ND2-OD1 3.08Å; D194-K359 PolarHBondContact O-NZ 2.9Å
195	C	67.8	Low	77.8	Confident	5 Å²	5	62.5 Å²	62.5	3%	0.034	30%	0.301	C	S	.	.			trans	-95.6	-8.1	-172.5	-47.7	0	0	0	0	112.9	N181 V184 V192 V193 S357 K359	N181-C195 PolarHBondContact OD1-N 2.99Å; V184-C195 HydrophobicContact CG1-CB 4.4Å; V184-C195 WeakPolarHBondContact CG1-SG 3.35Å; V192-C195 WeakPolarHBondContact CG1-SG 3.28Å; V193-C195 PolarHBondContact O-N 3Å; C195-S357 WeakPolarHBondContact O-CB 3.19Å; C195-S357 PolarHBondContact O-OG 2.92Å; C195-K359 HydrophobicContact CB-CB 4.22Å; C195-K359 HydrophobicContact CB-CD 4.38Å
196	L	70.5	Confident	77.8	Confident	29 Å²	29	56 Å²	56	15%	0.152	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-99	134.9	-171.9	-70.6	-176.2	0	0	0	111.8	I180 F199 V206 A208	I180-L196 HydrophobicContact CB-CD1 3.4Å; I180-L196 VanDerWaalsContact CB-CD1 3.4Å; I180-L196 HydrophobicContact CB-CG 4.36Å; I180-L196 HydrophobicContact CD1-CD1 3.63Å; I180-L196 HydrophobicContact CG1-CD1 4.08Å; I180-L196 HydrophobicContact CG2-CD1 3.37Å; I180-L196 HydrophobicContact CG2-CD2 3.92Å; I180-L196 HydrophobicContact CG2-CG 3.82Å; L196-F199 HydrophobicContact CD1-CE1 3.93Å; L196-V206 HydrophobicContact CD2-CG1 3.53Å; L196-A208 HydrophobicContact CD2-CB 4.35Å
197	P	66.4	Low	77.6	Confident	27 Å²	27	48.5 Å²	48.5	18%	0.175	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-64.1	162	164.3	30.1	-36.3	0	0	0	109.3	F199 R355 S357	P197-F199 WeakPolarHBondContact O-CD1 3.19Å; P197-F199 PolarHBondContact O-N 3.41Å; P197-R355 HydrophobicContact CG-CB 4.22Å; P197-S357 VanDerWaalsContact CD-CB 3.45Å
198	E	71.5	Confident	77.6	Confident	188 Å²	188	46 Å²	46	88%	0.879	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-59.4	129.6	166.2	-67.7	-173.1	174.1	0	0	109.3
199	F	75.6	Confident	77.7	Confident	26 Å²	26	46.2 Å²	46.2	11%	0.114	24%	0.239	C	C	.	.			trans	-121.4	142.1	178.1	56.5	-96.6	0	0	0	109.9	F170 S173 T176 L196 P197 T203 R355	F170-F199 HydrophobicContact CB-CD2 4.42Å; F170-F199 AromaticContact CD1-CD2 3.63Å; F170-F199 HydrophobicContact CD1-CD2 3.63Å; F170-F199 AromaticContact CD1-CE2 3.55Å; F170-F199 HydrophobicContact CD1-CE2 3.55Å; F170-F199 HydrophobicContact CD1-CG 4.43Å; F170-F199 HydrophobicContact CD1-CZ 4.31Å; F170-F199 HydrophobicContact CE1-CD2 4.37Å; F170-F199 HydrophobicContact CE1-CE2 4.29Å; F170-F199 HydrophobicContact CG-CD2 4.42Å; S173-F199 VanDerWaalsContact O-CZ 3.31Å; S173-F199 WeakPolarHBondContact O-CZ 3.17Å; T176-F199 HydrophobicContact CG2-CE2 4.33Å; T176-F199 HydrophobicContact CG2-CZ 4.13Å; L196-F199 HydrophobicContact CD1-CE1 3.93Å; P197-F199 WeakPolarHBondContact O-CD1 3.19Å; P197-F199 PolarHBondContact O-N 3.41Å; F199-T203 HydrophobicContact CB-CG2 4.16Å; F199-T203 WeakPolarHBondContact CB-OG1 3.21Å; F199-R355 HydrophobicContact CB-CG 4.16Å
200	S	74.4	Confident	77.5	Confident	43 Å²	43	40 Å²	40	30%	0.301	21%	0.214	S	C	.	.			trans	-94.6	166.6	-174.7	44.5	0	0	0	0	111.5	D202 T203	S200-D202 WeakPolarHBondContact CB-OD1 3.12Å; S200-D202 PolarHBondContact O-N 3.47Å; S200-D202 VanDerWaalsContact O-N 3.14Å; S200-D202 PolarHBondContact OG-OD1 2.72Å; S200-T203 PolarHBondContact N-OG1 2.6Å; S200-T203 VanDerWaalsContact N-OG1 3.14Å; S200-T203 WeakPolarHBondContact O-CB 3.38Å; S200-T203 PolarHBondContact O-N 2.91Å; S200-T203 PolarHBondContact O-OG1 3Å
201	Q	77.1	Confident	77.5	Confident	136 Å²	136	38.5 Å²	38.5	64%	0.636	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-17.2	-175.3	-64.2	-176.2	-14.3	0	0	114.4
202	D	76.9	Confident	77.8	Confident	84 Å²	84	36.3 Å²	36.3	45%	0.449	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-2.7	174.3	58.2	-11.5	0	0	0	113.1	S200 L204 I353	S200-D202 WeakPolarHBondContact CB-OD1 3.12Å; S200-D202 PolarHBondContact O-N 3.47Å; S200-D202 VanDerWaalsContact O-N 3.14Å; S200-D202 PolarHBondContact OG-OD1 2.72Å; D202-L204 PolarHBondContact O-N 3.03Å; D202-I353 HydrophobicContact CB-CD1 3.99Å; D202-I353 WeakPolarHBondContact OD2-CD1 3.38Å
203	T	83.3	Confident	78.5	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	129.5	172.5	-57.2	0	0	0	0	109.6	F170 F199 S200 V206 R355	F170-T203 HydrophobicContact CD1-CG2 4.39Å; F170-T203 HydrophobicContact CD2-CG2 4.25Å; F170-T203 WeakPolarHBondContact CD2-O 3.49Å; F170-T203 HydrophobicContact CE1-CG2 4.48Å; F170-T203 HydrophobicContact CE2-CG2 4.31Å; F170-T203 HydrophobicContact CG-CG2 4.28Å; F170-T203 HydrophobicContact CZ-CG2 4.43Å; F199-T203 HydrophobicContact CB-CG2 4.16Å; F199-T203 WeakPolarHBondContact CB-OG1 3.21Å; S200-T203 PolarHBondContact N-OG1 2.6Å; S200-T203 VanDerWaalsContact N-OG1 3.14Å; S200-T203 WeakPolarHBondContact O-CB 3.38Å; S200-T203 PolarHBondContact O-N 2.91Å; S200-T203 PolarHBondContact O-OG1 3Å; T203-V206 HydrophobicContact CG2-CG2 3.62Å; T203-R355 HydrophobicContact CG2-CG 3.9Å
204	L	82.4	Confident	78.9	Confident	25 Å²	25	36.4 Å²	36.4	13%	0.131	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-25.9	-178.5	-74.4	-173.4	0	0	0	112.4	D144 L147 D202 N350 T352 I353	D144-L204 HydrophobicContact CB-CD2 3.98Å; D144-L204 PolarHBondContact N-O 2.85Å; L147-L204 HydrophobicContact CD1-CB 4.23Å; L147-L204 WeakPolarHBondContact CD1-O 3.24Å; L147-L204 HydrophobicContact CD2-CD2 4.45Å; D202-L204 PolarHBondContact O-N 3.03Å; L204-N350 HydrophobicContact CD1-CB 4.18Å; L204-T352 HydrophobicContact CB-CG2 3.76Å; L204-I353 PolarHBondContact N-O 2.95Å
205	M	85.4	Confident	79.6	Confident	4 Å²	4	31.4 Å²	31.4	2%	0.02	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	131.7	-176.4	-176.8	165.5	67.4	0	0	110.1	L87 L141 F142 L143 F342 T352 S354 R355	L87-M205 HydrophobicContact CD1-CE 3.41Å; L87-M205 VanDerWaalsContact CD1-CE 3.41Å; L87-M205 HydrophobicContact CD1-SD 4.43Å; L141-M205 HydrophobicContact CD1-CG 3.58Å; L141-M205 HydrophobicContact CD1-SD 3.69Å; L141-M205 HydrophobicContact CG-CG 4.45Å; F142-M205 CarbonylContact O-C 3.56Å; F142-M205 WeakPolarHBondContact O-CA 2.8Å; L143-M205 HydrophobicContact CD2-CB 4.15Å; L143-M205 HydrophobicContact CD2-CG 3.81Å; L143-M205 HydrophobicContact CD2-SD 3.97Å; M205-F342 HydrophobicContact CE-CD2 4.41Å; M205-F342 HydrophobicContact CE-CG 4.37Å; M205-T352 HydrophobicContact CB-CG2 3.91Å; M205-T352 HydrophobicContact CE-CG2 4.28Å; M205-S354 WeakPolarHBondContact CE-OG 3.33Å; M205-S354 CarbonylContact O-C 3.5Å; M205-S354 WeakPolarHBondContact O-CA 3.43Å; M205-R355 PolarHBondContact O-N 2.78Å
206	V	85.1	Confident	80.7	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	125	170.5	176.6	0	0	0	0	108.1	F142 F170 L196 T203 R355	F142-V206 HydrophobicContact CB-CB 4.23Å; F142-V206 PolarHBondContact N-O 2.88Å; F142-V206 PolarHBondContact O-N 2.79Å; F170-V206 HydrophobicContact CD1-CG2 4.32Å; F170-V206 HydrophobicContact CE1-CB 4.18Å; F170-V206 HydrophobicContact CE1-CG2 3.4Å; F170-V206 HydrophobicContact CE2-CG2 4.41Å; F170-V206 HydrophobicContact CZ-CB 3.97Å; F170-V206 HydrophobicContact CZ-CG2 3.45Å; F170-V206 VanDerWaalsContact CZ-CG2 3.45Å; L196-V206 HydrophobicContact CD2-CG1 3.53Å; T203-V206 HydrophobicContact CG2-CG2 3.62Å; V206-R355 CarbonylContact C-O 3.56Å; V206-R355 WeakPolarHBondContact CA-O 3.48Å; V206-R355 HydrophobicContact CG2-CB 4.14Å
207	L	85.4	Confident	81.8	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.016	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	110.1	174.6	-175	58.5	0	0	0	108.7	T83 L86 L87 L141 R355 V356 S357	T83-L207 HydrophobicContact CG2-CD2 3.26Å; T83-L207 HydrophobicContact CG2-CG 3.69Å; T83-L207 WeakPolarHBondContact O-CD2 3.33Å; L86-L207 HydrophobicContact CD2-CD1 3.96Å; L86-L207 HydrophobicContact CD2-CD2 4.05Å; L87-L207 HydrophobicContact CB-CD2 4.42Å; L141-L207 HydrophobicContact CB-CD1 4.36Å; L141-L207 HydrophobicContact CD1-CB 4.26Å; L141-L207 HydrophobicContact CD1-CD1 3.92Å; L207-R355 PolarHBondContact N-O 3.34Å; L207-V356 HydrophobicContact CB-CG1 4.37Å; L207-V356 HydrophobicContact CB-CG2 4.37Å; L207-V356 HydrophobicContact CD2-CG1 4.49Å; L207-S357 PolarHBondContact O-N 3.07Å
208	A	81.3	Confident	83	Confident	2 Å²	2	37.9 Å²	37.9	2%	0.017	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	120.2	177.6	0	0	0	0	0	109.4	S140 F142 I180 V184 L196	S140-A208 PolarHBondContact N-O 3.15Å; S140-A208 PolarHBondContact O-N 2.64Å; F142-A208 HydrophobicContact CD2-CB 4.42Å; F142-A208 HydrophobicContact CE2-CB 3.92Å; I180-A208 HydrophobicContact CG2-CB 4.44Å; V184-A208 HydrophobicContact CG2-CB 4.26Å; L196-A208 HydrophobicContact CD2-CB 4.35Å
209	N	82.2	Confident	83.9	Confident	4 Å²	4	31 Å²	31	2%	0.021	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	133.4	178.2	172.8	-99	0	0	0	110.5	S79 T83 G138 N139 S357 H358	S79-N209 WeakPolarHBondContact CB-OD1 3.32Å; S79-N209 PolarHBondContact O-ND2 3.22Å; S79-N209 PolarHBondContact O-OD1 2.85Å; S79-N209 PolarHBondContact OG-ND2 3.39Å; S79-N209 PolarHBondContact OG-OD1 2.89Å; T83-N209 HydrophobicContact CG2-CB 4.17Å; T83-N209 WeakPolarHBondContact OG1-CB 3.39Å; T83-N209 PolarHBondContact OG1-ND2 2.98Å; G138-N209 PolarHBondContact O-ND2 3.03Å; N139-N209 PolarHBondContact OD1-ND2 2.84Å; N209-S357 PolarHBondContact N-O 2.93Å; N209-H358 PolarHBondContact OD1-ND1 2.84Å
210	Y	79.9	Confident	84.7	Confident	8 Å²	8	31.9 Å²	31.9	3%	0.031	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	150	178.5	58.6	-92.5	0	0	0	110.9	G138 Y183 V184 Q187 T188	G138-Y210 PolarHBondContact N-O 2.88Å; G138-Y210 PolarHBondContact O-N 2.85Å; G138-Y210 VanDerWaalsContact O-N 3.09Å; Y183-Y210 HydrophobicContact CE1-CE1 4.41Å; V184-Y210 HydrophobicContact CG1-CD1 3.86Å; V184-Y210 HydrophobicContact CG1-CG 4.06Å; V184-Y210 HydrophobicContact CG2-CD1 4.21Å; Q187-Y210 HydrophobicContact CB-CE1 4.11Å; Q187-Y210 HydrophobicContact CB-CE2 3.65Å; Q187-Y210 VanDerWaalsContact CB-OH 3.24Å; Q187-Y210 WeakPolarHBondContact CB-OH 3.47Å; Q187-Y210 HydrophobicContact CG-CE1 4.41Å; Q187-Y210 VanDerWaalsContact CG-OH 3.27Å; Q187-Y210 WeakPolarHBondContact CG-OH 3.12Å; T188-Y210 HydrophobicContact CG2-CD2 3.33Å; T188-Y210 HydrophobicContact CG2-CE2 3.97Å; T188-Y210 HydrophobicContact CG2-CG 3.8Å
211	I	84.5	Confident	85.5	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	137.4	172.2	-175.3	169.3	0	0	0	108.8	S76 L135 K136 V137 A360 F412	S76-I211 WeakPolarHBondContact OG-CD1 3.38Å; L135-I211 HydrophobicContact CD1-CD1 4.13Å; L135-I211 HydrophobicContact CD1-CG1 4.11Å; K136-I211 CarbonylContact O-C 3.59Å; K136-I211 VanDerWaalsContact O-CA 3.31Å; K136-I211 WeakPolarHBondContact O-CA 3.26Å; V137-I211 HydrophobicContact CG2-CD1 3.96Å; V137-I211 HydrophobicContact CG2-CG1 4.03Å; I211-A360 HydrophobicContact CG2-CB 4.29Å; I211-F412 HydrophobicContact CB-CZ 4.3Å; I211-F412 HydrophobicContact CD1-CE1 4.31Å; I211-F412 HydrophobicContact CD1-CE2 4.06Å; I211-F412 HydrophobicContact CD1-CZ 3.75Å; I211-F412 HydrophobicContact CG1-CE1 4.4Å; I211-F412 HydrophobicContact CG1-CE2 4.43Å; I211-F412 HydrophobicContact CG1-CZ 3.77Å; I211-F412 HydrophobicContact CG2-CD1 4.45Å; I211-F412 HydrophobicContact CG2-CE1 3.4Å; I211-F412 HydrophobicContact CG2-CZ 3.63Å
212	F	83	Confident	86.1	Confident	13 Å²	13	25.5 Å²	25.5	6%	0.057	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	127	174	169.1	-109.4	0	0	0	108.5	E134 L135 K136 Y189 Q191 K214	E134-F212 HydrophobicContact CB-CE1 4.49Å; E134-F212 HydrophobicContact CG-CD1 4.38Å; E134-F212 HydrophobicContact CG-CE1 3.84Å; L135-F212 WeakPolarHBondContact CA-O 3.39Å; L135-F212 WeakPolarHBondContact CD1-O 3.3Å; K136-F212 HydrophobicContact CB-CB 4.33Å; K136-F212 HydrophobicContact CB-CD1 4.49Å; K136-F212 PolarHBondContact N-O 3.4Å; K136-F212 PolarHBondContact O-N 3.14Å; Y189-F212 HydrophobicContact CD2-CD1 4.05Å; Y189-F212 AromaticContact CD2-CE1 3.7Å; Y189-F212 HydrophobicContact CD2-CE1 3.7Å; Y189-F212 AromaticContact CD2-CZ 4Å; Y189-F212 HydrophobicContact CD2-CZ 4Å; Y189-F212 HydrophobicContact CE2-CD1 4.03Å; Y189-F212 AromaticContact CE2-CE1 3.74Å; Y189-F212 HydrophobicContact CE2-CE1 3.74Å; Y189-F212 HydrophobicContact CE2-CZ 4.45Å; Q191-F212 HydrophobicContact CB-CD2 4.3Å; Q191-F212 HydrophobicContact CB-CE2 4.49Å; Q191-F212 HydrophobicContact CG-CD2 4.12Å; Q191-F212 HydrophobicContact CG-CE2 3.81Å; F212-K214 HydrophobicContact CE1-CB 3.82Å; F212-K214 HydrophobicContact CE1-CD 4.14Å; F212-K214 HydrophobicContact CE2-CB 4.16Å; F212-K214 HydrophobicContact CZ-CB 3.51Å; F212-K214 HydrophobicContact CZ-CD 3.63Å; F212-K214 HydrophobicContact CZ-CG 4.28Å
213	F	86.6	Confident	86.7	Confident	8 Å²	8	29 Å²	29	4%	0.035	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	126.3	179.1	170.4	-88.3	0	0	0	110.7	L133 L135 A215 Y268 A272 V362 T369 L411 F412	L133-F213 HydrophobicContact CD1-CD2 3.68Å; L133-F213 HydrophobicContact CD1-CE2 3.3Å; L133-F213 HydrophobicContact CD1-CZ 4.07Å; L135-F213 HydrophobicContact CD1-CB 4.29Å; L135-F213 HydrophobicContact CD1-CD2 4.28Å; F213-A215 HydrophobicContact CE1-CB 4.11Å; F213-A215 HydrophobicContact CE2-CB 4.32Å; F213-A215 HydrophobicContact CZ-CB 3.71Å; F213-Y268 HydrophobicContact CE1-CE1 4.09Å; F213-Y268 HydrophobicContact CE1-CE2 4.28Å; F213-Y268 AromaticContact CE1-CZ 3.89Å; F213-Y268 HydrophobicContact CZ-CD1 4.4Å; F213-Y268 HydrophobicContact CZ-CD2 4.16Å; F213-Y268 HydrophobicContact CZ-CE1 4.26Å; F213-Y268 AromaticContact CZ-CE2 3.99Å; F213-Y268 HydrophobicContact CZ-CE2 3.99Å; F213-Y268 HydrophobicContact CZ-CG 4.36Å; F213-A272 HydrophobicContact CE2-CB 3.79Å; F213-A272 HydrophobicContact CZ-CB 3.99Å; F213-V362 HydrophobicContact CD1-CG2 4.41Å; F213-T369 HydrophobicContact CD1-CG2 3.88Å; F213-T369 HydrophobicContact CE1-CG2 3.64Å; F213-T369 PolarHBondContact O-OG1 3.19Å; F213-L411 HydrophobicContact CD2-CD1 3.82Å; F213-L411 HydrophobicContact CE2-CD1 4.05Å; F213-F412 HydrophobicContact CB-CE2 3.45Å; F213-F412 VanDerWaalsContact CB-CE2 3.45Å; F213-F412 HydrophobicContact CB-CZ 3.82Å; F213-F412 HydrophobicContact CD2-CE2 4.5Å; F213-F412 AromaticContact CG-CE2 3.99Å; F213-F412 HydrophobicContact CG-CE2 3.99Å
214	K	84.6	Confident	86.9	Confident	50 Å²	50	36.9 Å²	36.9	22%	0.217	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	114.8	-178.4	166.1	173.4	162.4	-179.5	0	110.8	E134 F212 T369 E370	E134-K214 HydrophobicContact CB-CB 4.08Å; E134-K214 HydrophobicContact CB-CD 4.39Å; E134-K214 HydrophobicContact CB-CG 4.29Å; E134-K214 PolarHBondContact N-O 3.47Å; E134-K214 PolarHBondContact O-N 2.86Å; E134-K214 WeakPolarHBondContact OE2-CD 3.19Å; E134-K214 WeakPolarHBondContact OE2-CE 3.43Å; E134-K214 IonicContact OE2-NZ 3.66Å; E134-K214 PolarHBondContact OE2-NZ 3.46Å; F212-K214 HydrophobicContact CE1-CB 3.82Å; F212-K214 HydrophobicContact CE1-CD 4.14Å; F212-K214 HydrophobicContact CE2-CB 4.16Å; F212-K214 HydrophobicContact CZ-CB 3.51Å; F212-K214 HydrophobicContact CZ-CD 3.63Å; F212-K214 HydrophobicContact CZ-CG 4.28Å; K214-T369 WeakPolarHBondContact CA-OG1 3.37Å; K214-E370 HydrophobicContact CD-CB 4.13Å; K214-E370 HydrophobicContact CD-CG 3.98Å; K214-E370 WeakPolarHBondContact CD-OE1 3.38Å; K214-E370 WeakPolarHBondContact CE-OE1 3.16Å; K214-E370 WeakPolarHBondContact CE-OE2 3Å; K214-E370 HydrophobicContact CG-CB 4.09Å; K214-E370 HydrophobicContact CG-CG 4.41Å; K214-E370 IonicContact NZ-OE1 3.7Å; K214-E370 PolarHBondContact NZ-OE1 2.87Å; K214-E370 IonicContact NZ-OE2 2.92Å; K214-E370 PolarHBondContact NZ-OE2 2.85Å
215	A	88.1	Confident	87.3	Confident	3 Å²	3	40.3 Å²	40.3	3%	0.025	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	154	176.4	0	0	0	0	0	111	L133 F213 Y268 G368 T369	L133-A215 HydrophobicContact CD1-CB 3.8Å; F213-A215 HydrophobicContact CE1-CB 4.11Å; F213-A215 HydrophobicContact CE2-CB 4.32Å; F213-A215 HydrophobicContact CZ-CB 3.71Å; A215-Y268 HydrophobicContact CB-CD1 3.45Å; A215-Y268 VanDerWaalsContact CB-CD1 3.45Å; A215-Y268 HydrophobicContact CB-CE1 4.15Å; A215-Y268 HydrophobicContact CB-CG 3.85Å; A215-G368 WeakPolarHBondContact O-CA 3.49Å; A215-T369 PolarHBondContact N-OG1 2.91Å; A215-T369 PolarHBondContact O-N 2.85Å; A215-T369 PolarHBondContact O-OG1 2.9Å
216	K	90.8	Very high	87.6	Confident	103 Å²	103	41 Å²	41	45%	0.448	19%	0.185	S	C	.	.	B	Isolated β-bridge	trans	-93.4	146.3	174.4	-66.2	-179.3	-178.1	177.6	0	110.3	Y268 R269 K367	K216-Y268 CarbonylContact O-C 3.54Å; K216-Y268 VanDerWaalsContact O-CA 3.29Å; K216-Y268 WeakPolarHBondContact O-CA 3.31Å; K216-Y268 WeakPolarHBondContact O-CB 3.36Å; K216-Y268 WeakPolarHBondContact O-CD1 3.35Å; K216-R269 PolarHBondContact O-N 2.9Å; K216-K367 CarbonylContact C-O 3.49Å; K216-K367 WeakPolarHBondContact CA-O 3.35Å; K216-K367 WeakPolarHBondContact CB-O 3.37Å
217	W	92.8	Very high	88	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-57	141.8	169.4	-63.2	127.9	0	0	0	110.7	H219 P220 F221 I266 Y268 R269 A274 M364 S365 K367 G368	W217-H219 WeakPolarHBondContact CB-O 3.27Å; W217-H219 PolarHBondContact O-N 3.42Å; W217-P220 HydrophobicContact CB-CB 4.37Å; W217-F221 AromaticContact CD1-CD2 3.82Å; W217-F221 AromaticContact NE1-CD2 3.82Å; W217-F221 AromaticContact NE1-CE2 3.75Å; W217-I266 HydrophobicContact CD2-CG2 4.28Å; W217-I266 HydrophobicContact CE3-CB 4.39Å; W217-I266 HydrophobicContact CE3-CG2 3.52Å; W217-I266 HydrophobicContact CH2-CG2 4.39Å; W217-I266 HydrophobicContact CZ3-CB 3.97Å; W217-I266 HydrophobicContact CZ3-CG2 3.59Å; W217-Y268 HydrophobicContact CD2-CD1 4.43Å; W217-Y268 HydrophobicContact CD2-CE1 4.07Å; W217-Y268 AromaticContact CE3-CD1 3.84Å; W217-Y268 HydrophobicContact CE3-CD1 3.84Å; W217-Y268 HydrophobicContact CE3-CD2 4.3Å; W217-Y268 AromaticContact CE3-CE1 3.59Å; W217-Y268 HydrophobicContact CE3-CE1 3.59Å; W217-Y268 HydrophobicContact CE3-CE2 4.08Å; W217-Y268 HydrophobicContact CE3-CG 4.2Å; W217-Y268 AromaticContact CE3-CZ 3.73Å; W217-Y268 HydrophobicContact CH2-CE1 4.03Å; W217-Y268 HydrophobicContact CH2-CE2 4.1Å; W217-Y268 AromaticContact CH2-CZ 3.52Å; W217-Y268 WeakPolarHBondContact CH2-OH 3.22Å; W217-Y268 HydrophobicContact CZ2-CE1 4.46Å; W217-Y268 HydrophobicContact CZ3-CD1 4.16Å; W217-Y268 HydrophobicContact CZ3-CD2 4.04Å; W217-Y268 AromaticContact CZ3-CE1 3.58Å; W217-Y268 HydrophobicContact CZ3-CE1 3.58Å; W217-Y268 AromaticContact CZ3-CE2 3.44Å; W217-Y268 HydrophobicContact CZ3-CE2 3.44Å; W217-Y268 VanDerWaalsContact CZ3-CE2 3.44Å; W217-Y268 HydrophobicContact CZ3-CG 4.37Å; W217-Y268 AromaticContact CZ3-CZ 3.18Å; W217-Y268 WeakPolarHBondContact CZ3-OH 2.86Å; W217-R269 WeakPolarHBondContact O-CG 3.4Å; W217-R269 PolarHBondContact O-NE 3.34Å; W217-A274 HydrophobicContact CH2-CB 4.2Å; W217-A274 HydrophobicContact CZ3-CB 4.13Å; W217-M364 HydrophobicContact CH2-SD 3.49Å; W217-M364 WeakPolarHBondContact CH2-SD 3.05Å; W217-M364 HydrophobicContact CZ2-CG 3.99Å; W217-M364 HydrophobicContact CZ2-SD 3.32Å; W217-M364 WeakPolarHBondContact CZ2-SD 3.37Å; W217-S365 PolarHBondContact NE1-O 3.4Å; W217-K367 VanDerWaalsContact CD1-C 3.41Å; W217-K367 PolarHBondContact N-O 2.98Å; W217-G368 VanDerWaalsContact CD1-CA 3.49Å; W217-G368 VanDerWaalsContact NE1-N 3.2Å
218	K	92.2	Very high	88.3	Confident	94 Å²	94	54.2 Å²	54.2	41%	0.409	24%	0.243	S	C	.	.	S	Bend	trans	-55.2	-47.7	170.1	-173.4	177.6	169.5	177	0	109.6	E267 R269	K218-E267 HydrophobicContact CB-CB 4.02Å; K218-E267 VanDerWaalsContact CB-O 3.26Å; K218-E267 WeakPolarHBondContact CB-O 3.09Å; K218-E267 HydrophobicContact CD-CB 3.91Å; K218-E267 WeakPolarHBondContact CD-OE2 3.31Å; K218-E267 WeakPolarHBondContact CE-OE2 3.42Å; K218-E267 PolarHBondContact N-O 2.91Å; K218-E267 IonicContact NZ-OE2 3.58Å; K218-E267 PolarHBondContact NZ-OE2 3.23Å; K218-R269 PolarHBondContact O-NE 2.64Å
219	H	90.9	Very high	88.8	Confident	43 Å²	43	60.6 Å²	60.6	20%	0.199	27%	0.273	C	S	.	.	S	Bend	trans	-117.2	98.5	174.1	-57.1	-95	0	0	0	109.2	W217 E249	W217-H219 WeakPolarHBondContact CB-O 3.27Å; W217-H219 PolarHBondContact O-N 3.42Å; H219-E249 HydrophobicContact CB-CG 3.65Å; H219-E249 IonicContact CE1-OE2 3.98Å; H219-E249 IonicContact CG-OE2 3.07Å; H219-E249 IonicContact ND1-OE2 2.78Å; H219-E249 PolarHBondContact ND1-OE2 3.41Å
220	P	91.4	Very high	89.5	Confident	46 Å²	46	61.9 Å²	61.9	30%	0.299	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-77.3	148.9	-177.4	31.4	-34.7	0	0	0	112.4	W217 Q247 E366	W217-P220 HydrophobicContact CB-CB 4.37Å; P220-Q247 PolarHBondContact O-OE1 3.25Å; P220-E366 CarbonylContact C-O 3.59Å; P220-E366 WeakPolarHBondContact CA-O 3.37Å; P220-E366 VanDerWaalsContact CB-O 3.31Å; P220-E366 WeakPolarHBondContact CB-O 3.3Å
221	F	92.3	Very high	90.3	Very high	11 Å²	11	63.4 Å²	63.4	5%	0.048	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-69.4	151.4	172.6	-59.6	-103.5	0	0	0	110.6	W217 M245 Q247 L310 L312 E366	W217-F221 AromaticContact CD1-CD2 3.82Å; W217-F221 AromaticContact NE1-CD2 3.82Å; W217-F221 AromaticContact NE1-CE2 3.75Å; F221-M245 HydrophobicContact CB-CB 4.25Å; F221-M245 HydrophobicContact CD1-CB 3.64Å; F221-M245 HydrophobicContact CD2-CE 4.31Å; F221-M245 HydrophobicContact CD2-SD 4.38Å; F221-M245 HydrophobicContact CE1-CB 4.07Å; F221-M245 HydrophobicContact CE2-CE 4.17Å; F221-M245 HydrophobicContact CG-CB 3.92Å; F221-M245 HydrophobicContact CG-SD 4.49Å; F221-M245 HydrophobicContact CZ-CE 4.41Å; F221-Q247 HydrophobicContact CD1-CB 3.87Å; F221-Q247 HydrophobicContact CD1-CG 3.62Å; F221-Q247 HydrophobicContact CE1-CB 4.29Å; F221-Q247 HydrophobicContact CE1-CG 3.58Å; F221-Q247 HydrophobicContact CG-CG 4.38Å; F221-Q247 HydrophobicContact CZ-CG 4.3Å; F221-L310 HydrophobicContact CE1-CD2 3.94Å; F221-L310 HydrophobicContact CE1-CG 4.15Å; F221-L310 HydrophobicContact CZ-CD2 3.65Å; F221-L310 HydrophobicContact CZ-CG 4.27Å; F221-L312 HydrophobicContact CE1-CB 4.4Å; F221-L312 HydrophobicContact CE2-CD2 4.42Å; F221-L312 HydrophobicContact CZ-CB 4.16Å; F221-L312 HydrophobicContact CZ-CD2 4.09Å; F221-E366 HydrophobicContact CB-CB 3.88Å; F221-E366 HydrophobicContact CB-CG 3.83Å; F221-E366 PolarHBondContact N-O 2.95Å
222	S	88.4	Confident	90.9	Very high	33 Å²	33	63.4 Å²	63.4	23%	0.231	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-85.5	123.4	171.4	-178.6	0	0	0	0	110.5	Y224 Q225 T226	S222-Y224 PolarHBondContact O-N 2.97Å; S222-Y224 PolarHBondContact OG-N 3.34Å; S222-Q225 PolarHBondContact O-N 3.44Å; S222-T226 PolarHBondContact O-N 3.04Å; S222-T226 PolarHBondContact O-OG1 2.88Å
223	R	89.4	Confident	91.5	Very high	157 Å²	157	67.2 Å²	67.2	59%	0.592	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-21.8	173.3	71.3	178.4	-177	-176.8	0.2	114.1
224	Y	89.2	Confident	91.8	Very high	166 Å²	166	68.3 Å²	68.3	65%	0.651	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-17.9	179.3	-57.4	-68.9	0	0	0	112.4	S222	S222-Y224 PolarHBondContact O-N 2.97Å; S222-Y224 PolarHBondContact OG-N 3.34Å
225	Q	90.3	Very high	91.9	Very high	98 Å²	98	69.5 Å²	69.5	46%	0.458	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-9.7	174.2	-67.4	177.6	-52.3	0	0	111.9	S222 Q227	S222-Q225 PolarHBondContact O-N 3.44Å; Q225-Q227 PolarHBondContact O-N 3.39Å
226	T	91.8	Very high	91.8	Very high	19 Å²	19	77.2 Å²	77.2	12%	0.117	36%	0.364	C	S	.	.			trans	-67.3	115.7	174.3	-55.6	0	0	0	0	110.8	S222 P243 M244 M245 E366	S222-T226 PolarHBondContact O-N 3.04Å; S222-T226 PolarHBondContact O-OG1 2.88Å; T226-P243 HydrophobicContact CG2-CB 4.21Å; T226-M244 CarbonylContact C-O 3.56Å; T226-M244 VanDerWaalsContact CA-O 3.28Å; T226-M244 WeakPolarHBondContact CA-O 3.44Å; T226-M244 WeakPolarHBondContact CG2-O 3.31Å; T226-M245 HydrophobicContact CG2-CG 4.38Å; T226-E366 WeakPolarHBondContact CB-OE1 3.33Å; T226-E366 WeakPolarHBondContact OG1-CG 3.4Å; T226-E366 PolarHBondContact OG1-OE1 3.34Å
227	Q	93.7	Very high	91.8	Very high	99 Å²	99	83.8 Å²	83.8	46%	0.463	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	125.4	170.1	-178.8	165.2	-20.8	0	0	109.1	Q225 Q229 E230 P243 M244	Q225-Q227 PolarHBondContact O-N 3.39Å; Q227-Q229 VanDerWaalsContact C-N 3.32Å; Q227-Q229 WeakPolarHBondContact CG-O 3.24Å; Q227-Q229 PolarHBondContact NE2-O 3.07Å; Q227-Q229 PolarHBondContact O-N 3.04Å; Q227-E230 HydrophobicContact CG-CB 4.35Å; Q227-P243 CarbonylContact O-C 3.44Å; Q227-P243 VanDerWaalsContact O-CA 3.31Å; Q227-P243 WeakPolarHBondContact O-CA 3.13Å; Q227-M244 PolarHBondContact N-O 2.95Å; Q227-M244 PolarHBondContact O-N 3.23Å
228	K	90.7	Very high	91.8	Very high	180 Å²	180	86.8 Å²	86.8	78%	0.783	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	-29.8	-173.2	-68.1	-174.4	179.5	179.5	0	113.7
229	Q	92.3	Very high	91.9	Very high	136 Å²	136	85.3 Å²	85.3	64%	0.636	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.5	107.9	-176.7	-70.8	-171.6	-24.1	0	0	108.3	Q227 Q241	Q227-Q229 VanDerWaalsContact C-N 3.32Å; Q227-Q229 WeakPolarHBondContact CG-O 3.24Å; Q227-Q229 PolarHBondContact NE2-O 3.07Å; Q227-Q229 PolarHBondContact O-N 3.04Å; Q229-Q241 HydrophobicContact CB-CB 4.37Å; Q229-Q241 HydrophobicContact CG-CB 4.32Å
230	E	96.2	Very high	92	Very high	32 Å²	32	85.3 Å²	85.3	15%	0.15	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	147.9	169.7	-172.7	158.1	-164.6	0	0	108.9	Q227 F232 Q241 V242 M244 H311 H393	Q227-E230 HydrophobicContact CG-CB 4.35Å; E230-F232 PolarHBondContact O-N 2.89Å; E230-Q241 WeakPolarHBondContact O-CA 3.19Å; E230-V242 PolarHBondContact N-O 2.91Å; E230-V242 PolarHBondContact O-N 3.23Å; E230-M244 HydrophobicContact CB-CB 3.78Å; E230-M244 HydrophobicContact CB-CE 4.46Å; E230-M244 HydrophobicContact CG-CB 4.34Å; E230-M244 HydrophobicContact CG-CE 4.32Å; E230-M244 WeakPolarHBondContact OE2-CB 3.5Å; E230-M244 WeakPolarHBondContact OE2-CG 3.13Å; E230-H311 IonicContact OE2-ND1 2.64Å; E230-H393 IonicContact OE1-CE1 3.43Å; E230-H393 PolarHBondContact OE1-CE1 3.37Å; E230-H393 IonicContact OE1-NE2 2.81Å; E230-H393 PolarHBondContact OE1-NE2 3.11Å
231	S	96.6	Very high	92.3	Very high	40 Å²	40	87.7 Å²	87.7	28%	0.28	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	122.5	-177.2	-62.4	0	0	0	0	110.8	L240 Q241 N395	S231-L240 CarbonylContact C-O 3.52Å; S231-L240 WeakPolarHBondContact CA-O 3.41Å; S231-Q241 PolarHBondContact OG-NE2 3.07Å; S231-N395 WeakPolarHBondContact O-CB 3.38Å
232	F	97.4	Very high	92.5	Very high	0 Å²	0	87.1 Å²	87.1	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	121.9	164.2	-172.3	-76.3	0	0	0	108.8	E230 V234 S239 L240 V242 P313 F394 N395 R396 F398 V417 P419	E230-F232 PolarHBondContact O-N 2.89Å; F232-V234 HydrophobicContact CD1-CG2 4.46Å; F232-V234 PolarHBondContact O-N 3.04Å; F232-S239 CarbonylContact O-C 3.6Å; F232-S239 WeakPolarHBondContact O-CA 3.33Å; F232-L240 PolarHBondContact N-O 3.05Å; F232-L240 PolarHBondContact O-N 3.31Å; F232-V242 HydrophobicContact CB-CG1 3.83Å; F232-V242 HydrophobicContact CB-CG2 3.92Å; F232-P313 HydrophobicContact CD2-CG 4.25Å; F232-P313 HydrophobicContact CE2-CG 4.12Å; F232-F394 WeakPolarHBondContact CD2-O 3.25Å; F232-F394 VanDerWaalsContact CE2-O 3.27Å; F232-F394 WeakPolarHBondContact CE2-O 3.02Å; F232-N395 CarbonylContact C-O 3.56Å; F232-N395 WeakPolarHBondContact CA-O 3.42Å; F232-R396 VanDerWaalsContact CZ-O 3.27Å; F232-R396 WeakPolarHBondContact CZ-O 3.14Å; F232-F398 HydrophobicContact CE2-CD1 4.31Å; F232-F398 HydrophobicContact CE2-CE1 4.08Å; F232-F398 HydrophobicContact CZ-CD1 4.41Å; F232-F398 HydrophobicContact CZ-CE1 4.41Å; F232-V417 VanDerWaalsContact CE1-O 3.28Å; F232-V417 WeakPolarHBondContact CE1-O 3.45Å; F232-P419 HydrophobicContact CB-CG 4.3Å; F232-P419 HydrophobicContact CD1-CG 4.01Å; F232-P419 HydrophobicContact CD2-CG 3.88Å; F232-P419 HydrophobicContact CE1-CG 4.31Å; F232-P419 HydrophobicContact CE2-CG 4.17Å; F232-P419 HydrophobicContact CG-CG 3.79Å; F232-P419 HydrophobicContact CZ-CG 4.37Å
233	F	96.1	Very high	92.8	Very high	93 Å²	93	87.4 Å²	87.4	41%	0.408	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	107.4	-178.2	-58.9	-86	0	0	0	109.5	D235 N395 R396 P397	F233-D235 VanDerWaalsContact C-N 3.32Å; F233-N395 WeakPolarHBondContact CD2-O 3.35Å; F233-N395 PolarHBondContact N-O 2.77Å; F233-R396 WeakPolarHBondContact O-CA 3.49Å; F233-P397 WeakPolarHBondContact O-CD 3.46Å
234	V	91.8	Very high	93.2	Very high	31 Å²	31	80 Å²	80	19%	0.188	39%	0.385	C	S	.	.	S	Bend	trans	-70.9	-37.2	175.5	-176.2	0	0	0	0	109.7	F232 T238 L240 V417	F232-V234 HydrophobicContact CD1-CG2 4.46Å; F232-V234 PolarHBondContact O-N 3.04Å; V234-T238 HydrophobicContact CB-CG2 4.49Å; V234-T238 PolarHBondContact N-O 3.5Å; V234-L240 HydrophobicContact CG2-CD1 3.34Å; V234-L240 HydrophobicContact CG2-CG 3.71Å; V234-V417 HydrophobicContact CG1-CG1 3.9Å
235	D	88.5	Confident	93.6	Very high	75 Å²	75	72 Å²	72	40%	0.401	35%	0.354	S	S	.	.	S	Bend	trans	-151.7	-177.1	173.8	62.2	60.5	0	0	0	109.3	F233 R237 T238	F233-D235 VanDerWaalsContact C-N 3.32Å; D235-R237 PolarHBondContact O-N 2.82Å; D235-R237 VanDerWaalsContact O-N 3.11Å; D235-R237 WeakPolarHBondContact OD1-CA 3.39Å; D235-R237 WeakPolarHBondContact OD1-CB 3.21Å; D235-R237 PolarHBondContact OD1-N 2.92Å; D235-T238 PolarHBondContact N-O 3.35Å; D235-T238 WeakPolarHBondContact OD1-CB 3.35Å; D235-T238 PolarHBondContact OD1-N 3.48Å; D235-T238 PolarHBondContact OD1-OG1 3.11Å; D235-T238 VanDerWaalsContact OD1-OG1 3.11Å; D235-T238 VanDerWaalsContact OD2-CB 3.3Å; D235-T238 WeakPolarHBondContact OD2-CB 3.15Å; D235-T238 PolarHBondContact OD2-OG1 3.12Å
236	D	85.7	Confident	93.8	Very high	165 Å²	165	69.3 Å²	69.3	88%	0.882	34%	0.341	S	S	*	.	S	Bend	trans	-63.2	-16.1	-177.3	-64.2	-23.8	0	0	0	114.3
237	R	89.6	Confident	93.9	Very high	241 Å²	241	68.9 Å²	68.9	91%	0.909	34%	0.337	S	S	*	.	S	Bend	trans	-116.2	-22.6	-174.8	-59.6	-178.3	-179.1	179	0.6	112.9	D235	D235-R237 PolarHBondContact O-N 2.82Å; D235-R237 VanDerWaalsContact O-N 3.11Å; D235-R237 WeakPolarHBondContact OD1-CA 3.39Å; D235-R237 WeakPolarHBondContact OD1-CB 3.21Å; D235-R237 PolarHBondContact OD1-N 2.92Å
238	T	92.4	Very high	93.8	Very high	64 Å²	64	68.7 Å²	68.7	39%	0.393	34%	0.335	S	S	.	.			trans	-113.8	122.8	-171.5	-47.9	0	0	0	0	110.6	V234 D235	V234-T238 HydrophobicContact CB-CG2 4.49Å; V234-T238 PolarHBondContact N-O 3.5Å; D235-T238 PolarHBondContact N-O 3.35Å; D235-T238 WeakPolarHBondContact OD1-CB 3.35Å; D235-T238 PolarHBondContact OD1-N 3.48Å; D235-T238 PolarHBondContact OD1-OG1 3.11Å; D235-T238 VanDerWaalsContact OD1-OG1 3.11Å; D235-T238 VanDerWaalsContact OD2-CB 3.3Å; D235-T238 WeakPolarHBondContact OD2-CB 3.15Å; D235-T238 PolarHBondContact OD2-OG1 3.12Å
239	S	94.4	Very high	93.8	Very high	62 Å²	62	62.2 Å²	62.2	43%	0.434	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	149.8	171.5	67.8	0	0	0	0	112	F232	F232-S239 CarbonylContact O-C 3.6Å; F232-S239 WeakPolarHBondContact O-CA 3.33Å
240	L	94.6	Very high	93.8	Very high	43 Å²	43	59.5 Å²	59.5	23%	0.225	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	147.2	179	-60.5	169.4	0	0	0	109.1	S231 F232 V234 V242 N418 V420	S231-L240 CarbonylContact C-O 3.52Å; S231-L240 WeakPolarHBondContact CA-O 3.41Å; F232-L240 PolarHBondContact N-O 3.05Å; F232-L240 PolarHBondContact O-N 3.31Å; V234-L240 HydrophobicContact CG2-CD1 3.34Å; V234-L240 HydrophobicContact CG2-CG 3.71Å; L240-V242 HydrophobicContact CB-CG1 4.28Å; L240-N418 HydrophobicContact CD1-CB 4.5Å; L240-N418 WeakPolarHBondContact CD1-OD1 3.5Å; L240-V420 HydrophobicContact CD1-CG2 4.03Å
241	Q	96.4	Very high	93.7	Very high	96 Å²	96	58.5 Å²	58.5	45%	0.449	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	119.1	171.5	-65.8	-57.6	-46.5	0	0	109.5	Q229 E230 S231	Q229-Q241 HydrophobicContact CB-CB 4.37Å; Q229-Q241 HydrophobicContact CG-CB 4.32Å; E230-Q241 WeakPolarHBondContact O-CA 3.19Å; S231-Q241 PolarHBondContact OG-NE2 3.07Å
242	V	96.3	Very high	93.7	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	152	-175.8	-53.3	0	0	0	0	110.8	E230 F232 L240 M244 P313 P419 V420	E230-V242 PolarHBondContact N-O 2.91Å; E230-V242 PolarHBondContact O-N 3.23Å; F232-V242 HydrophobicContact CB-CG1 3.83Å; F232-V242 HydrophobicContact CB-CG2 3.92Å; L240-V242 HydrophobicContact CB-CG1 4.28Å; V242-M244 HydrophobicContact CG2-CE 3.87Å; V242-M244 PolarHBondContact O-N 2.86Å; V242-P313 HydrophobicContact CG2-CB 4.1Å; V242-P419 HydrophobicContact CG1-CG 3.6Å; V242-V420 HydrophobicContact CG1-CG1 3.88Å
243	P	96.4	Very high	93.5	Very high	39 Å²	39	63 Å²	63	25%	0.253	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	115.8	164.8	-11.8	27.2	0	0	0	108.9	T226 Q227 R314	T226-P243 HydrophobicContact CG2-CB 4.21Å; Q227-P243 CarbonylContact O-C 3.44Å; Q227-P243 VanDerWaalsContact O-CA 3.31Å; Q227-P243 WeakPolarHBondContact O-CA 3.13Å; P243-R314 HydrophobicContact CB-CB 4.15Å; P243-R314 PolarHBondContact O-N 3.45Å
244	M	97.5	Very high	93.5	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	115.5	178	-166.2	68.7	67.6	0	0	109.7	T226 Q227 E230 V242 H311 P313 N395	T226-M244 CarbonylContact C-O 3.56Å; T226-M244 VanDerWaalsContact CA-O 3.28Å; T226-M244 WeakPolarHBondContact CA-O 3.44Å; T226-M244 WeakPolarHBondContact CG2-O 3.31Å; Q227-M244 PolarHBondContact N-O 2.95Å; Q227-M244 PolarHBondContact O-N 3.23Å; E230-M244 HydrophobicContact CB-CB 3.78Å; E230-M244 HydrophobicContact CB-CE 4.46Å; E230-M244 HydrophobicContact CG-CB 4.34Å; E230-M244 HydrophobicContact CG-CE 4.32Å; E230-M244 WeakPolarHBondContact OE2-CB 3.5Å; E230-M244 WeakPolarHBondContact OE2-CG 3.13Å; V242-M244 HydrophobicContact CG2-CE 3.87Å; V242-M244 PolarHBondContact O-N 2.86Å; M244-H311 HydrophobicContact CG-CB 3.87Å; M244-H311 HydrophobicContact SD-CB 4.15Å; M244-P313 HydrophobicContact CE-CB 4.41Å; M244-P313 HydrophobicContact SD-CB 4.18Å; M244-N395 HydrophobicContact CE-CB 4.21Å
245	M	97	Very high	93.8	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	140.5	173.8	-49.7	-179.4	-63	0	0	108.5	F221 T226 H311 L312 R314 E366	F221-M245 HydrophobicContact CB-CB 4.25Å; F221-M245 HydrophobicContact CD1-CB 3.64Å; F221-M245 HydrophobicContact CD2-CE 4.31Å; F221-M245 HydrophobicContact CD2-SD 4.38Å; F221-M245 HydrophobicContact CE1-CB 4.07Å; F221-M245 HydrophobicContact CE2-CE 4.17Å; F221-M245 HydrophobicContact CG-CB 3.92Å; F221-M245 HydrophobicContact CG-SD 4.49Å; F221-M245 HydrophobicContact CZ-CE 4.41Å; T226-M245 HydrophobicContact CG2-CG 4.38Å; M245-H311 CarbonylContact O-C 3.58Å; M245-H311 WeakPolarHBondContact O-CA 3.47Å; M245-L312 WeakPolarHBondContact CA-O 3.19Å; M245-L312 VanDerWaalsContact CB-O 3.27Å; M245-L312 WeakPolarHBondContact CB-O 3.44Å; M245-L312 HydrophobicContact CE-CB 4.12Å; M245-L312 HydrophobicContact CE-CD2 3.81Å; M245-L312 HydrophobicContact CE-CG 4.02Å; M245-L312 PolarHBondContact N-O 3.37Å; M245-L312 PolarHBondContact O-N 3.09Å; M245-R314 HydrophobicContact CG-CB 4.2Å; M245-R314 HydrophobicContact SD-CB 4.28Å; M245-E366 HydrophobicContact CB-CG 4.46Å; M245-E366 HydrophobicContact CG-CG 3.94Å; M245-E366 VanDerWaalsContact SD-CA 3.59Å; M245-E366 HydrophobicContact SD-CB 4.31Å; M245-E366 HydrophobicContact SD-CG 3.8Å; M245-E366 PolarHBondContact SD-N 3.36Å
246	H	94.8	Very high	94.2	Very high	40 Å²	40	59.6 Å²	59.6	19%	0.185	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	139.1	-179.5	159.6	-104.3	0	0	0	111.2	D309 L310 H311	H246-D309 IonicContact CD2-OD1 2.84Å; H246-D309 PolarHBondContact CD2-OD1 3.16Å; H246-D309 IonicContact NE2-OD1 2.75Å; H246-D309 PolarHBondContact NE2-OD1 3.24Å; H246-L310 VanDerWaalsContact CA-O 3.27Å; H246-L310 WeakPolarHBondContact CA-O 3.41Å; H246-H311 AromaticContact CD2-CD2 3.74Å; H246-H311 AromaticContact CD2-CE1 3.83Å; H246-H311 AromaticContact CD2-NE2 3.33Å; H246-H311 PolarHBondContact CD2-NE2 2.95Å; H246-H311 VanDerWaalsContact CD2-NE2 3.33Å
247	Q	93.6	Very high	94.7	Very high	10 Å²	10	59.7 Å²	59.7	5%	0.047	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	154.6	169.7	70.9	-174.2	-5.9	0	0	111.8	P220 F221 E249 H251 L310	P220-Q247 PolarHBondContact O-OE1 3.25Å; F221-Q247 HydrophobicContact CD1-CB 3.87Å; F221-Q247 HydrophobicContact CD1-CG 3.62Å; F221-Q247 HydrophobicContact CE1-CB 4.29Å; F221-Q247 HydrophobicContact CE1-CG 3.58Å; F221-Q247 HydrophobicContact CG-CG 4.38Å; F221-Q247 HydrophobicContact CZ-CG 4.3Å; Q247-E249 HydrophobicContact CG-CB 4.28Å; Q247-H251 PolarHBondContact NE2-NE2 2.81Å; Q247-L310 HydrophobicContact CG-CB 4.47Å; Q247-L310 PolarHBondContact N-O 2.99Å; Q247-L310 VanDerWaalsContact N-O 3.08Å; Q247-L310 PolarHBondContact O-N 3.33Å
248	K	92.1	Very high	95	Very high	96 Å²	96	54.7 Å²	54.7	42%	0.417	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	110.8	164.4	-65.1	-169.6	180	-126	0	109.3	L308 D309 D389	K248-L308 WeakPolarHBondContact CA-O 3.35Å; K248-D309 VanDerWaalsContact CE-CG 3.48Å; K248-D309 WeakPolarHBondContact CE-OD2 3.2Å; K248-D309 HydrophobicContact CG-CB 4.42Å; K248-D309 IonicContact NZ-OD2 3Å; K248-D309 PolarHBondContact NZ-OD2 3.19Å; K248-D389 IonicContact NZ-OD2 2.97Å
249	E	90.8	Very high	95.3	Very high	44 Å²	44	52.3 Å²	52.3	21%	0.206	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	158.2	-173.9	-176.7	58	-80.3	0	0	111.5	H219 Q247 H251 L308	H219-E249 HydrophobicContact CB-CG 3.65Å; H219-E249 IonicContact CE1-OE2 3.98Å; H219-E249 IonicContact CG-OE2 3.07Å; H219-E249 IonicContact ND1-OE2 2.78Å; H219-E249 PolarHBondContact ND1-OE2 3.41Å; Q247-E249 HydrophobicContact CG-CB 4.28Å; E249-H251 PolarHBondContact O-N 3.13Å; E249-L308 PolarHBondContact N-O 3.38Å; E249-L308 PolarHBondContact O-N 3.49Å
250	M	91.7	Very high	95.4	Very high	79 Å²	79	50 Å²	50	39%	0.389	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	115.1	173.4	-68.1	-61.5	-58.8	0	0	111	P305 S306 L307	M250-P305 HydrophobicContact CE-CB 3.98Å; M250-S306 WeakPolarHBondContact CA-O 3.47Å; M250-L307 VanDerWaalsContact SD-CA 3.56Å; M250-L307 HydrophobicContact SD-CB 3.71Å; M250-L307 HydrophobicContact SD-CD1 4.26Å; M250-L307 PolarHBondContact SD-N 2.76Å; M250-L307 VanDerWaalsContact SD-N 3.36Å
251	H	94.4	Very high	95.6	Very high	11 Å²	11	47.9 Å²	47.9	5%	0.051	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	171.7	172.4	-65.7	-41.2	0	0	0	110.4	Q247 E249 L264 P305 S306	Q247-H251 PolarHBondContact NE2-NE2 2.81Å; E249-H251 PolarHBondContact O-N 3.13Å; H251-L264 HydrophobicContact CB-CD1 3.63Å; H251-P305 CarbonylContact O-C 3.53Å; H251-P305 WeakPolarHBondContact O-CA 3.41Å; H251-S306 PolarHBondContact N-O 2.87Å; H251-S306 PolarHBondContact O-N 3.49Å
252	R	95.2	Very high	95.7	Very high	105 Å²	105	44 Å²	44	40%	0.396	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	128.7	167.1	-50.7	-172.3	173.3	-158.6	-3.9	109.5	L264 Q265 L303 L304	R252-L264 WeakPolarHBondContact O-CD1 3.38Å; R252-Q265 HydrophobicContact CB-CB 4.16Å; R252-Q265 PolarHBondContact N-O 2.86Å; R252-Q265 PolarHBondContact O-N 3.49Å; R252-L303 HydrophobicContact CB-CB 3.98Å; R252-L303 HydrophobicContact CB-CD2 4.23Å; R252-L304 WeakPolarHBondContact CA-O 3.37Å
253	F	95.1	Very high	95.8	Very high	30 Å²	30	44 Å²	44	13%	0.132	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	147.1	-170.6	173.3	-90.2	0	0	0	110.1	T262 L304 L308 P390 A392	F253-T262 HydrophobicContact CD2-CG2 4.07Å; F253-T262 HydrophobicContact CE2-CG2 3.38Å; F253-T262 HydrophobicContact CZ-CG2 4.14Å; F253-L304 PolarHBondContact N-O 2.85Å; F253-L304 PolarHBondContact O-N 3.44Å; F253-L304 VanDerWaalsContact O-N 3.11Å; F253-L308 HydrophobicContact CD2-CD1 3.52Å; F253-L308 HydrophobicContact CD2-CD2 4.24Å; F253-L308 HydrophobicContact CE2-CD1 3.79Å; F253-L308 HydrophobicContact CG-CD1 4.09Å; F253-P390 HydrophobicContact CD1-CB 4.45Å; F253-P390 HydrophobicContact CE1-CB 4.1Å; F253-P390 HydrophobicContact CZ-CB 4.21Å; F253-A392 HydrophobicContact CE2-CB 4.46Å
254	L	95.8	Very high	95.9	Very high	25 Å²	25	42.1 Å²	42.1	13%	0.131	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	136.2	174.8	169.4	67.2	0	0	0	108.3	V263 W299 L302 L303	L254-V263 HydrophobicContact CB-CB 4.29Å; L254-V263 PolarHBondContact N-O 2.84Å; L254-V263 PolarHBondContact O-N 3.35Å; L254-W299 HydrophobicContact CD2-CB 4.33Å; L254-W299 HydrophobicContact CD2-CG 4.22Å; L254-L302 HydrophobicContact CD1-CB 3.98Å; L254-L302 HydrophobicContact CD2-CB 3.82Å; L254-L303 HydrophobicContact CB-CD2 3.8Å; L254-L303 HydrophobicContact CB-CG 4.25Å
255	Y	96.8	Very high	95.9	Very high	93 Å²	93	43.2 Å²	43.2	37%	0.365	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	114.1	159.8	-179.1	-100.6	0	0	0	108.5	Q257 D280	Y255-Q257 HydrophobicContact CD1-CG 3.8Å; Y255-Q257 HydrophobicContact CE1-CB 4.42Å; Y255-Q257 HydrophobicContact CE1-CG 3.84Å; Y255-Q257 PolarHBondContact O-N 3.38Å; Y255-D280 PolarHBondContact OH-OD2 3.02Å
256	D	97.4	Very high	95.8	Very high	8 Å²	8	43.3 Å²	43.3	4%	0.043	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	101.9	176.5	-167	-22.6	0	0	0	109.1	E258 L259 A260 C261 K298 W299	D256-E258 PolarHBondContact O-N 3.18Å; D256-E258 WeakPolarHBondContact OD1-CB 3.35Å; D256-E258 PolarHBondContact OD1-N 2.99Å; D256-E258 VanDerWaalsContact OD1-N 3.07Å; D256-L259 HydrophobicContact CB-CB 4.41Å; D256-L259 PolarHBondContact O-N 3.33Å; D256-A260 WeakPolarHBondContact O-CA 3.48Å; D256-A260 PolarHBondContact O-N 2.92Å; D256-C261 PolarHBondContact N-O 3.25Å; D256-C261 PolarHBondContact O-N 2.82Å; D256-K298 IonicContact OD1-NZ 3.9Å; D256-K298 PolarHBondContact OD1-NZ 3.05Å; D256-K298 VanDerWaalsContact OD1-NZ 3.15Å; D256-K298 IonicContact OD2-NZ 3.15Å; D256-K298 PolarHBondContact OD2-NZ 3.32Å; D256-W299 PolarHBondContact OD2-NE1 2.89Å
257	Q	96.8	Very high	95.8	Very high	167 Å²	167	44.7 Å²	44.7	78%	0.78	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-30.9	-179.2	-67.1	-177.2	-14.5	0	0	112.9	Y255	Y255-Q257 HydrophobicContact CD1-CG 3.8Å; Y255-Q257 HydrophobicContact CE1-CB 4.42Å; Y255-Q257 HydrophobicContact CE1-CG 3.84Å; Y255-Q257 PolarHBondContact O-N 3.38Å
258	E	96.6	Very high	95.8	Very high	137 Å²	137	44.4 Å²	44.4	64%	0.64	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-39.7	-178.2	-174.6	-176.6	179.6	0	0	111	D256 Q286 K298	D256-E258 PolarHBondContact O-N 3.18Å; D256-E258 WeakPolarHBondContact OD1-CB 3.35Å; D256-E258 PolarHBondContact OD1-N 2.99Å; D256-E258 VanDerWaalsContact OD1-N 3.07Å; E258-Q286 PolarHBondContact O-NE2 3.11Å; E258-K298 IonicContact OE2-NZ 3.84Å; E258-K298 PolarHBondContact OE2-NZ 3.05Å
259	L	97.6	Very high	95.7	Very high	14 Å²	14	45.7 Å²	45.7	7%	0.073	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-6.8	-179.2	-60.6	-177.3	0	0	0	113.6	D256 V287 A290 T295 W299	D256-L259 HydrophobicContact CB-CB 4.41Å; D256-L259 PolarHBondContact O-N 3.33Å; L259-V287 HydrophobicContact CB-CG2 4.41Å; L259-A290 HydrophobicContact CD1-CB 3.86Å; L259-A290 HydrophobicContact CD2-CB 3.34Å; L259-A290 HydrophobicContact CG-CB 4.26Å; L259-T295 HydrophobicContact CD1-CG2 3.67Å; L259-W299 HydrophobicContact CD1-CZ2 3.67Å
260	A	97.7	Very high	95.5	Very high	12 Å²	12	44.7 Å²	44.7	10%	0.099	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	59.8	-175.3	0	0	0	0	0	111.1	D256 D280 K283	D256-A260 WeakPolarHBondContact O-CA 3.48Å; D256-A260 PolarHBondContact O-N 2.92Å; A260-D280 HydrophobicContact CB-CB 4.28Å; A260-D280 WeakPolarHBondContact O-CB 3.06Å; A260-D280 PolarHBondContact O-N 3.44Å; A260-K283 HydrophobicContact CB-CD 4.42Å; A260-K283 HydrophobicContact CB-CG 3.93Å
261	C	98.1	Very high	95.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	148.1	179.2	67.7	0	0	0	0	112.9	D256 V277 L278 V287	D256-C261 PolarHBondContact N-O 3.25Å; D256-C261 PolarHBondContact O-N 2.82Å; C261-V277 HydrophobicContact CB-CG1 4.11Å; C261-L278 WeakPolarHBondContact CA-O 3.21Å; C261-V287 HydrophobicContact CB-CG2 3.74Å
262	T	98	Very high	95.5	Very high	14 Å²	14	45 Å²	45	9%	0.086	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	131.8	167.1	-68	0	0	0	0	109.8	F253 V277 L278 A392	F253-T262 HydrophobicContact CD2-CG2 4.07Å; F253-T262 HydrophobicContact CE2-CG2 3.38Å; F253-T262 HydrophobicContact CZ-CG2 4.14Å; T262-V277 CarbonylContact O-C 3.56Å; T262-V277 WeakPolarHBondContact O-CA 3.3Å; T262-L278 PolarHBondContact N-O 3.23Å; T262-L278 PolarHBondContact O-N 2.9Å; T262-A392 HydrophobicContact CG2-CB 4.29Å
263	V	98.3	Very high	95.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124.7	176.7	-174.5	0	0	0	0	108.6	L254 L275 L276 V277 W299 L303	L254-V263 HydrophobicContact CB-CB 4.29Å; L254-V263 PolarHBondContact N-O 2.84Å; L254-V263 PolarHBondContact O-N 3.35Å; V263-L275 HydrophobicContact CG1-CD1 3.58Å; V263-L275 HydrophobicContact CG1-CD2 4.47Å; V263-L275 HydrophobicContact CG1-CG 4.09Å; V263-L276 WeakPolarHBondContact CA-O 3.44Å; V263-V277 HydrophobicContact CG1-CG2 4.46Å; V263-V277 HydrophobicContact CG2-CG1 4.3Å; V263-W299 HydrophobicContact CG1-CB 4.28Å; V263-W299 HydrophobicContact CG1-CD2 4.2Å; V263-W299 HydrophobicContact CG1-CE3 4.3Å; V263-W299 HydrophobicContact CG1-CG 4.22Å; V263-W299 HydrophobicContact CG2-CD2 3.87Å; V263-W299 HydrophobicContact CG2-CE3 4.41Å; V263-W299 HydrophobicContact CG2-CG 4.13Å; V263-W299 HydrophobicContact CG2-CZ2 4.07Å; V263-L303 HydrophobicContact CG1-CD2 4.3Å
264	L	97.9	Very high	95.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	127.1	-174.9	173.9	59.9	0	0	0	110.3	H251 R252 I266 L275 L276 L308 L310 F394	H251-L264 HydrophobicContact CB-CD1 3.63Å; R252-L264 WeakPolarHBondContact O-CD1 3.38Å; L264-I266 HydrophobicContact CD1-CG1 4.35Å; L264-I266 HydrophobicContact CD2-CD1 3.92Å; L264-I266 HydrophobicContact CD2-CG1 4.05Å; L264-I266 HydrophobicContact CG-CD1 4.28Å; L264-I266 HydrophobicContact CG-CG1 3.86Å; L264-L275 CarbonylContact O-C 3.54Å; L264-L275 WeakPolarHBondContact O-CA 3.33Å; L264-L276 HydrophobicContact CB-CB 4.36Å; L264-L276 HydrophobicContact CD2-CD1 4.32Å; L264-L276 PolarHBondContact N-O 3.22Å; L264-L276 PolarHBondContact O-N 2.8Å; L264-L308 HydrophobicContact CD1-CD2 3.42Å; L264-L308 VanDerWaalsContact CD1-CD2 3.42Å; L264-L308 HydrophobicContact CD2-CD2 3.79Å; L264-L308 HydrophobicContact CG-CD2 4.22Å; L264-L310 HydrophobicContact CD2-CD1 3.45Å; L264-L310 VanDerWaalsContact CD2-CD1 3.45Å; L264-L310 HydrophobicContact CD2-CD2 3.9Å; L264-L310 HydrophobicContact CD2-CG 4.3Å; L264-F394 HydrophobicContact CB-CZ 4.19Å; L264-F394 HydrophobicContact CD2-CE2 3.75Å; L264-F394 HydrophobicContact CD2-CZ 4.12Å
265	Q	97.5	Very high	95.7	Very high	23 Å²	23	39.3 Å²	39.3	11%	0.107	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	121.6	172.2	-175.4	-171.4	-61.8	0	0	110.5	R252 L273 A274 L275 L303	R252-Q265 HydrophobicContact CB-CB 4.16Å; R252-Q265 PolarHBondContact N-O 2.86Å; R252-Q265 PolarHBondContact O-N 3.49Å; Q265-L273 HydrophobicContact CG-CB 4.35Å; Q265-L273 HydrophobicContact CG-CD1 4.22Å; Q265-L273 HydrophobicContact CG-CD2 4.29Å; Q265-A274 CarbonylContact C-O 3.33Å; Q265-A274 WeakPolarHBondContact CA-O 3.33Å; Q265-L275 HydrophobicContact CB-CD1 4.15Å; Q265-L303 HydrophobicContact CB-CD1 3.97Å; Q265-L303 HydrophobicContact CB-CD2 4.5Å
266	I	95.9	Very high	95.8	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.01	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130.1	177.3	-48.5	-179.1	0	0	0	109.1	W217 L264 L273 A274 L276 L310 L312	W217-I266 HydrophobicContact CD2-CG2 4.28Å; W217-I266 HydrophobicContact CE3-CB 4.39Å; W217-I266 HydrophobicContact CE3-CG2 3.52Å; W217-I266 HydrophobicContact CH2-CG2 4.39Å; W217-I266 HydrophobicContact CZ3-CB 3.97Å; W217-I266 HydrophobicContact CZ3-CG2 3.59Å; L264-I266 HydrophobicContact CD1-CG1 4.35Å; L264-I266 HydrophobicContact CD2-CD1 3.92Å; L264-I266 HydrophobicContact CD2-CG1 4.05Å; L264-I266 HydrophobicContact CG-CD1 4.28Å; L264-I266 HydrophobicContact CG-CG1 3.86Å; I266-L273 CarbonylContact O-C 3.55Å; I266-L273 WeakPolarHBondContact O-CA 3.49Å; I266-A274 PolarHBondContact N-O 3.22Å; I266-A274 PolarHBondContact O-N 3.25Å; I266-L276 HydrophobicContact CD1-CD1 3.8Å; I266-L310 HydrophobicContact CD1-CD2 3.83Å; I266-L312 HydrophobicContact CD1-CD2 4.49Å
267	E	95.2	Very high	95.8	Very high	68 Å²	68	34.5 Å²	34.5	32%	0.318	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	144.1	-178.8	-63.6	179.7	165.2	0	0	112	K218	K218-E267 HydrophobicContact CB-CB 4.02Å; K218-E267 VanDerWaalsContact CB-O 3.26Å; K218-E267 WeakPolarHBondContact CB-O 3.09Å; K218-E267 HydrophobicContact CD-CB 3.91Å; K218-E267 WeakPolarHBondContact CD-OE2 3.31Å; K218-E267 WeakPolarHBondContact CE-OE2 3.42Å; K218-E267 PolarHBondContact N-O 2.91Å; K218-E267 IonicContact NZ-OE2 3.58Å; K218-E267 PolarHBondContact NZ-OE2 3.23Å
268	Y	94.1	Very high	95.9	Very high	5 Å²	5	26.7 Å²	26.7	2%	0.02	13%	0.134	C	C	.	.	B	Isolated β-bridge	trans	-91.8	161.4	166.8	-70.8	-90.6	0	0	0	111.3	F213 A215 K216 W217 G270 A272 A274 T369 L402	F213-Y268 HydrophobicContact CE1-CE1 4.09Å; F213-Y268 HydrophobicContact CE1-CE2 4.28Å; F213-Y268 AromaticContact CE1-CZ 3.89Å; F213-Y268 HydrophobicContact CZ-CD1 4.4Å; F213-Y268 HydrophobicContact CZ-CD2 4.16Å; F213-Y268 HydrophobicContact CZ-CE1 4.26Å; F213-Y268 AromaticContact CZ-CE2 3.99Å; F213-Y268 HydrophobicContact CZ-CE2 3.99Å; F213-Y268 HydrophobicContact CZ-CG 4.36Å; A215-Y268 HydrophobicContact CB-CD1 3.45Å; A215-Y268 VanDerWaalsContact CB-CD1 3.45Å; A215-Y268 HydrophobicContact CB-CE1 4.15Å; A215-Y268 HydrophobicContact CB-CG 3.85Å; K216-Y268 CarbonylContact O-C 3.54Å; K216-Y268 VanDerWaalsContact O-CA 3.29Å; K216-Y268 WeakPolarHBondContact O-CA 3.31Å; K216-Y268 WeakPolarHBondContact O-CB 3.36Å; K216-Y268 WeakPolarHBondContact O-CD1 3.35Å; W217-Y268 HydrophobicContact CD2-CD1 4.43Å; W217-Y268 HydrophobicContact CD2-CE1 4.07Å; W217-Y268 AromaticContact CE3-CD1 3.84Å; W217-Y268 HydrophobicContact CE3-CD1 3.84Å; W217-Y268 HydrophobicContact CE3-CD2 4.3Å; W217-Y268 AromaticContact CE3-CE1 3.59Å; W217-Y268 HydrophobicContact CE3-CE1 3.59Å; W217-Y268 HydrophobicContact CE3-CE2 4.08Å; W217-Y268 HydrophobicContact CE3-CG 4.2Å; W217-Y268 AromaticContact CE3-CZ 3.73Å; W217-Y268 HydrophobicContact CH2-CE1 4.03Å; W217-Y268 HydrophobicContact CH2-CE2 4.1Å; W217-Y268 AromaticContact CH2-CZ 3.52Å; W217-Y268 WeakPolarHBondContact CH2-OH 3.22Å; W217-Y268 HydrophobicContact CZ2-CE1 4.46Å; W217-Y268 HydrophobicContact CZ3-CD1 4.16Å; W217-Y268 HydrophobicContact CZ3-CD2 4.04Å; W217-Y268 AromaticContact CZ3-CE1 3.58Å; W217-Y268 HydrophobicContact CZ3-CE1 3.58Å; W217-Y268 AromaticContact CZ3-CE2 3.44Å; W217-Y268 HydrophobicContact CZ3-CE2 3.44Å; W217-Y268 VanDerWaalsContact CZ3-CE2 3.44Å; W217-Y268 HydrophobicContact CZ3-CG 4.37Å; W217-Y268 AromaticContact CZ3-CZ 3.18Å; W217-Y268 WeakPolarHBondContact CZ3-OH 2.86Å; Y268-G270 PolarHBondContact O-N 3.21Å; Y268-A272 HydrophobicContact CD2-CB 4.08Å; Y268-A272 HydrophobicContact CG-CB 4.42Å; Y268-A272 PolarHBondContact N-O 3.37Å; Y268-A274 HydrophobicContact CE2-CB 4.09Å; Y268-T369 HydrophobicContact CE1-CG2 4.04Å; Y268-L402 HydrophobicContact CE2-CD2 3.69Å
269	R	88.2	Confident	96	Very high	122 Å²	122	20.3 Å²	20.3	46%	0.46	10%	0.104	S	C	.	.	S	Bend	trans	-68.7	99	161.3	-65.3	-177	-178.4	-163.8	-2.5	105.6	K132 K216 W217 K218	K132-R269 CarbonylContact C-O 3.47Å; K132-R269 VanDerWaalsContact C-O 3.26Å; K132-R269 HydrophobicContact CB-CB 4.3Å; K132-R269 WeakPolarHBondContact CB-O 3.23Å; K216-R269 PolarHBondContact O-N 2.9Å; W217-R269 WeakPolarHBondContact O-CG 3.4Å; W217-R269 PolarHBondContact O-NE 3.34Å; K218-R269 PolarHBondContact O-NE 2.64Å
270	G	88	Confident	95.9	Very high	24 Å²	24	21.8 Å²	21.8	25%	0.247	11%	0.112	C	C	.	.	S	Bend	trans	131.5	-178.3	-174.6	0	0	0	0	0	110.8	Y268 A272	Y268-G270 PolarHBondContact O-N 3.21Å; G270-A272 PolarHBondContact O-N 2.8Å
271	N	91.1	Very high	95.7	Very high	92 Å²	92	26.2 Å²	26.2	49%	0.492	14%	0.14	S	C	.	.	S	Bend	trans	-85.9	52.1	-176.7	-63.4	-14.7	0	0	0	110.8	E404 V405 T406	N271-E404 VanDerWaalsContact CB-OE1 3.25Å; N271-E404 WeakPolarHBondContact CB-OE1 3.39Å; N271-E404 CarbonylContact O-C 3.34Å; N271-E404 WeakPolarHBondContact O-CA 3.44Å; N271-E404 WeakPolarHBondContact O-CG 3.11Å; N271-V405 HydrophobicContact CB-CB 4.29Å; N271-V405 PolarHBondContact O-N 3.33Å; N271-T406 WeakPolarHBondContact CB-OG1 3.34Å; N271-T406 PolarHBondContact ND2-OG1 3.14Å
272	A	94.3	Very high	95.5	Very high	3 Å²	3	30.1 Å²	30.1	3%	0.025	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	150.2	177.4	0	0	0	0	0	111.9	L133 F213 Y268 G270 W403	L133-A272 HydrophobicContact CD1-CB 4.35Å; L133-A272 HydrophobicContact CD2-CB 4.11Å; F213-A272 HydrophobicContact CE2-CB 3.79Å; F213-A272 HydrophobicContact CZ-CB 3.99Å; Y268-A272 HydrophobicContact CD2-CB 4.08Å; Y268-A272 HydrophobicContact CG-CB 4.42Å; Y268-A272 PolarHBondContact N-O 3.37Å; G270-A272 PolarHBondContact O-N 2.8Å; A272-W403 CarbonylContact C-O 3.56Å; A272-W403 WeakPolarHBondContact CA-O 3.08Å
273	L	95.4	Very high	95.4	Very high	29 Å²	29	33.1 Å²	33.1	15%	0.152	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	152.3	173.9	62.2	82.3	0	0	0	111.2	Q265 I266 L402 W403 V405	Q265-L273 HydrophobicContact CG-CB 4.35Å; Q265-L273 HydrophobicContact CG-CD1 4.22Å; Q265-L273 HydrophobicContact CG-CD2 4.29Å; I266-L273 CarbonylContact O-C 3.55Å; I266-L273 WeakPolarHBondContact O-CA 3.49Å; L273-L402 WeakPolarHBondContact O-CA 3.43Å; L273-W403 HydrophobicContact CD1-CB 3.76Å; L273-W403 HydrophobicContact CD1-CG 3.98Å; L273-W403 HydrophobicContact CG-CB 4.01Å; L273-W403 PolarHBondContact N-O 3.44Å; L273-W403 PolarHBondContact O-N 3.2Å; L273-V405 HydrophobicContact CD2-CG2 3.87Å; L273-V405 HydrophobicContact CG-CG2 4.16Å
274	A	96.9	Very high	95.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133.3	166.3	0	0	0	0	0	109.1	W217 Q265 I266 Y268 L400 L401 L402	W217-A274 HydrophobicContact CH2-CB 4.2Å; W217-A274 HydrophobicContact CZ3-CB 4.13Å; Q265-A274 CarbonylContact C-O 3.33Å; Q265-A274 WeakPolarHBondContact CA-O 3.33Å; I266-A274 PolarHBondContact N-O 3.22Å; I266-A274 PolarHBondContact O-N 3.25Å; Y268-A274 HydrophobicContact CE2-CB 4.09Å; A274-L400 HydrophobicContact CB-CD1 4.36Å; A274-L401 CarbonylContact C-O 3.58Å; A274-L401 WeakPolarHBondContact CA-O 3.48Å; A274-L402 HydrophobicContact CB-CD2 3.65Å
275	L	97.9	Very high	95.1	Very high	12 Å²	12	43 Å²	43	6%	0.063	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	115.2	166.2	-171.7	76	0	0	0	107.4	V263 L264 Q265 L296 W299 L303 L401	V263-L275 HydrophobicContact CG1-CD1 3.58Å; V263-L275 HydrophobicContact CG1-CD2 4.47Å; V263-L275 HydrophobicContact CG1-CG 4.09Å; L264-L275 CarbonylContact O-C 3.54Å; L264-L275 WeakPolarHBondContact O-CA 3.33Å; Q265-L275 HydrophobicContact CB-CD1 4.15Å; L275-L296 HydrophobicContact CD2-CD2 4.34Å; L275-W299 HydrophobicContact CD2-CE3 4.11Å; L275-L303 HydrophobicContact CD1-CD1 3.89Å; L275-L401 HydrophobicContact CB-CB 4.21Å; L275-L401 HydrophobicContact CD2-CD1 4.5Å; L275-L401 PolarHBondContact N-O 2.86Å; L275-L401 PolarHBondContact O-N 2.89Å
276	L	98.3	Very high	95	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	130.4	177.9	-56.6	177.2	0	0	0	108.7	V263 L264 I266 L312 F394 F398 L399 L400	V263-L276 WeakPolarHBondContact CA-O 3.44Å; L264-L276 HydrophobicContact CB-CB 4.36Å; L264-L276 HydrophobicContact CD2-CD1 4.32Å; L264-L276 PolarHBondContact N-O 3.22Å; L264-L276 PolarHBondContact O-N 2.8Å; I266-L276 HydrophobicContact CD1-CD1 3.8Å; L276-L312 HydrophobicContact CD1-CD1 3.53Å; L276-L312 HydrophobicContact CD1-CD2 4.14Å; L276-F394 HydrophobicContact CB-CE1 3.48Å; L276-F394 VanDerWaalsContact CB-CE1 3.48Å; L276-F394 HydrophobicContact CB-CZ 3.52Å; L276-F394 HydrophobicContact CD1-CE1 4.18Å; L276-F394 HydrophobicContact CD1-CE2 4.33Å; L276-F394 HydrophobicContact CD1-CZ 4.01Å; L276-F394 HydrophobicContact CG-CE1 4.41Å; L276-F394 HydrophobicContact CG-CZ 4.43Å; L276-F398 HydrophobicContact CD2-CD2 4.37Å; L276-F398 HydrophobicContact CD2-CE2 4.13Å; L276-L399 WeakPolarHBondContact CA-O 3.27Å; L276-L400 HydrophobicContact CD2-CB 4.36Å; L276-L400 HydrophobicContact CD2-CD1 3.46Å; L276-L400 VanDerWaalsContact CD2-CD1 3.46Å; L276-L400 HydrophobicContact CD2-CG 4.5Å
277	V	98.6	Very high	95.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	116.7	178.2	-172.6	0	0	0	0	108.3	C261 T262 V263 P279 V287 W299 F398 L399 L401	C261-V277 HydrophobicContact CB-CG1 4.11Å; T262-V277 CarbonylContact O-C 3.56Å; T262-V277 WeakPolarHBondContact O-CA 3.3Å; V263-V277 HydrophobicContact CG1-CG2 4.46Å; V263-V277 HydrophobicContact CG2-CG1 4.3Å; V277-P279 WeakPolarHBondContact O-CD 3.24Å; V277-V287 HydrophobicContact CG1-CG1 3.77Å; V277-W299 HydrophobicContact CG1-CH2 3.91Å; V277-W299 HydrophobicContact CG1-CZ2 4.38Å; V277-W299 HydrophobicContact CG1-CZ3 4.48Å; V277-W299 HydrophobicContact CG2-CE3 4.32Å; V277-W299 HydrophobicContact CG2-CH2 3.92Å; V277-W299 HydrophobicContact CG2-CZ3 3.63Å; V277-F398 CarbonylContact O-C 3.57Å; V277-F398 WeakPolarHBondContact O-CA 3.37Å; V277-F398 VanDerWaalsContact O-CB 3.3Å; V277-F398 WeakPolarHBondContact O-CB 3.33Å; V277-L399 HydrophobicContact CB-CB 4.07Å; V277-L399 HydrophobicContact CB-CD1 4.46Å; V277-L399 HydrophobicContact CB-CG 4.45Å; V277-L399 PolarHBondContact N-O 3.36Å; V277-L399 PolarHBondContact O-N 3.37Å; V277-L401 HydrophobicContact CG2-CD1 4.33Å
278	L	98.3	Very high	95.2	Very high	3 Å²	3	43.1 Å²	43.1	2%	0.016	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	98.1	-179.5	179.2	67	0	0	0	109	C261 T262 H393 F394 R396 F398	C261-L278 WeakPolarHBondContact CA-O 3.21Å; T262-L278 PolarHBondContact N-O 3.23Å; T262-L278 PolarHBondContact O-N 2.9Å; L278-H393 VanDerWaalsContact CD2-O 3.27Å; L278-H393 WeakPolarHBondContact CD2-O 3.31Å; L278-F394 HydrophobicContact CB-CD1 3.96Å; L278-F394 HydrophobicContact CB-CE1 3.55Å; L278-F394 HydrophobicContact CB-CZ 3.99Å; L278-F394 HydrophobicContact CD1-CD1 4.07Å; L278-F394 HydrophobicContact CD2-CD1 4.35Å; L278-F394 HydrophobicContact CD2-CD2 4.47Å; L278-F394 HydrophobicContact CD2-CE1 4.48Å; L278-F394 HydrophobicContact CD2-CG 4.34Å; L278-F394 HydrophobicContact CG-CD1 4.35Å; L278-F394 HydrophobicContact CG-CE1 4.39Å; L278-R396 HydrophobicContact CD1-CG 3.66Å; L278-F398 HydrophobicContact CD1-CB 4.06Å
279	P	97.6	Very high	95.2	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.019	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	148.4	175.1	-18.7	32.1	0	0	0	111.3	V277 K283 M284 V287 R396	V277-P279 WeakPolarHBondContact O-CD 3.24Å; P279-K283 HydrophobicContact CB-CB 4.13Å; P279-M284 HydrophobicContact CG-CB 4.39Å; P279-M284 HydrophobicContact CG-CE 3.84Å; P279-M284 HydrophobicContact CG-SD 3.8Å; P279-V287 HydrophobicContact CB-CG2 3.83Å; P279-V287 HydrophobicContact CG-CB 4.17Å; P279-V287 HydrophobicContact CG-CG1 4.43Å; P279-V287 HydrophobicContact CG-CG2 3.95Å; P279-R396 PolarHBondContact O-NE 3.24Å; P279-R396 PolarHBondContact O-NH2 3.42Å
280	D	96.4	Very high	95.6	Very high	46 Å²	46	41.1 Å²	41.1	25%	0.246	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-61.2	162.2	166.9	-76.9	2.5	0	0	0	111.5	Y255 A260 G282 K283 R396	Y255-D280 PolarHBondContact OH-OD2 3.02Å; A260-D280 HydrophobicContact CB-CB 4.28Å; A260-D280 WeakPolarHBondContact O-CB 3.06Å; A260-D280 PolarHBondContact O-N 3.44Å; D280-G282 PolarHBondContact O-N 3.35Å; D280-K283 HydrophobicContact CB-CB 4.24Å; D280-K283 HydrophobicContact CB-CG 3.78Å; D280-K283 VanDerWaalsContact O-CB 3.3Å; D280-K283 WeakPolarHBondContact O-CB 3.42Å; D280-K283 PolarHBondContact O-N 3.07Å; D280-R396 IonicContact OD1-NH2 2.58Å
281	P	94.4	Very high	96	Very high	104 Å²	104	40 Å²	40	68%	0.675	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.9	126.5	176.8	-28.5	36.4	0	0	0	112.3	K283	P281-K283 VanDerWaalsContact C-N 3.27Å; P281-K283 PolarHBondContact O-N 3.32Å
282	G	92.8	Very high	96.3	Very high	82 Å²	82	40 Å²	40	85%	0.845	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.2	3.6	-177.9	0	0	0	0	0	115.9	D280	D280-G282 PolarHBondContact O-N 3.35Å
283	K	96.4	Very high	96.3	Very high	78 Å²	78	42.1 Å²	42.1	34%	0.339	25%	0.246	S	C	.	.			trans	-100.1	-1	-174.6	-60.3	-55.8	-159.2	163.8	0	115.9	A260 P279 D280 P281 K285 Q286 V287	A260-K283 HydrophobicContact CB-CD 4.42Å; A260-K283 HydrophobicContact CB-CG 3.93Å; P279-K283 HydrophobicContact CB-CB 4.13Å; D280-K283 HydrophobicContact CB-CB 4.24Å; D280-K283 HydrophobicContact CB-CG 3.78Å; D280-K283 VanDerWaalsContact O-CB 3.3Å; D280-K283 WeakPolarHBondContact O-CB 3.42Å; D280-K283 PolarHBondContact O-N 3.07Å; P281-K283 VanDerWaalsContact C-N 3.27Å; P281-K283 PolarHBondContact O-N 3.32Å; K283-K285 PolarHBondContact O-N 2.89Å; K283-Q286 WeakPolarHBondContact O-CB 3.27Å; K283-Q286 PolarHBondContact O-N 3.15Å; K283-V287 PolarHBondContact O-N 2.9Å; K283-V287 VanDerWaalsContact O-N 3.08Å
284	M	95.5	Very high	96.4	Very high	34 Å²	34	45.9 Å²	45.9	17%	0.167	26%	0.263	C	S	.	.	H	α-helix	trans	-49.9	-54.4	-179.7	-179.2	60.7	78.1	0	0	112.6	P279 Q286 V287 E288 P397 L399 K415	P279-M284 HydrophobicContact CG-CB 4.39Å; P279-M284 HydrophobicContact CG-CE 3.84Å; P279-M284 HydrophobicContact CG-SD 3.8Å; M284-Q286 VanDerWaalsContact C-N 3.26Å; M284-Q286 PolarHBondContact O-N 2.89Å; M284-V287 PolarHBondContact O-N 3.06Å; M284-V287 VanDerWaalsContact O-N 3.07Å; M284-E288 HydrophobicContact CG-CG 4.22Å; M284-E288 WeakPolarHBondContact O-CG 3.15Å; M284-E288 PolarHBondContact O-N 3.44Å; M284-E288 HydrophobicContact SD-CG 3.94Å; M284-P397 VanDerWaalsContact CE-C 3.42Å; M284-P397 HydrophobicContact CE-CB 3.6Å; M284-P397 VanDerWaalsContact CE-O 3.27Å; M284-P397 WeakPolarHBondContact CE-O 3.35Å; M284-L399 HydrophobicContact CE-CD2 4.43Å; M284-L399 HydrophobicContact SD-CD2 3.9Å; M284-L399 HydrophobicContact SD-CG 4.34Å; M284-K415 HydrophobicContact CE-CG 4.45Å; M284-K415 HydrophobicContact SD-CD 4.5Å
285	K	94.4	Very high	96.4	Very high	174 Å²	174	46.9 Å²	46.9	76%	0.757	27%	0.269	S	S	*	.	H	α-helix	trans	-59.5	-34.6	-179.5	-66.5	-171.9	176.7	-173.3	0	113.5	K283 A289	K283-K285 PolarHBondContact O-N 2.89Å; K285-A289 VanDerWaalsContact O-CB 3.31Å; K285-A289 WeakPolarHBondContact O-CB 3.39Å; K285-A289 PolarHBondContact O-N 2.75Å
286	Q	96.1	Very high	96.4	Very high	72 Å²	72	47.2 Å²	47.2	34%	0.336	27%	0.27	S	S	.	.	H	α-helix	trans	-66	-45.5	176.8	178.3	-179.5	-21.2	0	0	110.6	E258 K283 M284 A290	E258-Q286 PolarHBondContact O-NE2 3.11Å; K283-Q286 WeakPolarHBondContact O-CB 3.27Å; K283-Q286 PolarHBondContact O-N 3.15Å; M284-Q286 VanDerWaalsContact C-N 3.26Å; M284-Q286 PolarHBondContact O-N 2.89Å; Q286-A290 WeakPolarHBondContact O-CB 3.28Å; Q286-A290 PolarHBondContact O-N 2.82Å; Q286-A290 VanDerWaalsContact O-N 3.16Å
287	V	97.6	Very high	96.3	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.5	-45	177.2	176.4	0	0	0	0	111	L259 C261 V277 P279 K283 M284 A289 A290 L291 W299 L399	L259-V287 HydrophobicContact CB-CG2 4.41Å; C261-V287 HydrophobicContact CB-CG2 3.74Å; V277-V287 HydrophobicContact CG1-CG1 3.77Å; P279-V287 HydrophobicContact CB-CG2 3.83Å; P279-V287 HydrophobicContact CG-CB 4.17Å; P279-V287 HydrophobicContact CG-CG1 4.43Å; P279-V287 HydrophobicContact CG-CG2 3.95Å; K283-V287 PolarHBondContact O-N 2.9Å; K283-V287 VanDerWaalsContact O-N 3.08Å; M284-V287 PolarHBondContact O-N 3.06Å; M284-V287 VanDerWaalsContact O-N 3.07Å; V287-A289 PolarHBondContact O-N 2.86Å; V287-A290 CarbonylContact O-C 3.4Å; V287-A290 PolarHBondContact O-N 3.18Å; V287-L291 PolarHBondContact O-N 3.19Å; V287-W299 HydrophobicContact CG1-CH2 4.32Å; V287-L399 HydrophobicContact CG1-CD1 3.98Å
288	E	96.4	Very high	96.2	Very high	22 Å²	22	57.7 Å²	57.7	10%	0.103	31%	0.312	C	S	.	.	H	α-helix	trans	-62.6	-42.6	178.9	-68.5	177.7	132	0	0	112.3	Y62 K63 M284 A290 L291 K415	Y62-E288 HydrophobicContact CE1-CB 4.33Å; Y62-E288 HydrophobicContact CE1-CG 3.93Å; Y62-E288 PolarHBondContact OH-OE1 2.7Å; K63-E288 WeakPolarHBondContact CE-O 3.44Å; M284-E288 HydrophobicContact CG-CG 4.22Å; M284-E288 WeakPolarHBondContact O-CG 3.15Å; M284-E288 PolarHBondContact O-N 3.44Å; M284-E288 HydrophobicContact SD-CG 3.94Å; E288-A290 VanDerWaalsContact C-N 3.31Å; E288-A290 PolarHBondContact O-N 2.98Å; E288-L291 WeakPolarHBondContact O-CB 3.42Å; E288-L291 PolarHBondContact O-N 2.86Å; E288-K415 WeakPolarHBondContact OE1-CD 3.19Å; E288-K415 IonicContact OE1-NZ 3.31Å
289	A	95.3	Very high	96.2	Very high	63 Å²	63	57.6 Å²	57.6	52%	0.521	31%	0.311	S	S	.	.	H	α-helix	trans	-61.7	-41.1	176.5	0	0	0	0	0	111.9	K63 K285 V287 L291	K63-A289 PolarHBondContact NZ-O 3.02Å; K285-A289 VanDerWaalsContact O-CB 3.31Å; K285-A289 WeakPolarHBondContact O-CB 3.39Å; K285-A289 PolarHBondContact O-N 2.75Å; V287-A289 PolarHBondContact O-N 2.86Å; A289-L291 VanDerWaalsContact C-N 3.29Å; A289-L291 PolarHBondContact O-N 2.99Å
290	A	96.6	Very high	96	Very high	22 Å²	22	59.4 Å²	59.4	18%	0.182	33%	0.331	C	S	.	.	H	α-helix	trans	-78.8	-6.2	178.8	0	0	0	0	0	114.1	L259 Q286 V287 E288 Q292 T295	L259-A290 HydrophobicContact CD1-CB 3.86Å; L259-A290 HydrophobicContact CD2-CB 3.34Å; L259-A290 HydrophobicContact CG-CB 4.26Å; Q286-A290 WeakPolarHBondContact O-CB 3.28Å; Q286-A290 PolarHBondContact O-N 2.82Å; Q286-A290 VanDerWaalsContact O-N 3.16Å; V287-A290 CarbonylContact O-C 3.4Å; V287-A290 PolarHBondContact O-N 3.18Å; E288-A290 VanDerWaalsContact C-N 3.31Å; E288-A290 PolarHBondContact O-N 2.98Å; A290-Q292 PolarHBondContact O-N 3.45Å; A290-T295 WeakPolarHBondContact O-CB 3.47Å; A290-T295 PolarHBondContact O-OG1 3.43Å
291	L	95.9	Very high	96	Very high	1 Å²	1	63.9 Å²	63.9	1%	0.005	35%	0.35	C	S	.	.			trans	-70	97.1	-179.7	-161.6	70.2	0	0	0	110.1	L59 Y62 K63 V287 E288 A289 L296 W299 L399 L413	L59-L291 HydrophobicContact CD2-CD2 3.67Å; L59-L291 HydrophobicContact CD2-CG 3.69Å; Y62-L291 HydrophobicContact CD1-CD2 4.18Å; Y62-L291 HydrophobicContact CE1-CD2 4.39Å; K63-L291 WeakPolarHBondContact CE-O 3.42Å; K63-L291 PolarHBondContact NZ-O 3.14Å; V287-L291 PolarHBondContact O-N 3.19Å; E288-L291 WeakPolarHBondContact O-CB 3.42Å; E288-L291 PolarHBondContact O-N 2.86Å; A289-L291 VanDerWaalsContact C-N 3.29Å; A289-L291 PolarHBondContact O-N 2.99Å; L291-L296 HydrophobicContact CD1-CD2 4.01Å; L291-W299 HydrophobicContact CD1-CH2 4Å; L291-W299 HydrophobicContact CD1-CZ3 3.84Å; L291-L399 HydrophobicContact CD2-CD1 4.28Å; L291-L413 HydrophobicContact CD2-CD1 4.49Å
292	Q	96.4	Very high	96.1	Very high	93 Å²	93	62.9 Å²	62.9	44%	0.435	34%	0.339	S	S	.	.	S	Bend	trans	-139	159.8	-176.8	-61.8	-171.2	15.6	0	0	109.6	A290 E294 T295 L296	A290-Q292 PolarHBondContact O-N 3.45Å; Q292-E294 PolarHBondContact O-N 3.1Å; Q292-E294 VanDerWaalsContact O-N 3.17Å; Q292-T295 WeakPolarHBondContact O-CB 3.48Å; Q292-T295 PolarHBondContact O-N 3.37Å; Q292-L296 PolarHBondContact O-N 3.03Å; Q292-L296 VanDerWaalsContact O-N 3.1Å
293	P	95.9	Very high	96.2	Very high	47 Å²	47	59.3 Å²	59.3	31%	0.305	30%	0.3	S	S	.	.	H	α-helix	trans	-53.9	-36.2	179.3	-26.7	36.4	0	0	0	113.4	L59 L296 R297	L59-P293 HydrophobicContact CD1-CG 4.05Å; P293-L296 PolarHBondContact O-N 2.98Å; P293-R297 WeakPolarHBondContact O-CB 3.27Å; P293-R297 PolarHBondContact O-N 2.63Å
294	E	96.8	Very high	96.1	Very high	107 Å²	107	61 Å²	61	50%	0.5	31%	0.312	S	S	.	.	H	α-helix	trans	-64.5	-41.3	178.6	-65.4	67.4	-148.5	0	0	111.4	Q292 R297 K298	Q292-E294 PolarHBondContact O-N 3.1Å; Q292-E294 VanDerWaalsContact O-N 3.17Å; E294-R297 PolarHBondContact O-N 2.78Å; E294-K298 WeakPolarHBondContact O-CB 3.12Å; E294-K298 PolarHBondContact O-N 2.7Å
295	T	97.8	Very high	96	Very high	21 Å²	21	63.6 Å²	63.6	13%	0.129	33%	0.332	C	S	.	.	H	α-helix	trans	-64.5	-45.8	176	-54.1	0	0	0	0	111	L259 A290 Q292 R297 K298 W299	L259-T295 HydrophobicContact CD1-CG2 3.67Å; A290-T295 WeakPolarHBondContact O-CB 3.47Å; A290-T295 PolarHBondContact O-OG1 3.43Å; Q292-T295 WeakPolarHBondContact O-CB 3.48Å; Q292-T295 PolarHBondContact O-N 3.37Å; T295-R297 VanDerWaalsContact C-N 3.31Å; T295-R297 PolarHBondContact O-N 3.11Å; T295-K298 WeakPolarHBondContact O-CB 3.07Å; T295-K298 PolarHBondContact O-N 2.99Å; T295-W299 HydrophobicContact CG2-CD2 4.03Å; T295-W299 HydrophobicContact CG2-CE3 4.33Å; T295-W299 HydrophobicContact CG2-CH2 3.89Å; T295-W299 HydrophobicContact CG2-CZ2 3.55Å; T295-W299 HydrophobicContact CG2-CZ3 4.26Å; T295-W299 PolarHBondContact O-N 3.19Å
296	L	96.9	Very high	95.8	Very high	19 Å²	19	56.7 Å²	56.7	10%	0.099	31%	0.305	C	S	.	.	H	α-helix	trans	-61.6	-41.2	176.1	-63.2	177.3	0	0	0	111.7	T55 L59 L275 L291 Q292 P293 W299 G300 L401 W403	T55-L296 HydrophobicContact CG2-CD1 4.1Å; L59-L296 HydrophobicContact CD1-CD1 3.96Å; L59-L296 HydrophobicContact CD2-CD1 4.33Å; L275-L296 HydrophobicContact CD2-CD2 4.34Å; L291-L296 HydrophobicContact CD1-CD2 4.01Å; Q292-L296 PolarHBondContact O-N 3.03Å; Q292-L296 VanDerWaalsContact O-N 3.1Å; P293-L296 PolarHBondContact O-N 2.98Å; L296-W299 HydrophobicContact CD2-CE3 3.89Å; L296-W299 HydrophobicContact CD2-CZ3 3.88Å; L296-W299 PolarHBondContact O-N 3.49Å; L296-G300 PolarHBondContact O-N 3.14Å; L296-L401 HydrophobicContact CD1-CD2 4.4Å; L296-L401 HydrophobicContact CD2-CD2 3.86Å; L296-W403 HydrophobicContact CD1-CZ2 4.07Å
297	R	96	Very high	95.6	Very high	164 Å²	164	56 Å²	56	62%	0.619	30%	0.303	S	S	*	.	H	α-helix	trans	-64.2	-44.5	175	-174.6	-178.3	66.4	150	-0.2	111.7	P293 E294 T295 G300 Q301	P293-R297 WeakPolarHBondContact O-CB 3.27Å; P293-R297 PolarHBondContact O-N 2.63Å; E294-R297 PolarHBondContact O-N 2.78Å; T295-R297 VanDerWaalsContact C-N 3.31Å; T295-R297 PolarHBondContact O-N 3.11Å; R297-G300 PolarHBondContact O-N 3.34Å; R297-Q301 WeakPolarHBondContact O-CG 3.45Å; R297-Q301 PolarHBondContact O-N 3.41Å; R297-Q301 VanDerWaalsContact O-N 3.12Å
298	K	97.2	Very high	95.3	Very high	56 Å²	56	56 Å²	56	24%	0.243	30%	0.303	C	S	.	.	H	α-helix	trans	-56.3	-52	175.3	176.6	-168.7	174.1	-160.3	0	110	D256 E258 E294 T295 G300 Q301 L302	D256-K298 IonicContact OD1-NZ 3.9Å; D256-K298 PolarHBondContact OD1-NZ 3.05Å; D256-K298 VanDerWaalsContact OD1-NZ 3.15Å; D256-K298 IonicContact OD2-NZ 3.15Å; D256-K298 PolarHBondContact OD2-NZ 3.32Å; E258-K298 IonicContact OE2-NZ 3.84Å; E258-K298 PolarHBondContact OE2-NZ 3.05Å; E294-K298 WeakPolarHBondContact O-CB 3.12Å; E294-K298 PolarHBondContact O-N 2.7Å; T295-K298 WeakPolarHBondContact O-CB 3.07Å; T295-K298 PolarHBondContact O-N 2.99Å; K298-G300 PolarHBondContact O-N 3.31Å; K298-Q301 PolarHBondContact O-N 3.06Å; K298-Q301 VanDerWaalsContact O-N 3.14Å; K298-L302 HydrophobicContact CD-CD1 4.4Å; K298-L302 HydrophobicContact CG-CD1 3.67Å; K298-L302 HydrophobicContact CG-CG 4.42Å; K298-L302 WeakPolarHBondContact O-CG 3.22Å; K298-L302 PolarHBondContact O-N 3.01Å
299	W	97.7	Very high	95.3	Very high	1 Å²	1	56.1 Å²	56.1	0%	0.004	31%	0.305	C	S	.	.	H	α-helix	trans	-58.9	-46	177.3	-66.4	-19.8	0	0	0	112.2	L254 D256 L259 V263 L275 V277 V287 L291 T295 L296 Q301 L302 L303	L254-W299 HydrophobicContact CD2-CB 4.33Å; L254-W299 HydrophobicContact CD2-CG 4.22Å; D256-W299 PolarHBondContact OD2-NE1 2.89Å; L259-W299 HydrophobicContact CD1-CZ2 3.67Å; V263-W299 HydrophobicContact CG1-CB 4.28Å; V263-W299 HydrophobicContact CG1-CD2 4.2Å; V263-W299 HydrophobicContact CG1-CE3 4.3Å; V263-W299 HydrophobicContact CG1-CG 4.22Å; V263-W299 HydrophobicContact CG2-CD2 3.87Å; V263-W299 HydrophobicContact CG2-CE3 4.41Å; V263-W299 HydrophobicContact CG2-CG 4.13Å; V263-W299 HydrophobicContact CG2-CZ2 4.07Å; L275-W299 HydrophobicContact CD2-CE3 4.11Å; V277-W299 HydrophobicContact CG1-CH2 3.91Å; V277-W299 HydrophobicContact CG1-CZ2 4.38Å; V277-W299 HydrophobicContact CG1-CZ3 4.48Å; V277-W299 HydrophobicContact CG2-CE3 4.32Å; V277-W299 HydrophobicContact CG2-CH2 3.92Å; V277-W299 HydrophobicContact CG2-CZ3 3.63Å; V287-W299 HydrophobicContact CG1-CH2 4.32Å; L291-W299 HydrophobicContact CD1-CH2 4Å; L291-W299 HydrophobicContact CD1-CZ3 3.84Å; T295-W299 HydrophobicContact CG2-CD2 4.03Å; T295-W299 HydrophobicContact CG2-CE3 4.33Å; T295-W299 HydrophobicContact CG2-CH2 3.89Å; T295-W299 HydrophobicContact CG2-CZ2 3.55Å; T295-W299 HydrophobicContact CG2-CZ3 4.26Å; T295-W299 PolarHBondContact O-N 3.19Å; L296-W299 HydrophobicContact CD2-CE3 3.89Å; L296-W299 HydrophobicContact CD2-CZ3 3.88Å; L296-W299 PolarHBondContact O-N 3.49Å; W299-Q301 PolarHBondContact O-N 2.63Å; W299-Q301 VanDerWaalsContact O-N 3.14Å; W299-L302 PolarHBondContact O-N 2.94Å; W299-L302 VanDerWaalsContact O-N 3.14Å; W299-L303 WeakPolarHBondContact O-CB 3.35Å; W299-L303 WeakPolarHBondContact O-CD1 3.34Å; W299-L303 WeakPolarHBondContact O-CG 3.46Å; W299-L303 PolarHBondContact O-N 3.15Å
300	G	94.2	Very high	95.3	Very high	42 Å²	42	53.1 Å²	53.1	43%	0.433	28%	0.28	S	S	.	.	H	α-helix	trans	-57.6	-28.2	177.2	0	0	0	0	0	114.5	L296 R297 K298	L296-G300 PolarHBondContact O-N 3.14Å; R297-G300 PolarHBondContact O-N 3.34Å; K298-G300 PolarHBondContact O-N 3.31Å
301	Q	96	Very high	95.3	Very high	140 Å²	140	53.5 Å²	53.5	65%	0.654	28%	0.278	S	S	*	.	H	α-helix	trans	-86.9	-31	177.8	-69.8	173.3	-10.6	0	0	113.5	R297 K298 W299	R297-Q301 WeakPolarHBondContact O-CG 3.45Å; R297-Q301 PolarHBondContact O-N 3.41Å; R297-Q301 VanDerWaalsContact O-N 3.12Å; K298-Q301 PolarHBondContact O-N 3.06Å; K298-Q301 VanDerWaalsContact O-N 3.14Å; W299-Q301 PolarHBondContact O-N 2.63Å; W299-Q301 VanDerWaalsContact O-N 3.14Å
302	L	96.6	Very high	95.4	Very high	83 Å²	83	53.5 Å²	53.5	44%	0.435	28%	0.278	S	S	.	.	H	α-helix	trans	-96	-12.1	-172.8	-64.6	-179.5	0	0	0	114.1	L254 K298 W299 L304	L254-L302 HydrophobicContact CD1-CB 3.98Å; L254-L302 HydrophobicContact CD2-CB 3.82Å; K298-L302 HydrophobicContact CD-CD1 4.4Å; K298-L302 HydrophobicContact CG-CD1 3.67Å; K298-L302 HydrophobicContact CG-CG 4.42Å; K298-L302 WeakPolarHBondContact O-CG 3.22Å; K298-L302 PolarHBondContact O-N 3.01Å; W299-L302 PolarHBondContact O-N 2.94Å; W299-L302 VanDerWaalsContact O-N 3.14Å; L302-L304 PolarHBondContact O-N 3.14Å
303	L	95.4	Very high	95.4	Very high	7 Å²	7	49 Å²	49	4%	0.037	26%	0.257	C	S	.	.			trans	-63	120.7	176.7	-84	164.7	0	0	0	111.8	R252 L254 V263 Q265 L275 W299	R252-L303 HydrophobicContact CB-CB 3.98Å; R252-L303 HydrophobicContact CB-CD2 4.23Å; L254-L303 HydrophobicContact CB-CD2 3.8Å; L254-L303 HydrophobicContact CB-CG 4.25Å; V263-L303 HydrophobicContact CG1-CD2 4.3Å; Q265-L303 HydrophobicContact CB-CD1 3.97Å; Q265-L303 HydrophobicContact CB-CD2 4.5Å; L275-L303 HydrophobicContact CD1-CD1 3.89Å; W299-L303 WeakPolarHBondContact O-CB 3.35Å; W299-L303 WeakPolarHBondContact O-CD1 3.34Å; W299-L303 WeakPolarHBondContact O-CG 3.46Å; W299-L303 PolarHBondContact O-N 3.15Å
304	L	93.4	Very high	95.4	Very high	114 Å²	114	51.5 Å²	51.5	60%	0.597	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	142.1	-178.3	-65.3	175.2	0	0	0	111.8	R252 F253 L302 S306	R252-L304 WeakPolarHBondContact CA-O 3.37Å; F253-L304 PolarHBondContact N-O 2.85Å; F253-L304 PolarHBondContact O-N 3.44Å; F253-L304 VanDerWaalsContact O-N 3.11Å; L302-L304 PolarHBondContact O-N 3.14Å; L304-S306 PolarHBondContact O-N 2.75Å; L304-S306 PolarHBondContact O-OG 3.11Å
305	P	93.6	Very high	95.2	Very high	88 Å²	88	47 Å²	47	57%	0.571	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-56.7	125.5	170.3	-21.8	33.1	0	0	0	111.3	M250 H251	M250-P305 HydrophobicContact CE-CB 3.98Å; H251-P305 CarbonylContact O-C 3.53Å; H251-P305 WeakPolarHBondContact O-CA 3.41Å
306	S	89.6	Confident	94.8	Very high	28 Å²	28	47.3 Å²	47.3	20%	0.196	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	141.4	-178.7	-57.9	0	0	0	0	110.1	M250 H251 L304 L308	M250-S306 WeakPolarHBondContact CA-O 3.47Å; H251-S306 PolarHBondContact N-O 2.87Å; H251-S306 PolarHBondContact O-N 3.49Å; L304-S306 PolarHBondContact O-N 2.75Å; L304-S306 PolarHBondContact O-OG 3.11Å; S306-L308 PolarHBondContact O-N 3.3Å
307	L	92.3	Very high	94.5	Very high	57 Å²	57	46.4 Å²	46.4	30%	0.298	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	115	168	-177.7	64.1	0	0	0	107.4	M250 P390	M250-L307 VanDerWaalsContact SD-CA 3.56Å; M250-L307 HydrophobicContact SD-CB 3.71Å; M250-L307 HydrophobicContact SD-CD1 4.26Å; M250-L307 PolarHBondContact SD-N 2.76Å; M250-L307 VanDerWaalsContact SD-N 3.36Å; L307-P390 WeakPolarHBondContact O-CD 3.42Å
308	L	92.5	Very high	94.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	132.6	-170.4	-169.8	74	0	0	0	111	K248 E249 F253 L264 S306 L310 P390 A392	K248-L308 WeakPolarHBondContact CA-O 3.35Å; E249-L308 PolarHBondContact N-O 3.38Å; E249-L308 PolarHBondContact O-N 3.49Å; F253-L308 HydrophobicContact CD2-CD1 3.52Å; F253-L308 HydrophobicContact CD2-CD2 4.24Å; F253-L308 HydrophobicContact CE2-CD1 3.79Å; F253-L308 HydrophobicContact CG-CD1 4.09Å; L264-L308 HydrophobicContact CD1-CD2 3.42Å; L264-L308 VanDerWaalsContact CD1-CD2 3.42Å; L264-L308 HydrophobicContact CD2-CD2 3.79Å; L264-L308 HydrophobicContact CG-CD2 4.22Å; S306-L308 PolarHBondContact O-N 3.3Å; L308-L310 HydrophobicContact CD2-CB 4.17Å; L308-L310 HydrophobicContact CD2-CD1 4.32Å; L308-L310 HydrophobicContact CG-CB 4.39Å; L308-L310 PolarHBondContact O-N 2.92Å; L308-P390 HydrophobicContact CD1-CB 3.93Å; L308-P390 VanDerWaalsContact CD1-O 3.25Å; L308-P390 WeakPolarHBondContact CD1-O 3.35Å; L308-A392 HydrophobicContact CD1-CB 4.01Å; L308-A392 HydrophobicContact CD2-CB 3.84Å; L308-A392 HydrophobicContact CG-CB 4.15Å
309	D	94.6	Very high	93.6	Very high	26 Å²	26	38 Å²	38	14%	0.139	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	97.5	165.6	-159.9	-11.1	0	0	0	108.9	H246 K248 H311 P390 H391 A392	H246-D309 IonicContact CD2-OD1 2.84Å; H246-D309 PolarHBondContact CD2-OD1 3.16Å; H246-D309 IonicContact NE2-OD1 2.75Å; H246-D309 PolarHBondContact NE2-OD1 3.24Å; K248-D309 VanDerWaalsContact CE-CG 3.48Å; K248-D309 WeakPolarHBondContact CE-OD2 3.2Å; K248-D309 HydrophobicContact CG-CB 4.42Å; K248-D309 IonicContact NZ-OD2 3Å; K248-D309 PolarHBondContact NZ-OD2 3.19Å; D309-H311 IonicContact OD1-NE2 3.52Å; D309-P390 PolarHBondContact N-O 3.01Å; D309-H391 WeakPolarHBondContact O-CA 3.43Å; D309-A392 PolarHBondContact O-N 2.62Å
310	L	96.3	Very high	93	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121.9	-167.3	176	59.5	0	0	0	111.6	F221 H246 Q247 L264 I266 L308 L312 A392 F394	F221-L310 HydrophobicContact CE1-CD2 3.94Å; F221-L310 HydrophobicContact CE1-CG 4.15Å; F221-L310 HydrophobicContact CZ-CD2 3.65Å; F221-L310 HydrophobicContact CZ-CG 4.27Å; H246-L310 VanDerWaalsContact CA-O 3.27Å; H246-L310 WeakPolarHBondContact CA-O 3.41Å; Q247-L310 HydrophobicContact CG-CB 4.47Å; Q247-L310 PolarHBondContact N-O 2.99Å; Q247-L310 VanDerWaalsContact N-O 3.08Å; Q247-L310 PolarHBondContact O-N 3.33Å; L264-L310 HydrophobicContact CD2-CD1 3.45Å; L264-L310 VanDerWaalsContact CD2-CD1 3.45Å; L264-L310 HydrophobicContact CD2-CD2 3.9Å; L264-L310 HydrophobicContact CD2-CG 4.3Å; I266-L310 HydrophobicContact CD1-CD2 3.83Å; L308-L310 HydrophobicContact CD2-CB 4.17Å; L308-L310 HydrophobicContact CD2-CD1 4.32Å; L308-L310 HydrophobicContact CG-CB 4.39Å; L308-L310 PolarHBondContact O-N 2.92Å; L310-L312 HydrophobicContact CD1-CB 4.47Å; L310-A392 HydrophobicContact CD1-CB 4.15Å; L310-F394 HydrophobicContact CD1-CD2 3.89Å; L310-F394 HydrophobicContact CD1-CE2 3.8Å
311	H	97.3	Very high	92.5	Very high	30 Å²	30	40.8 Å²	40.8	14%	0.139	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	116.7	167.6	-69.5	-116.5	0	0	0	109.7	E230 M244 M245 H246 D309 H391 A392 H393 F394	E230-H311 IonicContact OE2-ND1 2.64Å; M244-H311 HydrophobicContact CG-CB 3.87Å; M244-H311 HydrophobicContact SD-CB 4.15Å; M245-H311 CarbonylContact O-C 3.58Å; M245-H311 WeakPolarHBondContact O-CA 3.47Å; H246-H311 AromaticContact CD2-CD2 3.74Å; H246-H311 AromaticContact CD2-CE1 3.83Å; H246-H311 AromaticContact CD2-NE2 3.33Å; H246-H311 PolarHBondContact CD2-NE2 2.95Å; H246-H311 VanDerWaalsContact CD2-NE2 3.33Å; D309-H311 IonicContact OD1-NE2 3.52Å; H311-H391 AromaticContact CD2-NE2 3.7Å; H311-H391 AromaticContact NE2-NE2 3.98Å; H311-A392 PolarHBondContact N-O 2.91Å; H311-H393 HydrophobicContact CB-CB 4.18Å; H311-H393 WeakPolarHBondContact CB-CD2 3.3Å; H311-F394 PolarHBondContact O-N 3.31Å
312	L	97.4	Very high	91.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	128.2	-177.5	-173.8	72.5	0	0	0	110.2	F221 M245 I266 L276 L310 M364 F394	F221-L312 HydrophobicContact CE1-CB 4.4Å; F221-L312 HydrophobicContact CE2-CD2 4.42Å; F221-L312 HydrophobicContact CZ-CB 4.16Å; F221-L312 HydrophobicContact CZ-CD2 4.09Å; M245-L312 WeakPolarHBondContact CA-O 3.19Å; M245-L312 VanDerWaalsContact CB-O 3.27Å; M245-L312 WeakPolarHBondContact CB-O 3.44Å; M245-L312 HydrophobicContact CE-CB 4.12Å; M245-L312 HydrophobicContact CE-CD2 3.81Å; M245-L312 HydrophobicContact CE-CG 4.02Å; M245-L312 PolarHBondContact N-O 3.37Å; M245-L312 PolarHBondContact O-N 3.09Å; I266-L312 HydrophobicContact CD1-CD2 4.49Å; L276-L312 HydrophobicContact CD1-CD1 3.53Å; L276-L312 HydrophobicContact CD1-CD2 4.14Å; L310-L312 HydrophobicContact CD1-CB 4.47Å; L312-M364 HydrophobicContact CD2-CG 4.33Å; L312-F394 HydrophobicContact CD1-CB 3.93Å; L312-F394 HydrophobicContact CD1-CD1 4.29Å; L312-F394 HydrophobicContact CD1-CD2 3.99Å; L312-F394 HydrophobicContact CD1-CG 3.81Å
313	P	96.8	Very high	91	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	145.2	-179.7	25.3	-32.7	0	0	0	109.6	F232 V242 M244 F315 F394 F398 P419	F232-P313 HydrophobicContact CD2-CG 4.25Å; F232-P313 HydrophobicContact CE2-CG 4.12Å; V242-P313 HydrophobicContact CG2-CB 4.1Å; M244-P313 HydrophobicContact CE-CB 4.41Å; M244-P313 HydrophobicContact SD-CB 4.18Å; P313-F315 HydrophobicContact CB-CD1 4.44Å; P313-F315 HydrophobicContact CG-CD1 4.08Å; P313-F315 HydrophobicContact CG-CE1 4.48Å; P313-F315 VanDerWaalsContact O-CD1 3.22Å; P313-F315 WeakPolarHBondContact O-CD1 3.35Å; P313-F394 WeakPolarHBondContact CD-O 3.28Å; P313-F398 HydrophobicContact CG-CE1 3.95Å; P313-F398 HydrophobicContact CG-CZ 4.29Å; P313-P419 HydrophobicContact CB-CB 4.31Å
314	R	94.4	Very high	90.2	Very high	99 Å²	99	33.1 Å²	33.1	37%	0.374	18%	0.18	S	C	.	.			trans	-76.3	126.7	159.8	-174.4	-167	-69.2	150.5	-9.5	107.3	P243 M245 M364 E366	P243-R314 HydrophobicContact CB-CB 4.15Å; P243-R314 PolarHBondContact O-N 3.45Å; M245-R314 HydrophobicContact CG-CB 4.2Å; M245-R314 HydrophobicContact SD-CB 4.28Å; R314-M364 WeakPolarHBondContact CA-O 3.27Å; R314-M364 VanDerWaalsContact CG-O 3.25Å; R314-M364 WeakPolarHBondContact CG-O 3.38Å; R314-E366 IonicContact CZ-OE1 3.27Å; R314-E366 IonicContact CZ-OE2 2.71Å; R314-E366 VanDerWaalsContact CZ-OE2 3.31Å; R314-E366 IonicContact NE-OE1 3.27Å; R314-E366 IonicContact NE-OE2 2.71Å; R314-E366 PolarHBondContact NE-OE2 2.83Å; R314-E366 IonicContact NH2-OE1 3.34Å; R314-E366 PolarHBondContact NH2-OE1 3.12Å; R314-E366 IonicContact NH2-OE2 3.54Å; R314-E366 PolarHBondContact NH2-OE2 3.36Å
315	F	92.5	Very high	89.6	Confident	11 Å²	11	32.5 Å²	32.5	5%	0.048	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	160.9	178.5	63	-86.9	0	0	0	111.3	P313 I317 M364 F398 L400 V416 P419	P313-F315 HydrophobicContact CB-CD1 4.44Å; P313-F315 HydrophobicContact CG-CD1 4.08Å; P313-F315 HydrophobicContact CG-CE1 4.48Å; P313-F315 VanDerWaalsContact O-CD1 3.22Å; P313-F315 WeakPolarHBondContact O-CD1 3.35Å; F315-I317 HydrophobicContact CD2-CB 4.11Å; F315-I317 HydrophobicContact CD2-CG2 4.06Å; F315-I317 HydrophobicContact CE2-CB 4.28Å; F315-I317 HydrophobicContact CE2-CG2 3.77Å; F315-M364 HydrophobicContact CD1-CB 3.9Å; F315-M364 HydrophobicContact CD1-CG 4.43Å; F315-M364 HydrophobicContact CD2-CB 4.31Å; F315-M364 HydrophobicContact CE1-CB 3.64Å; F315-M364 HydrophobicContact CE1-CE 3.95Å; F315-M364 HydrophobicContact CE1-CG 3.81Å; F315-M364 HydrophobicContact CE2-CB 4.1Å; F315-M364 HydrophobicContact CE2-CE 4.21Å; F315-M364 HydrophobicContact CG-CB 4.22Å; F315-M364 HydrophobicContact CZ-CB 3.78Å; F315-M364 HydrophobicContact CZ-CE 3.38Å; F315-M364 HydrophobicContact CZ-CG 4.06Å; F315-M364 PolarHBondContact N-O 3.17Å; F315-M364 PolarHBondContact O-N 3.04Å; F315-F398 HydrophobicContact CD1-CZ 4.36Å; F315-F398 HydrophobicContact CE1-CE2 4.28Å; F315-F398 AromaticContact CE1-CZ 3.62Å; F315-F398 HydrophobicContact CE1-CZ 3.62Å; F315-F398 HydrophobicContact CZ-CE2 4.14Å; F315-F398 AromaticContact CZ-CZ 3.84Å; F315-F398 HydrophobicContact CZ-CZ 3.84Å; F315-L400 HydrophobicContact CE2-CD2 4.37Å; F315-L400 HydrophobicContact CZ-CD2 4.3Å; F315-V416 HydrophobicContact CD2-CG2 4.32Å; F315-V416 HydrophobicContact CE2-CG2 3.73Å; F315-V416 HydrophobicContact CZ-CG2 3.92Å; F315-P419 HydrophobicContact CB-CB 3.7Å; F315-P419 WeakPolarHBondContact CB-O 3.36Å; F315-P419 HydrophobicContact CG-CB 4.46Å
316	S	90.5	Very high	89.1	Confident	28 Å²	28	29 Å²	29	20%	0.196	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	141.3	159.7	-170.7	0	0	0	0	106.9	M361 D363 G422	S316-M361 WeakPolarHBondContact OG-CE 3.45Å; S316-D363 WeakPolarHBondContact CB-OD1 3.27Å; S316-D363 PolarHBondContact OG-OD1 3.1Å; S316-G422 WeakPolarHBondContact O-CA 3.35Å
317	I	89.7	Confident	88.8	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	132.9	174.4	-171.9	171.4	0	0	0	109	N72 F74 F315 M361 V362 V416	N72-I317 HydrophobicContact CB-CD1 3.86Å; N72-I317 HydrophobicContact CB-CG1 4.27Å; F74-I317 HydrophobicContact CB-CD1 3.81Å; F74-I317 HydrophobicContact CB-CG1 3.73Å; F74-I317 HydrophobicContact CB-CG2 4.43Å; F74-I317 HydrophobicContact CD1-CG2 4.28Å; F74-I317 HydrophobicContact CD2-CD1 4.41Å; F74-I317 HydrophobicContact CD2-CG2 3.77Å; F74-I317 HydrophobicContact CE2-CG2 4.08Å; F74-I317 HydrophobicContact CG-CD1 4.34Å; F74-I317 HydrophobicContact CG-CG1 4.13Å; F74-I317 HydrophobicContact CG-CG2 3.89Å; F74-I317 HydrophobicContact CZ-CG2 4.46Å; F315-I317 HydrophobicContact CD2-CB 4.11Å; F315-I317 HydrophobicContact CD2-CG2 4.06Å; F315-I317 HydrophobicContact CE2-CB 4.28Å; F315-I317 HydrophobicContact CE2-CG2 3.77Å; I317-M361 CarbonylContact O-C 3.59Å; I317-M361 WeakPolarHBondContact O-CA 3.32Å; I317-V362 HydrophobicContact CG2-CG1 3.52Å; I317-V362 PolarHBondContact N-O 3.33Å; I317-V362 PolarHBondContact O-N 2.89Å; I317-V416 HydrophobicContact CD1-CG2 3.97Å
318	S	88	Confident	88.4	Confident	37 Å²	37	27.9 Å²	27.9	26%	0.259	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	154.4	173.6	68.1	0	0	0	0	110.4	A360 G422	S318-A360 CarbonylContact C-O 3.49Å; S318-A360 WeakPolarHBondContact CA-O 3.49Å; S318-G422 PolarHBondContact OG-OXT 3.4Å
319	G	86.3	Confident	87.7	Confident	7 Å²	7	31.9 Å²	31.9	7%	0.072	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	133	171	0	0	0	0	0	109.3	F74 K359 A360	F74-G319 VanDerWaalsContact O-CA 3.27Å; F74-G319 WeakPolarHBondContact O-CA 3.43Å; G319-K359 WeakPolarHBondContact O-CA 3.38Å; G319-A360 PolarHBondContact N-O 2.92Å; G319-A360 PolarHBondContact O-N 3.1Å
320	T	85.4	Confident	86.9	Confident	72 Å²	72	31.1 Å²	31.1	44%	0.442	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	123.7	176.3	-52.7	0	0	0	0	107.7	H358 K359	T320-H358 WeakPolarHBondContact CA-O 3.22Å; T320-K359 HydrophobicContact CG2-CD 4.43Å; T320-K359 WeakPolarHBondContact OG1-CD 3.46Å; T320-K359 WeakPolarHBondContact OG1-CE 3.28Å
321	Y	83.7	Confident	85.9	Confident	29 Å²	29	34.1 Å²	34.1	11%	0.114	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	124.2	-171.5	-66.1	-70.8	0	0	0	109.6	L65 I73 F74 F75 L323 I326 H358	L65-Y321 HydrophobicContact CD1-CD1 4.44Å; L65-Y321 HydrophobicContact CD1-CE1 3.89Å; L65-Y321 HydrophobicContact CD2-CD1 4.02Å; L65-Y321 HydrophobicContact CD2-CE1 3.76Å; L65-Y321 HydrophobicContact CG-CE1 4.43Å; I73-Y321 WeakPolarHBondContact CA-OH 3.42Å; F74-Y321 PolarHBondContact N-OH 2.89Å; F74-Y321 WeakPolarHBondContact O-CE2 3.37Å; F75-Y321 HydrophobicContact CB-CD2 3.99Å; F75-Y321 HydrophobicContact CB-CE2 3.69Å; Y321-L323 PolarHBondContact O-N 3.34Å; Y321-I326 VanDerWaalsContact CB-CD1 3.46Å; Y321-I326 HydrophobicContact CD1-CD1 3.43Å; Y321-I326 VanDerWaalsContact CD1-CD1 3.43Å; Y321-I326 HydrophobicContact CG-CD1 3.8Å; Y321-H358 PolarHBondContact N-O 3.08Å; Y321-H358 PolarHBondContact O-N 2.79Å
322	N	81.2	Confident	85	Confident	31 Å²	31	33 Å²	33	17%	0.166	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	111.7	164.8	-178.1	11.9	0	0	0	108.1	E324 D325 I326	N322-E324 PolarHBondContact O-N 3.46Å; N322-E324 PolarHBondContact OD1-N 2.86Å; N322-E324 PolarHBondContact OD1-OE1 3.19Å; N322-D325 VanDerWaalsContact CB-OD2 3.32Å; N322-D325 WeakPolarHBondContact CB-OD2 3.2Å; N322-D325 PolarHBondContact ND2-OD2 2.62Å; N322-D325 PolarHBondContact O-N 3.35Å; N322-I326 WeakPolarHBondContact O-CD1 3.45Å; N322-I326 PolarHBondContact O-N 3.05Å
323	L	80.9	Confident	83.9	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-69.3	-22.4	-175.8	-61.1	-170	0	0	0	112	I80 L84 Y321 D325 I326 L327 V356 H358	I80-L323 HydrophobicContact CD1-CD2 4.16Å; I80-L323 HydrophobicContact CG1-CD2 4.4Å; I80-L323 HydrophobicContact CG2-CD1 3.95Å; I80-L323 HydrophobicContact CG2-CD2 4.31Å; L84-L323 HydrophobicContact CD2-CD1 4.45Å; Y321-L323 PolarHBondContact O-N 3.34Å; L323-D325 PolarHBondContact O-N 3.27Å; L323-I326 PolarHBondContact O-N 2.82Å; L323-L327 HydrophobicContact CB-CD1 3.87Å; L323-L327 HydrophobicContact CB-CG 4.01Å; L323-L327 VanDerWaalsContact O-CB 3.31Å; L323-L327 WeakPolarHBondContact O-CB 3.32Å; L323-L327 WeakPolarHBondContact O-CG 3.39Å; L323-L327 PolarHBondContact O-N 2.93Å; L323-V356 HydrophobicContact CB-CB 4.21Å; L323-V356 HydrophobicContact CB-CG1 4.35Å; L323-V356 HydrophobicContact CD1-CB 4.39Å; L323-V356 HydrophobicContact CD1-CG1 3.64Å; L323-V356 HydrophobicContact CG-CG1 4.23Å; L323-V356 PolarHBondContact N-O 2.78Å; L323-H358 HydrophobicContact CD2-CB 4.25Å; L323-H358 HydrophobicContact CG-CB 4.47Å
324	E	78.5	Confident	82.6	Confident	36 Å²	36	40.6 Å²	40.6	17%	0.168	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-33.3	173.9	-67.7	159	-112	0	0	112.7	N322 P328 L336 R355 V356	N322-E324 PolarHBondContact O-N 3.46Å; N322-E324 PolarHBondContact OD1-N 2.86Å; N322-E324 PolarHBondContact OD1-OE1 3.19Å; E324-P328 WeakPolarHBondContact O-CD 3.4Å; E324-P328 VanDerWaalsContact O-CG 3.31Å; E324-P328 WeakPolarHBondContact O-CG 3.4Å; E324-L336 HydrophobicContact CG-CB 4.42Å; E324-L336 HydrophobicContact CG-CD1 3.84Å; E324-R355 VanDerWaalsContact CD-CD 3.45Å; E324-R355 WeakPolarHBondContact OE1-CA 3.32Å; E324-R355 WeakPolarHBondContact OE1-CD 3.24Å; E324-R355 IonicContact OE1-NH1 3.76Å; E324-R355 VanDerWaalsContact OE2-CD 3.27Å; E324-R355 WeakPolarHBondContact OE2-CD 3.42Å; E324-R355 IonicContact OE2-CZ 3.47Å; E324-R355 IonicContact OE2-NE 3.19Å; E324-R355 IonicContact OE2-NH1 2.74Å; E324-R355 PolarHBondContact OE2-NH1 2.91Å; E324-V356 PolarHBondContact OE1-N 3.02Å
325	D	80.9	Confident	81.6	Confident	102 Å²	102	36 Å²	36	55%	0.545	22%	0.216	S	C	.	.	H	α-helix	trans	-84.1	-32.1	-177.2	-58	-34.9	0	0	0	111.4	N322 L323	N322-D325 VanDerWaalsContact CB-OD2 3.32Å; N322-D325 WeakPolarHBondContact CB-OD2 3.2Å; N322-D325 PolarHBondContact ND2-OD2 2.62Å; N322-D325 PolarHBondContact O-N 3.35Å; L323-D325 PolarHBondContact O-N 3.27Å
326	I	81.7	Confident	80.5	Confident	14 Å²	14	36.6 Å²	36.6	7%	0.072	22%	0.22	C	C	.	.	H	α-helix	trans	-94.2	-36.7	-169.7	-64.2	156.1	0	0	0	112.6	L61 L65 Y321 N322 L323 Q329 I330	L61-I326 HydrophobicContact CD1-CG2 3.35Å; L65-I326 HydrophobicContact CD2-CD1 4.07Å; L65-I326 HydrophobicContact CD2-CG1 4.13Å; L65-I326 HydrophobicContact CD2-CG2 4Å; Y321-I326 VanDerWaalsContact CB-CD1 3.46Å; Y321-I326 HydrophobicContact CD1-CD1 3.43Å; Y321-I326 VanDerWaalsContact CD1-CD1 3.43Å; Y321-I326 HydrophobicContact CG-CD1 3.8Å; N322-I326 WeakPolarHBondContact O-CD1 3.45Å; N322-I326 PolarHBondContact O-N 3.05Å; L323-I326 PolarHBondContact O-N 2.82Å; I326-Q329 WeakPolarHBondContact O-CB 3.39Å; I326-Q329 PolarHBondContact O-N 2.94Å; I326-Q329 VanDerWaalsContact O-N 3.09Å; I326-I330 PolarHBondContact O-N 2.85Å
327	L	83.1	Confident	79.5	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-42	-178.2	-62.9	175.8	0	0	0	112.5	L84 L323 Q329 I330 L332 I335 L336	L84-L327 HydrophobicContact CD1-CD1 4.28Å; L84-L327 HydrophobicContact CD1-CD2 3.87Å; L84-L327 HydrophobicContact CD2-CD1 3.58Å; L323-L327 HydrophobicContact CB-CD1 3.87Å; L323-L327 HydrophobicContact CB-CG 4.01Å; L323-L327 VanDerWaalsContact O-CB 3.31Å; L323-L327 WeakPolarHBondContact O-CB 3.32Å; L323-L327 WeakPolarHBondContact O-CG 3.39Å; L323-L327 PolarHBondContact O-N 2.93Å; L327-Q329 PolarHBondContact O-N 3.07Å; L327-I330 HydrophobicContact CD2-CD1 3.85Å; L327-I330 HydrophobicContact CD2-CG1 4.47Å; L327-I330 WeakPolarHBondContact O-CG1 3.37Å; L327-I330 PolarHBondContact O-N 2.78Å; L327-I330 VanDerWaalsContact O-N 3.16Å; L327-L332 CarbonylContact C-O 3.6Å; L327-L332 HydrophobicContact CB-CB 3.9Å; L327-L332 HydrophobicContact CD2-CD1 4.16Å; L327-L332 CarbonylContact O-C 3.57Å; L327-L332 WeakPolarHBondContact O-CA 3.32Å; L327-L332 VanDerWaalsContact O-CB 3.26Å; L327-L332 WeakPolarHBondContact O-CB 3.44Å; L327-L332 PolarHBondContact O-N 3.05Å; L327-I335 HydrophobicContact CB-CD1 4.15Å; L327-I335 HydrophobicContact CD1-CD1 3.35Å; L327-I335 HydrophobicContact CD1-CG1 4.37Å; L327-I335 HydrophobicContact CG-CD1 4.27Å; L327-L336 HydrophobicContact CD1-CD1 3.75Å; L327-L336 HydrophobicContact CD1-CG 4.46Å
328	P	84.4	Confident	78.2	Confident	60 Å²	60	42.1 Å²	42.1	39%	0.39	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-36.5	174.3	-26.9	37	0	0	0	113.5	E324 I330 G331 T333	E324-P328 WeakPolarHBondContact O-CD 3.4Å; E324-P328 VanDerWaalsContact O-CG 3.31Å; E324-P328 WeakPolarHBondContact O-CG 3.4Å; P328-I330 VanDerWaalsContact C-N 3.32Å; P328-I330 PolarHBondContact O-N 3.22Å; P328-G331 PolarHBondContact O-N 3.33Å; P328-G331 VanDerWaalsContact O-N 3.16Å; P328-T333 HydrophobicContact CB-CG2 4.25Å
329	Q	79.3	Confident	77.4	Confident	85 Å²	85	48.1 Å²	48.1	40%	0.397	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-34.1	-179.7	-58.2	179.2	-26.4	0	0	112.2	D68 I326 L327 G331	D68-Q329 PolarHBondContact OD2-NE2 2.99Å; D68-Q329 PolarHBondContact OD2-OE1 2.82Å; I326-Q329 WeakPolarHBondContact O-CB 3.39Å; I326-Q329 PolarHBondContact O-N 2.94Å; I326-Q329 VanDerWaalsContact O-N 3.09Å; L327-Q329 PolarHBondContact O-N 3.07Å; Q329-G331 PolarHBondContact O-N 2.83Å
330	I	77.4	Confident	76.9	Confident	9 Å²	9	47.9 Å²	47.9	5%	0.046	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	16.8	176.8	60.8	166.4	0	0	0	113.2	F57 L61 E64 I326 L327 P328 L332	F57-I330 HydrophobicContact CE2-CD1 3.57Å; F57-I330 HydrophobicContact CZ-CD1 4.09Å; L61-I330 HydrophobicContact CD1-CD1 4.34Å; L61-I330 HydrophobicContact CD1-CG2 4.07Å; E64-I330 HydrophobicContact CB-CG2 3.66Å; E64-I330 HydrophobicContact CG-CB 4.18Å; E64-I330 HydrophobicContact CG-CG2 3.23Å; I326-I330 PolarHBondContact O-N 2.85Å; L327-I330 HydrophobicContact CD2-CD1 3.85Å; L327-I330 HydrophobicContact CD2-CG1 4.47Å; L327-I330 WeakPolarHBondContact O-CG1 3.37Å; L327-I330 PolarHBondContact O-N 2.78Å; L327-I330 VanDerWaalsContact O-N 3.16Å; P328-I330 VanDerWaalsContact C-N 3.32Å; P328-I330 PolarHBondContact O-N 3.22Å; I330-L332 HydrophobicContact CD1-CD1 3.53Å; I330-L332 HydrophobicContact CG1-CB 4.43Å; I330-L332 HydrophobicContact CG1-CD1 3.92Å
331	G	74.1	Confident	76.9	Confident	64 Å²	64	46.6 Å²	46.6	66%	0.66	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.3	12.4	177.9	0	0	0	0	0	114.9	P328 Q329 T333	P328-G331 PolarHBondContact O-N 3.33Å; P328-G331 VanDerWaalsContact O-N 3.16Å; Q329-G331 PolarHBondContact O-N 2.83Å; G331-T333 PolarHBondContact O-N 3.07Å
332	L	78.4	Confident	77	Confident	5 Å²	5	45.4 Å²	45.4	3%	0.026	25%	0.254	C	S	.	.			trans	-96.9	65.8	172.6	-86.3	145.2	0	0	0	108.9	F57 G102 L327 I330 I335	F57-L332 HydrophobicContact CE2-CD1 4.17Å; G102-L332 VanDerWaalsContact CA-CD2 3.41Å; G102-L332 WeakPolarHBondContact O-CD1 3.26Å; L327-L332 CarbonylContact C-O 3.6Å; L327-L332 HydrophobicContact CB-CB 3.9Å; L327-L332 HydrophobicContact CD2-CD1 4.16Å; L327-L332 CarbonylContact O-C 3.57Å; L327-L332 WeakPolarHBondContact O-CA 3.32Å; L327-L332 VanDerWaalsContact O-CB 3.26Å; L327-L332 WeakPolarHBondContact O-CB 3.44Å; L327-L332 PolarHBondContact O-N 3.05Å; I330-L332 HydrophobicContact CD1-CD1 3.53Å; I330-L332 HydrophobicContact CG1-CB 4.43Å; I330-L332 HydrophobicContact CG1-CD1 3.92Å; L332-I335 HydrophobicContact CB-CD1 4.1Å; L332-I335 HydrophobicContact CB-CG1 4.31Å; L332-I335 HydrophobicContact CD2-CD1 3.77Å; L332-I335 HydrophobicContact CD2-CG1 4.34Å; L332-I335 HydrophobicContact CD2-CG2 3.98Å
333	T	73.9	Confident	77.3	Confident	75 Å²	75	44.5 Å²	44.5	46%	0.46	25%	0.25	S	S	.	.			trans	-75.3	156.3	171.6	61.9	0	0	0	0	109.7	P328 G331 I335	P328-T333 HydrophobicContact CB-CG2 4.25Å; G331-T333 PolarHBondContact O-N 3.07Å; T333-I335 PolarHBondContact O-N 3.44Å
334	D	70.6	Confident	77.6	Confident	85 Å²	85	45.1 Å²	45.1	46%	0.455	26%	0.258	S	S	.	.	S	Bend	trans	68.7	-0.7	166.3	-47.1	-50.3	0	0	0	117.6	N337	D334-N337 VanDerWaalsContact CA-CG 3.5Å; D334-N337 VanDerWaalsContact CA-ND2 3.3Å; D334-N337 WeakPolarHBondContact CA-ND2 3.29Å; D334-N337 WeakPolarHBondContact CB-ND2 3.38Å; D334-N337 PolarHBondContact O-OD1 2.64Å; D334-N337 VanDerWaalsContact O-OD1 3.04Å; D334-N337 PolarHBondContact OD1-ND2 2.81Å
335	I	73.3	Confident	78	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.015	25%	0.251	C	S	.	.	S	Bend	trans	-77.6	-19.7	177.6	55.9	151.4	0	0	0	114.6	L84 L98 I99 L327 L332 T333 F342	L84-I335 HydrophobicContact CD2-CD1 4.32Å; L98-I335 HydrophobicContact CB-CG2 3.87Å; I99-I335 HydrophobicContact CG1-CB 3.78Å; I99-I335 HydrophobicContact CG1-CD1 4.47Å; I99-I335 HydrophobicContact CG1-CG2 3.73Å; L327-I335 HydrophobicContact CB-CD1 4.15Å; L327-I335 HydrophobicContact CD1-CD1 3.35Å; L327-I335 HydrophobicContact CD1-CG1 4.37Å; L327-I335 HydrophobicContact CG-CD1 4.27Å; L332-I335 HydrophobicContact CB-CD1 4.1Å; L332-I335 HydrophobicContact CB-CG1 4.31Å; L332-I335 HydrophobicContact CD2-CD1 3.77Å; L332-I335 HydrophobicContact CD2-CG1 4.34Å; L332-I335 HydrophobicContact CD2-CG2 3.98Å; T333-I335 PolarHBondContact O-N 3.44Å; I335-F342 WeakPolarHBondContact O-CZ 3.44Å
336	L	69.6	Low	78.1	Confident	24 Å²	24	39.8 Å²	39.8	13%	0.126	23%	0.231	C	C	.	.	S	Bend	trans	-123.8	9.7	179.9	-63.7	178.4	0	0	0	112.3	L87 E324 L327 V356	L87-L336 HydrophobicContact CD2-CD2 3.32Å; E324-L336 HydrophobicContact CG-CB 4.42Å; E324-L336 HydrophobicContact CG-CD1 3.84Å; L327-L336 HydrophobicContact CD1-CD1 3.75Å; L327-L336 HydrophobicContact CD1-CG 4.46Å; L336-V356 HydrophobicContact CD1-CB 4.43Å; L336-V356 HydrophobicContact CD1-CG2 4.09Å; L336-V356 HydrophobicContact CD2-CG2 3.87Å
337	N	68.7	Low	77.7	Confident	43 Å²	43	40.7 Å²	40.7	23%	0.23	24%	0.244	C	C	.	.	S	Bend	trans	-82.9	179.1	-177.7	78	2	0	0	0	111.5	D334 E339 A340	D334-N337 VanDerWaalsContact CA-CG 3.5Å; D334-N337 VanDerWaalsContact CA-ND2 3.3Å; D334-N337 WeakPolarHBondContact CA-ND2 3.29Å; D334-N337 WeakPolarHBondContact CB-ND2 3.38Å; D334-N337 PolarHBondContact O-OD1 2.64Å; D334-N337 VanDerWaalsContact O-OD1 3.04Å; D334-N337 PolarHBondContact OD1-ND2 2.81Å; N337-E339 PolarHBondContact O-N 3.19Å; N337-E339 WeakPolarHBondContact OD1-CA 3.18Å; N337-E339 WeakPolarHBondContact OD1-CB 3.48Å; N337-E339 PolarHBondContact OD1-N 3.21Å; N337-A340 WeakPolarHBondContact O-CB 3.3Å; N337-A340 PolarHBondContact O-N 3.36Å; N337-A340 PolarHBondContact OD1-N 3.25Å
338	L	63.9	Low	77	Confident	101 Å²	101	46.3 Å²	46.3	53%	0.529	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-15.1	177.5	-76.5	154.5	0	0	0	114.3	K351 I353	L338-K351 HydrophobicContact CD2-CB 3.68Å; L338-K351 HydrophobicContact CD2-CD 4.43Å; L338-I353 HydrophobicContact CD2-CG1 4.43Å
339	E	69.6	Low	75.8	Confident	162 Å²	162	50.4 Å²	50.4	76%	0.757	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-14.4	179.4	-55.3	-169.3	158.2	0	0	112.5	N337 D341	N337-E339 PolarHBondContact O-N 3.19Å; N337-E339 WeakPolarHBondContact OD1-CA 3.18Å; N337-E339 WeakPolarHBondContact OD1-CB 3.48Å; N337-E339 PolarHBondContact OD1-N 3.21Å; E339-D341 PolarHBondContact O-N 3.05Å
340	A	77.4	Confident	74.8	Confident	3 Å²	3	48.4 Å²	48.4	3%	0.025	28%	0.28	C	S	.	.			trans	-62.4	122.3	175.3	0	0	0	0	0	111.2	T95 N337 F342	T95-A340 HydrophobicContact CG2-CB 3.86Å; N337-A340 WeakPolarHBondContact O-CB 3.3Å; N337-A340 PolarHBondContact O-N 3.36Å; N337-A340 PolarHBondContact OD1-N 3.25Å; A340-F342 HydrophobicContact CB-CD2 4.04Å; A340-F342 HydrophobicContact CB-CE2 3.48Å; A340-F342 VanDerWaalsContact CB-CE2 3.48Å; A340-F342 HydrophobicContact CB-CZ 4.12Å; A340-F342 PolarHBondContact O-N 2.91Å
341	D	84.9	Confident	73.9	Confident	44 Å²	44	55.5 Å²	55.5	24%	0.235	31%	0.311	C	S	.	.			trans	-91.7	94.2	-177	-171.8	-16.1	0	0	0	110.9	A91 Q92 T95 E339 S343	A91-D341 CarbonylContact C-O 3.47Å; A91-D341 VanDerWaalsContact CA-O 3.24Å; A91-D341 WeakPolarHBondContact CA-O 3.38Å; Q92-D341 HydrophobicContact CB-CB 4.08Å; Q92-D341 HydrophobicContact CG-CB 4.07Å; Q92-D341 WeakPolarHBondContact CG-OD1 3.35Å; Q92-D341 VanDerWaalsContact CG-OD2 3.31Å; Q92-D341 WeakPolarHBondContact CG-OD2 3.28Å; Q92-D341 PolarHBondContact N-O 3Å; T95-D341 PolarHBondContact OG1-N 3.21Å; E339-D341 PolarHBondContact O-N 3.05Å; D341-S343 VanDerWaalsContact C-N 3.35Å; D341-S343 WeakPolarHBondContact OD1-CB 3.21Å; D341-S343 PolarHBondContact OD1-N 2.75Å; D341-S343 PolarHBondContact OD1-OG 2.89Å
342	F	86.2	Confident	73.1	Confident	4 Å²	4	53 Å²	53	2%	0.018	28%	0.282	C	S	.	.			trans	-95	25.8	172.9	-65.3	-66.6	0	0	0	113.7	L87 G90 A91 T95 I99 M205 I335 A340 G344 V345	L87-F342 HydrophobicContact CD1-CD1 3.95Å; L87-F342 HydrophobicContact CD1-CE1 3.42Å; L87-F342 VanDerWaalsContact CD1-CE1 3.42Å; L87-F342 HydrophobicContact CD1-CE2 4.46Å; L87-F342 HydrophobicContact CD1-CZ 3.71Å; L87-F342 HydrophobicContact CD2-CE1 4.14Å; L87-F342 HydrophobicContact CD2-CZ 3.81Å; L87-F342 HydrophobicContact CG-CD1 4.43Å; L87-F342 HydrophobicContact CG-CE1 3.47Å; L87-F342 VanDerWaalsContact CG-CE1 3.47Å; L87-F342 HydrophobicContact CG-CZ 3.68Å; G90-F342 CarbonylContact O-C 3.53Å; G90-F342 VanDerWaalsContact O-C 3.31Å; G90-F342 VanDerWaalsContact O-CA 3.31Å; G90-F342 WeakPolarHBondContact O-CA 3.18Å; A91-F342 HydrophobicContact CB-CD1 3.93Å; A91-F342 HydrophobicContact CB-CE1 3.8Å; T95-F342 HydrophobicContact CG2-CE1 4.28Å; T95-F342 HydrophobicContact CG2-CZ 4.15Å; I99-F342 HydrophobicContact CD1-CE1 4.22Å; I99-F342 HydrophobicContact CD1-CZ 4.29Å; M205-F342 HydrophobicContact CE-CD2 4.41Å; M205-F342 HydrophobicContact CE-CG 4.37Å; I335-F342 WeakPolarHBondContact O-CZ 3.44Å; A340-F342 HydrophobicContact CB-CD2 4.04Å; A340-F342 HydrophobicContact CB-CE2 3.48Å; A340-F342 VanDerWaalsContact CB-CE2 3.48Å; A340-F342 HydrophobicContact CB-CZ 4.12Å; A340-F342 PolarHBondContact O-N 2.91Å; F342-G344 PolarHBondContact O-N 3.32Å; F342-G344 VanDerWaalsContact O-N 3.09Å; F342-V345 HydrophobicContact CB-CG2 4.23Å; F342-V345 WeakPolarHBondContact O-CB 3.27Å; F342-V345 PolarHBondContact O-N 2.78Å
343	S	86.3	Confident	72.2	Confident	12 Å²	12	54.5 Å²	54.5	8%	0.084	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-14.6	176.9	63.5	0	0	0	0	113.2	Q92 D341 V345 G347 Q348	Q92-S343 WeakPolarHBondContact CG-OG 3.36Å; Q92-S343 PolarHBondContact NE2-OG 3.08Å; D341-S343 VanDerWaalsContact C-N 3.35Å; D341-S343 WeakPolarHBondContact OD1-CB 3.21Å; D341-S343 PolarHBondContact OD1-N 2.75Å; D341-S343 PolarHBondContact OD1-OG 2.89Å; S343-V345 PolarHBondContact O-N 3.27Å; S343-G347 WeakPolarHBondContact O-CA 3.25Å; S343-G347 PolarHBondContact O-N 3.42Å; S343-Q348 WeakPolarHBondContact CA-O 3.05Å; S343-Q348 WeakPolarHBondContact CB-O 3.45Å
344	G	87.8	Confident	71.8	Confident	16 Å²	16	51 Å²	51	17%	0.165	27%	0.268	C	S	.	.	H	α-helix	trans	-60.5	-29.4	169	0	0	0	0	0	113.1	G90 F342	G90-G344 CarbonylContact O-C 3.58Å; G90-G344 WeakPolarHBondContact O-CA 3.24Å; G90-G344 PolarHBondContact O-N 3.22Å; G90-G344 VanDerWaalsContact O-N 3.09Å; F342-G344 PolarHBondContact O-N 3.32Å; F342-G344 VanDerWaalsContact O-N 3.09Å
345	V	86.1	Confident	71.9	Confident	4 Å²	4	49.3 Å²	49.3	2%	0.024	26%	0.256	C	S	.	.	H	α-helix	trans	-71.5	-50.2	179.3	-176.3	0	0	0	0	111.7	G90 L143 P149 R150 Y153 F342 S343	G90-V345 PolarHBondContact O-N 3.01Å; L143-V345 HydrophobicContact CD1-CG1 4.26Å; L143-V345 HydrophobicContact CD2-CG1 4.18Å; P149-V345 CarbonylContact C-O 3.58Å; P149-V345 VanDerWaalsContact CA-O 3.23Å; P149-V345 WeakPolarHBondContact CA-O 3.43Å; R150-V345 PolarHBondContact N-O 3.5Å; Y153-V345 HydrophobicContact CD1-CB 4.44Å; Y153-V345 HydrophobicContact CD1-CG1 3.97Å; Y153-V345 HydrophobicContact CE1-CB 4.37Å; Y153-V345 HydrophobicContact CE1-CG1 3.79Å; Y153-V345 HydrophobicContact CE1-CG2 4.12Å; Y153-V345 HydrophobicContact CE2-CG2 4.14Å; F342-V345 HydrophobicContact CB-CG2 4.23Å; F342-V345 WeakPolarHBondContact O-CB 3.27Å; F342-V345 PolarHBondContact O-N 2.78Å; S343-V345 PolarHBondContact O-N 3.27Å
346	T	83.3	Confident	72	Confident	21 Å²	21	49.3 Å²	49.3	13%	0.129	26%	0.256	C	S	.	.	H	α-helix	trans	-122.3	-12.5	-168.2	64.5	0	0	0	0	114.7	L147 Q348	L147-T346 HydrophobicContact CB-CG2 3.89Å; L147-T346 HydrophobicContact CD1-CG2 4.12Å; L147-T346 HydrophobicContact CD2-CG2 4.18Å; L147-T346 HydrophobicContact CG-CG2 4.28Å; T346-Q348 VanDerWaalsContact C-N 3.29Å; T346-Q348 PolarHBondContact OG1-N 3.07Å
347	G	73	Confident	72.5	Confident	34 Å²	34	48.3 Å²	48.3	35%	0.351	25%	0.251	S	S	.	.	S	Bend	trans	78.2	5.3	-173.9	0	0	0	0	0	116	R150 S343	R150-G347 VanDerWaalsContact NE-CA 3.25Å; S343-G347 WeakPolarHBondContact O-CA 3.25Å; S343-G347 PolarHBondContact O-N 3.42Å
348	Q	68.9	Low	73.1	Confident	118 Å²	118	46.3 Å²	46.3	55%	0.551	24%	0.24	S	C	*	.	S	Bend	trans	-111.8	143.9	173.7	-64.9	-179.4	-15.3	0	0	109.9	S343 T346 N350	S343-Q348 WeakPolarHBondContact CA-O 3.05Å; S343-Q348 WeakPolarHBondContact CB-O 3.45Å; T346-Q348 VanDerWaalsContact C-N 3.29Å; T346-Q348 PolarHBondContact OG1-N 3.07Å; Q348-N350 WeakPolarHBondContact CB-OD1 3.34Å; Q348-N350 PolarHBondContact O-N 3.16Å; Q348-N350 PolarHBondContact OE1-ND2 3.05Å
349	L	59.9	Low	74	Confident	147 Å²	147	42.6 Å²	42.6	77%	0.77	22%	0.22	S	C	*	.			trans	-70.5	67.1	166.4	-87.2	148.4	0	0	0	108.8
350	N	57.1	Low	74.6	Confident	43 Å²	43	34.9 Å²	34.9	23%	0.23	18%	0.184	C	C	.	.			trans	-87.8	114.5	174	-69.9	-13.6	0	0	0	106.7	L147 L204 Q348 T352	L147-N350 WeakPolarHBondContact CD2-ND2 3.46Å; L204-N350 HydrophobicContact CD1-CB 4.18Å; Q348-N350 WeakPolarHBondContact CB-OD1 3.34Å; Q348-N350 PolarHBondContact O-N 3.16Å; Q348-N350 PolarHBondContact OE1-ND2 3.05Å; N350-T352 VanDerWaalsContact C-N 3.3Å; N350-T352 PolarHBondContact O-N 3.19Å; N350-T352 PolarHBondContact O-OG1 3.45Å
351	K	59.2	Low	74.7	Confident	158 Å²	158	36.9 Å²	36.9	69%	0.687	19%	0.193	S	C	*	.			trans	-58.1	98.7	165.1	-60.1	-173.4	177.2	-172.2	0	106.7	L338	L338-K351 HydrophobicContact CD2-CB 3.68Å; L338-K351 HydrophobicContact CD2-CD 4.43Å
352	T	58.1	Low	74.6	Confident	10 Å²	10	34.9 Å²	34.9	6%	0.061	18%	0.183	C	C	.	.			trans	-100.1	113.9	-164.2	-61	0	0	0	0	108.9	L204 M205 N350 S354	L204-T352 HydrophobicContact CB-CG2 3.76Å; M205-T352 HydrophobicContact CB-CG2 3.91Å; M205-T352 HydrophobicContact CE-CG2 4.28Å; N350-T352 VanDerWaalsContact C-N 3.3Å; N350-T352 PolarHBondContact O-N 3.19Å; N350-T352 PolarHBondContact O-OG1 3.45Å; T352-S354 WeakPolarHBondContact CG2-OG 3.42Å; T352-S354 PolarHBondContact O-N 2.86Å; T352-S354 VanDerWaalsContact O-N 3.1Å; T352-S354 PolarHBondContact O-OG 3.37Å
353	I	58.9	Low	74.3	Confident	37 Å²	37	37 Å²	37	19%	0.19	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	105.4	164	-63.7	167.1	0	0	0	106.3	D202 L204 L338	D202-I353 HydrophobicContact CB-CD1 3.99Å; D202-I353 WeakPolarHBondContact OD2-CD1 3.38Å; L204-I353 PolarHBondContact N-O 2.95Å; L338-I353 HydrophobicContact CD2-CG1 4.43Å
354	S	65.1	Low	74.2	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.007	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	118	-178.1	-55.7	0	0	0	0	108	M205 T352	M205-S354 WeakPolarHBondContact CE-OG 3.33Å; M205-S354 CarbonylContact O-C 3.5Å; M205-S354 WeakPolarHBondContact O-CA 3.43Å; T352-S354 WeakPolarHBondContact CG2-OG 3.42Å; T352-S354 PolarHBondContact O-N 2.86Å; T352-S354 VanDerWaalsContact O-N 3.1Å; T352-S354 PolarHBondContact O-OG 3.37Å
355	R	72.1	Confident	74.2	Confident	51 Å²	51	36.9 Å²	36.9	19%	0.192	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	126.4	173.9	-52.5	-62.8	-174	155.2	3.4	110.9	P197 F199 T203 M205 V206 L207 E324	P197-R355 HydrophobicContact CG-CB 4.22Å; F199-R355 HydrophobicContact CB-CG 4.16Å; T203-R355 HydrophobicContact CG2-CG 3.9Å; M205-R355 PolarHBondContact O-N 2.78Å; V206-R355 CarbonylContact C-O 3.56Å; V206-R355 WeakPolarHBondContact CA-O 3.48Å; V206-R355 HydrophobicContact CG2-CB 4.14Å; L207-R355 PolarHBondContact N-O 3.34Å; E324-R355 VanDerWaalsContact CD-CD 3.45Å; E324-R355 WeakPolarHBondContact OE1-CA 3.32Å; E324-R355 WeakPolarHBondContact OE1-CD 3.24Å; E324-R355 IonicContact OE1-NH1 3.76Å; E324-R355 VanDerWaalsContact OE2-CD 3.27Å; E324-R355 WeakPolarHBondContact OE2-CD 3.42Å; E324-R355 IonicContact OE2-CZ 3.47Å; E324-R355 IonicContact OE2-NE 3.19Å; E324-R355 IonicContact OE2-NH1 2.74Å; E324-R355 PolarHBondContact OE2-NH1 2.91Å
356	V	77	Confident	73.9	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.012	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	115.7	-179.6	-168.2	0	0	0	0	109.8	T83 L87 L207 L323 E324 L336	T83-V356 HydrophobicContact CG2-CG1 3.38Å; L87-V356 HydrophobicContact CD2-CG2 4.45Å; L207-V356 HydrophobicContact CB-CG1 4.37Å; L207-V356 HydrophobicContact CB-CG2 4.37Å; L207-V356 HydrophobicContact CD2-CG1 4.49Å; L323-V356 HydrophobicContact CB-CB 4.21Å; L323-V356 HydrophobicContact CB-CG1 4.35Å; L323-V356 HydrophobicContact CD1-CB 4.39Å; L323-V356 HydrophobicContact CD1-CG1 3.64Å; L323-V356 HydrophobicContact CG-CG1 4.23Å; L323-V356 PolarHBondContact N-O 2.78Å; E324-V356 PolarHBondContact OE1-N 3.02Å; L336-V356 HydrophobicContact CD1-CB 4.43Å; L336-V356 HydrophobicContact CD1-CG2 4.09Å; L336-V356 HydrophobicContact CD2-CG2 3.87Å
357	S	78.4	Confident	73.5	Confident	3 Å²	3	39.2 Å²	39.2	2%	0.021	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	139.4	-179	-161.7	0	0	0	0	112	C195 P197 L207 N209	C195-S357 WeakPolarHBondContact O-CB 3.19Å; C195-S357 PolarHBondContact O-OG 2.92Å; P197-S357 VanDerWaalsContact CD-CB 3.45Å; L207-S357 PolarHBondContact O-N 3.07Å; N209-S357 PolarHBondContact N-O 2.93Å
358	H	82.8	Confident	73.5	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	127	171.2	179.4	62.1	0	0	0	110.3	S76 I80 N209 T320 Y321 L323	S76-H358 PolarHBondContact N-NE2 3.38Å; I80-H358 HydrophobicContact CD1-CB 4.31Å; I80-H358 HydrophobicContact CG1-CB 3.92Å; I80-H358 VanDerWaalsContact CG1-CG 3.45Å; N209-H358 PolarHBondContact OD1-ND1 2.84Å; T320-H358 WeakPolarHBondContact CA-O 3.22Å; Y321-H358 PolarHBondContact N-O 3.08Å; Y321-H358 PolarHBondContact O-N 2.79Å; L323-H358 HydrophobicContact CD2-CB 4.25Å; L323-H358 HydrophobicContact CG-CB 4.47Å
359	K	81.6	Confident	73	Confident	24 Å²	24	32.3 Å²	32.3	10%	0.104	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	131.6	168.5	-167.8	162.6	-179.5	156.8	0	111	V192 V193 D194 C195 G319 T320	V192-K359 HydrophobicContact CG1-CB 3.81Å; V192-K359 HydrophobicContact CG1-CD 3.69Å; V192-K359 HydrophobicContact CG1-CG 3.63Å; V193-K359 WeakPolarHBondContact O-CD 3.3Å; V193-K359 VanDerWaalsContact O-CE 3.23Å; V193-K359 WeakPolarHBondContact O-CE 3.44Å; V193-K359 PolarHBondContact O-NZ 3.29Å; D194-K359 PolarHBondContact O-NZ 2.9Å; C195-K359 HydrophobicContact CB-CB 4.22Å; C195-K359 HydrophobicContact CB-CD 4.38Å; G319-K359 WeakPolarHBondContact O-CA 3.38Å; T320-K359 HydrophobicContact CG2-CD 4.43Å; T320-K359 WeakPolarHBondContact OG1-CD 3.46Å; T320-K359 WeakPolarHBondContact OG1-CE 3.28Å
360	A	81.9	Confident	72.2	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	144.6	175.4	0	0	0	0	0	109.4	F74 I211 S318 G319 F412	F74-A360 HydrophobicContact CD1-CB 3.85Å; F74-A360 HydrophobicContact CE1-CB 3.82Å; I211-A360 HydrophobicContact CG2-CB 4.29Å; S318-A360 CarbonylContact C-O 3.49Å; S318-A360 WeakPolarHBondContact CA-O 3.49Å; G319-A360 PolarHBondContact N-O 2.92Å; G319-A360 PolarHBondContact O-N 3.1Å; A360-F412 HydrophobicContact CB-CD1 4.09Å; A360-F412 HydrophobicContact CB-CE1 3.91Å
361	M	80.8	Confident	71	Confident	44 Å²	44	30.8 Å²	30.8	22%	0.217	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	142.8	174.4	-178.6	179.1	174.3	0	0	109.7	S316 I317 D363	S316-M361 WeakPolarHBondContact OG-CE 3.45Å; I317-M361 CarbonylContact O-C 3.59Å; I317-M361 WeakPolarHBondContact O-CA 3.32Å; M361-D363 WeakPolarHBondContact CE-OD1 3.47Å
362	V	81.6	Confident	69.7	Low	3 Å²	3	25 Å²	25	2%	0.018	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	137.5	168.5	72	0	0	0	0	110.6	F74 F213 I317 T369 L400 L402	F74-V362 HydrophobicContact CD2-CG1 4.49Å; F74-V362 HydrophobicContact CE1-CB 4.07Å; F74-V362 HydrophobicContact CE1-CG1 3.89Å; F74-V362 HydrophobicContact CE2-CB 4.44Å; F74-V362 HydrophobicContact CE2-CG1 3.6Å; F74-V362 HydrophobicContact CZ-CB 3.62Å; F74-V362 HydrophobicContact CZ-CG1 3.24Å; F213-V362 HydrophobicContact CD1-CG2 4.41Å; I317-V362 HydrophobicContact CG2-CG1 3.52Å; I317-V362 PolarHBondContact N-O 3.33Å; I317-V362 PolarHBondContact O-N 2.89Å; V362-T369 HydrophobicContact CG2-CG2 3.64Å; V362-L400 HydrophobicContact CG1-CD2 4.15Å; V362-L402 HydrophobicContact CG2-CD1 4.05Å
363	D	80.4	Confident	68.5	Low	49 Å²	49	28.3 Å²	28.3	26%	0.262	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	128.9	170.7	-71	-30.9	0	0	0	109.7	S316 M361 T369	S316-D363 WeakPolarHBondContact CB-OD1 3.27Å; S316-D363 PolarHBondContact OG-OD1 3.1Å; M361-D363 WeakPolarHBondContact CE-OD1 3.47Å; D363-T369 WeakPolarHBondContact O-CA 3.4Å; D363-T369 WeakPolarHBondContact O-CB 3.46Å; D363-T369 WeakPolarHBondContact O-CG2 3.46Å
364	M	84.6	Confident	67.2	Low	2 Å²	2	30.7 Å²	30.7	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	108.7	175.8	-157.1	85.7	80.6	0	0	109.4	W217 L312 R314 F315 L400	W217-M364 HydrophobicContact CH2-SD 3.49Å; W217-M364 WeakPolarHBondContact CH2-SD 3.05Å; W217-M364 HydrophobicContact CZ2-CG 3.99Å; W217-M364 HydrophobicContact CZ2-SD 3.32Å; W217-M364 WeakPolarHBondContact CZ2-SD 3.37Å; L312-M364 HydrophobicContact CD2-CG 4.33Å; R314-M364 WeakPolarHBondContact CA-O 3.27Å; R314-M364 VanDerWaalsContact CG-O 3.25Å; R314-M364 WeakPolarHBondContact CG-O 3.38Å; F315-M364 HydrophobicContact CD1-CB 3.9Å; F315-M364 HydrophobicContact CD1-CG 4.43Å; F315-M364 HydrophobicContact CD2-CB 4.31Å; F315-M364 HydrophobicContact CE1-CB 3.64Å; F315-M364 HydrophobicContact CE1-CE 3.95Å; F315-M364 HydrophobicContact CE1-CG 3.81Å; F315-M364 HydrophobicContact CE2-CB 4.1Å; F315-M364 HydrophobicContact CE2-CE 4.21Å; F315-M364 HydrophobicContact CG-CB 4.22Å; F315-M364 HydrophobicContact CZ-CB 3.78Å; F315-M364 HydrophobicContact CZ-CE 3.38Å; F315-M364 HydrophobicContact CZ-CG 4.06Å; F315-M364 PolarHBondContact N-O 3.17Å; F315-M364 PolarHBondContact O-N 3.04Å; M364-L400 HydrophobicContact CE-CD1 3.71Å; M364-L400 HydrophobicContact CE-CD2 3.76Å; M364-L400 HydrophobicContact CE-CG 4.4Å
365	S	86.9	Confident	65.7	Low	23 Å²	23	35.9 Å²	35.9	16%	0.161	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-131.5	177.1	-178.7	78.8	0	0	0	0	112.7	W217 K367 G368	W217-S365 PolarHBondContact NE1-O 3.4Å; S365-K367 PolarHBondContact O-N 3.25Å; S365-G368 WeakPolarHBondContact CB-O 3.33Å; S365-G368 PolarHBondContact N-O 2.88Å; S365-G368 PolarHBondContact O-N 3.42Å; S365-G368 PolarHBondContact OG-O 2.87Å
366	E	80.3	Confident	63.8	Low	13 Å²	13	36.6 Å²	36.6	6%	0.061	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-24.8	-177.5	-73	95.8	141.7	0	0	113.8	P220 F221 T226 M245 R314	P220-E366 CarbonylContact C-O 3.59Å; P220-E366 WeakPolarHBondContact CA-O 3.37Å; P220-E366 VanDerWaalsContact CB-O 3.31Å; P220-E366 WeakPolarHBondContact CB-O 3.3Å; F221-E366 HydrophobicContact CB-CB 3.88Å; F221-E366 HydrophobicContact CB-CG 3.83Å; F221-E366 PolarHBondContact N-O 2.95Å; T226-E366 WeakPolarHBondContact CB-OE1 3.33Å; T226-E366 WeakPolarHBondContact OG1-CG 3.4Å; T226-E366 PolarHBondContact OG1-OE1 3.34Å; M245-E366 HydrophobicContact CB-CG 4.46Å; M245-E366 HydrophobicContact CG-CG 3.94Å; M245-E366 VanDerWaalsContact SD-CA 3.59Å; M245-E366 HydrophobicContact SD-CB 4.31Å; M245-E366 HydrophobicContact SD-CG 3.8Å; M245-E366 PolarHBondContact SD-N 3.36Å; R314-E366 IonicContact CZ-OE1 3.27Å; R314-E366 IonicContact CZ-OE2 2.71Å; R314-E366 VanDerWaalsContact CZ-OE2 3.31Å; R314-E366 IonicContact NE-OE1 3.27Å; R314-E366 IonicContact NE-OE2 2.71Å; R314-E366 PolarHBondContact NE-OE2 2.83Å; R314-E366 IonicContact NH2-OE1 3.34Å; R314-E366 PolarHBondContact NH2-OE1 3.12Å; R314-E366 IonicContact NH2-OE2 3.54Å; R314-E366 PolarHBondContact NH2-OE2 3.36Å
367	K	74.9	Confident	61.6	Low	61 Å²	61	45 Å²	45	27%	0.265	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-16.2	-178.7	-68.2	162.7	178.9	166.3	0	112.9	K216 W217 S365 E370 G372	K216-K367 CarbonylContact C-O 3.49Å; K216-K367 WeakPolarHBondContact CA-O 3.35Å; K216-K367 WeakPolarHBondContact CB-O 3.37Å; W217-K367 VanDerWaalsContact CD1-C 3.41Å; W217-K367 PolarHBondContact N-O 2.98Å; S365-K367 PolarHBondContact O-N 3.25Å; K367-E370 WeakPolarHBondContact CB-O 3.32Å; K367-G372 VanDerWaalsContact CD-N 3.31Å; K367-G372 WeakPolarHBondContact CD-O 3.44Å; K367-G372 WeakPolarHBondContact CE-O 3.27Å; K367-G372 VanDerWaalsContact NZ-CA 3.32Å; K367-G372 PolarHBondContact NZ-O 2.88Å
368	G	71.9	Confident	59.6	Low	0 Å²	0	51.1 Å²	51.1	0%	0	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	116.4	-140.2	-161.7	0	0	0	0	0	109.3	A215 W217 S365	A215-G368 WeakPolarHBondContact O-CA 3.49Å; W217-G368 VanDerWaalsContact CD1-CA 3.49Å; W217-G368 VanDerWaalsContact NE1-N 3.2Å; S365-G368 WeakPolarHBondContact CB-O 3.33Å; S365-G368 PolarHBondContact N-O 2.88Å; S365-G368 PolarHBondContact O-N 3.42Å; S365-G368 PolarHBondContact OG-O 2.87Å
369	T	58.5	Low	57.4	Low	6 Å²	6	56.8 Å²	56.8	4%	0.037	37%	0.374	C	S	.	.	S	Bend	trans	-96.9	23.1	-173.8	66.6	0	0	0	0	114.7	F213 K214 A215 Y268 V362 D363	F213-T369 HydrophobicContact CD1-CG2 3.88Å; F213-T369 HydrophobicContact CE1-CG2 3.64Å; F213-T369 PolarHBondContact O-OG1 3.19Å; K214-T369 WeakPolarHBondContact CA-OG1 3.37Å; A215-T369 PolarHBondContact N-OG1 2.91Å; A215-T369 PolarHBondContact O-N 2.85Å; A215-T369 PolarHBondContact O-OG1 2.9Å; Y268-T369 HydrophobicContact CE1-CG2 4.04Å; V362-T369 HydrophobicContact CG2-CG2 3.64Å; D363-T369 WeakPolarHBondContact O-CA 3.4Å; D363-T369 WeakPolarHBondContact O-CB 3.46Å; D363-T369 WeakPolarHBondContact O-CG2 3.46Å
370	E	43.8	Very low	55.4	Low	69 Å²	69	64 Å²	64	32%	0.322	41%	0.408	S	S	.	.	S	Bend	trans	-162	158	167.7	-130.4	-160.9	-143.5	0	0	116.4	K214 K367	K214-E370 HydrophobicContact CD-CB 4.13Å; K214-E370 HydrophobicContact CD-CG 3.98Å; K214-E370 WeakPolarHBondContact CD-OE1 3.38Å; K214-E370 WeakPolarHBondContact CE-OE1 3.16Å; K214-E370 WeakPolarHBondContact CE-OE2 3Å; K214-E370 HydrophobicContact CG-CB 4.09Å; K214-E370 HydrophobicContact CG-CG 4.41Å; K214-E370 IonicContact NZ-OE1 3.7Å; K214-E370 PolarHBondContact NZ-OE1 2.87Å; K214-E370 IonicContact NZ-OE2 2.92Å; K214-E370 PolarHBondContact NZ-OE2 2.85Å; K367-E370 WeakPolarHBondContact CB-O 3.32Å
371	A	32.4	Very low	53.3	Low	90 Å²	90	67.8 Å²	67.8	74%	0.744	43%	0.432	S	S	*	.			trans	-92.1	109	-173	0	0	0	0	0	115.1
372	G	31.7	Very low	51.3	Low	35 Å²	35	71.5 Å²	71.5	36%	0.361	46%	0.46	S	S	.	.			trans	-172.7	126.3	163.4	0	0	0	0	0	112.6	K367	K367-G372 VanDerWaalsContact CD-N 3.31Å; K367-G372 WeakPolarHBondContact CD-O 3.44Å; K367-G372 WeakPolarHBondContact CE-O 3.27Å; K367-G372 VanDerWaalsContact NZ-CA 3.32Å; K367-G372 PolarHBondContact NZ-O 2.88Å
373	A	31.8	Very low	49.3	Very low	80 Å²	80	77.2 Å²	77.2	66%	0.661	50%	0.5	S	S	*	.			trans	-73.5	136.1	-165.1	0	0	0	0	0	114.2
374	A	32.4	Very low	47.3	Very low	87 Å²	87	82.6 Å²	82.6	72%	0.719	53%	0.528	S	S	*	.			trans	-163.7	112	150.1	0	0	0	0	0	109.2
375	S	32.6	Very low	45.3	Very low	111 Å²	111	89.3 Å²	89.3	78%	0.776	56%	0.564	S	S	*	*			trans	-77.6	132.7	169.6	-83	0	0	0	0	109.7
376	G	32.2	Very low	43.1	Very low	65 Å²	65	95.6 Å²	95.6	67%	0.67	60%	0.601	S	S	*	*			trans	-127.7	116.1	160	0	0	0	0	0	107.8	L378	G376-L378 PolarHBondContact O-N 2.88Å
377	L	30.9	Very low	41.8	Very low	180 Å²	180	103.2 Å²	103.2	94%	0.942	64%	0.639	S	S	*	*			trans	-65.6	125	167.6	-84.8	138.4	0	0	0	108
378	L	37.4	Very low	41.3	Very low	131 Å²	131	105.9 Å²	105.9	69%	0.686	67%	0.666	S	S	*	*			trans	-115.8	136.5	166	-70.6	175.5	0	0	0	109.4	G376	G376-L378 PolarHBondContact O-N 2.88Å
379	S	36.1	Very low	41.2	Very low	120 Å²	120	108.6 Å²	108.6	84%	0.839	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-64.7	135.8	-170.7	-49.8	0	0	0	0	112.5
380	Q	39.8	Very low	42.3	Very low	175 Å²	175	110.8 Å²	110.8	82%	0.818	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-68.4	135.7	172.4	-65.8	-178.6	-50	0	0	110.5
381	P	37.9	Very low	44.5	Very low	79 Å²	79	112.3 Å²	112.3	51%	0.513	70%	0.701	S	S	.	*	P	Polyproline II helix	trans	-70.4	153.8	168.5	28	-30.8	0	0	0	111.1
382	P	38.3	Very low	47.5	Very low	122 Å²	122	108.1 Å²	108.1	79%	0.792	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-68	137.5	179.2	26	-30.8	0	0	0	111.5	L384	P382-L384 PolarHBondContact O-N 3.26Å
383	S	40.6	Very low	50.6	Low	123 Å²	123	108 Å²	108	86%	0.86	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-63	121.3	-176.7	47.6	0	0	0	0	113.1
384	L	38.8	Very low	53.7	Low	163 Å²	163	104.1 Å²	104.1	85%	0.853	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-101.2	116.5	161.6	-79.7	163.1	0	0	0	108.6	P382	P382-L384 PolarHBondContact O-N 3.26Å
385	N	41.8	Very low	56.8	Low	143 Å²	143	101.3 Å²	101.3	77%	0.765	60%	0.598	S	S	*	*	S	Bend	trans	43.6	113.8	159.9	-68.6	-14.3	0	0	0	119.5	M387	N385-M387 VanDerWaalsContact C-N 3.31Å; N385-M387 PolarHBondContact O-N 3Å
386	T	41.4	Very low	59.8	Low	154 Å²	154	98.5 Å²	98.5	95%	0.945	57%	0.57	S	S	*	*	S	Bend	trans	-5.5	63	149.8	-22.2	0	0	0	0	118.7
387	M	53.3	Low	62.9	Low	174 Å²	174	96.9 Å²	96.9	86%	0.857	55%	0.547	S	S	*	.			trans	-122.7	136.4	148.6	-68.8	-163.8	-175.6	0	0	106.1	N385 D389	N385-M387 VanDerWaalsContact C-N 3.31Å; N385-M387 PolarHBondContact O-N 3Å; M387-D389 PolarHBondContact O-N 2.86Å
388	S	63.2	Low	66.1	Low	117 Å²	117	88.3 Å²	88.3	82%	0.818	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-54.6	130.7	174	-175.5	0	0	0	0	108.4
389	D	69.6	Low	69	Low	56 Å²	56	82 Å²	82	30%	0.299	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-48.9	137	173.4	-61.5	-38.3	0	0	0	108.6	K248 M387 H391	K248-D389 IonicContact NZ-OD2 2.97Å; M387-D389 PolarHBondContact O-N 2.86Å; D389-H391 PolarHBondContact O-N 2.65Å
390	P	83.1	Confident	71.9	Confident	53 Å²	53	76.3 Å²	76.3	34%	0.344	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-52.4	134.9	171.6	-21.6	30.5	0	0	0	109.3	F253 L307 L308 D309	F253-P390 HydrophobicContact CD1-CB 4.45Å; F253-P390 HydrophobicContact CE1-CB 4.1Å; F253-P390 HydrophobicContact CZ-CB 4.21Å; L307-P390 WeakPolarHBondContact O-CD 3.42Å; L308-P390 HydrophobicContact CD1-CB 3.93Å; L308-P390 VanDerWaalsContact CD1-O 3.25Å; L308-P390 WeakPolarHBondContact CD1-O 3.35Å; D309-P390 PolarHBondContact N-O 3.01Å
391	H	89.3	Confident	74.7	Confident	101 Å²	101	68 Å²	68	47%	0.468	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	126.1	-175.5	174.1	-98.1	0	0	0	109.2	D309 H311 D389 H393	D309-H391 WeakPolarHBondContact O-CA 3.43Å; H311-H391 AromaticContact CD2-NE2 3.7Å; H311-H391 AromaticContact NE2-NE2 3.98Å; D389-H391 PolarHBondContact O-N 2.65Å; H391-H393 WeakPolarHBondContact CE1-CB 3.04Å; H391-H393 AromaticContact CE1-CG 3.97Å; H391-H393 AromaticContact CE1-ND1 3.85Å
392	A	94.8	Very high	77.5	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.008	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	112.1	177.2	0	0	0	0	0	109.5	F253 T262 L308 D309 L310 H311 F394	F253-A392 HydrophobicContact CE2-CB 4.46Å; T262-A392 HydrophobicContact CG2-CB 4.29Å; L308-A392 HydrophobicContact CD1-CB 4.01Å; L308-A392 HydrophobicContact CD2-CB 3.84Å; L308-A392 HydrophobicContact CG-CB 4.15Å; D309-A392 PolarHBondContact O-N 2.62Å; L310-A392 HydrophobicContact CD1-CB 4.15Å; H311-A392 PolarHBondContact N-O 2.91Å; A392-F394 HydrophobicContact CB-CE2 4.07Å
393	H	96.5	Very high	80.2	Confident	32 Å²	32	60.5 Å²	60.5	15%	0.148	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	103.7	-176.1	-171.5	174	0	0	0	110.7	E230 L278 H311 H391 N395	E230-H393 IonicContact OE1-CE1 3.43Å; E230-H393 PolarHBondContact OE1-CE1 3.37Å; E230-H393 IonicContact OE1-NE2 2.81Å; E230-H393 PolarHBondContact OE1-NE2 3.11Å; L278-H393 VanDerWaalsContact CD2-O 3.27Å; L278-H393 WeakPolarHBondContact CD2-O 3.31Å; H311-H393 HydrophobicContact CB-CB 4.18Å; H311-H393 WeakPolarHBondContact CB-CD2 3.3Å; H391-H393 WeakPolarHBondContact CE1-CB 3.04Å; H391-H393 AromaticContact CE1-CG 3.97Å; H391-H393 AromaticContact CE1-ND1 3.85Å; H393-N395 PolarHBondContact CE1-ND2 3.48Å; H393-N395 WeakPolarHBondContact NE2-CB 3.38Å; H393-N395 PolarHBondContact O-N 2.76Å; H393-N395 PolarHBondContact O-OD1 2.91Å
394	F	97.7	Very high	82.8	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.298	C	S	.	.			trans	-82.5	59.4	-178.2	-70.9	-98.7	0	0	0	111.2	F232 L264 L276 L278 L310 H311 L312 P313 A392 F398	F232-F394 WeakPolarHBondContact CD2-O 3.25Å; F232-F394 VanDerWaalsContact CE2-O 3.27Å; F232-F394 WeakPolarHBondContact CE2-O 3.02Å; L264-F394 HydrophobicContact CB-CZ 4.19Å; L264-F394 HydrophobicContact CD2-CE2 3.75Å; L264-F394 HydrophobicContact CD2-CZ 4.12Å; L276-F394 HydrophobicContact CB-CE1 3.48Å; L276-F394 VanDerWaalsContact CB-CE1 3.48Å; L276-F394 HydrophobicContact CB-CZ 3.52Å; L276-F394 HydrophobicContact CD1-CE1 4.18Å; L276-F394 HydrophobicContact CD1-CE2 4.33Å; L276-F394 HydrophobicContact CD1-CZ 4.01Å; L276-F394 HydrophobicContact CG-CE1 4.41Å; L276-F394 HydrophobicContact CG-CZ 4.43Å; L278-F394 HydrophobicContact CB-CD1 3.96Å; L278-F394 HydrophobicContact CB-CE1 3.55Å; L278-F394 HydrophobicContact CB-CZ 3.99Å; L278-F394 HydrophobicContact CD1-CD1 4.07Å; L278-F394 HydrophobicContact CD2-CD1 4.35Å; L278-F394 HydrophobicContact CD2-CD2 4.47Å; L278-F394 HydrophobicContact CD2-CE1 4.48Å; L278-F394 HydrophobicContact CD2-CG 4.34Å; L278-F394 HydrophobicContact CG-CD1 4.35Å; L278-F394 HydrophobicContact CG-CE1 4.39Å; L310-F394 HydrophobicContact CD1-CD2 3.89Å; L310-F394 HydrophobicContact CD1-CE2 3.8Å; H311-F394 PolarHBondContact O-N 3.31Å; L312-F394 HydrophobicContact CD1-CB 3.93Å; L312-F394 HydrophobicContact CD1-CD1 4.29Å; L312-F394 HydrophobicContact CD1-CD2 3.99Å; L312-F394 HydrophobicContact CD1-CG 3.81Å; P313-F394 WeakPolarHBondContact CD-O 3.28Å; A392-F394 HydrophobicContact CB-CE2 4.07Å; F394-F398 HydrophobicContact CB-CD1 4.23Å; F394-F398 HydrophobicContact CB-CE1 4.34Å; F394-F398 HydrophobicContact CD1-CB 3.77Å; F394-F398 AromaticContact CD1-CD1 3.91Å; F394-F398 HydrophobicContact CD1-CD1 3.91Å; F394-F398 AromaticContact CD1-CD2 3.92Å; F394-F398 HydrophobicContact CD1-CD2 3.92Å; F394-F398 HydrophobicContact CD1-CE1 4.47Å; F394-F398 HydrophobicContact CD1-CE2 4.48Å; F394-F398 AromaticContact CD1-CG 3.61Å; F394-F398 HydrophobicContact CD1-CG 3.61Å; F394-F398 HydrophobicContact CE1-CB 4.14Å; F394-F398 HydrophobicContact CE1-CD2 4.29Å; F394-F398 HydrophobicContact CE1-CG 4.24Å
395	N	96.8	Very high	85.5	Confident	28 Å²	28	50.9 Å²	50.9	15%	0.15	28%	0.279	C	S	.	.			trans	-101	22	178.6	64	-4.9	0	0	0	113.8	S231 F232 F233 M244 H393	S231-N395 WeakPolarHBondContact O-CB 3.38Å; F232-N395 CarbonylContact C-O 3.56Å; F232-N395 WeakPolarHBondContact CA-O 3.42Å; F233-N395 WeakPolarHBondContact CD2-O 3.35Å; F233-N395 PolarHBondContact N-O 2.77Å; M244-N395 HydrophobicContact CE-CB 4.21Å; H393-N395 PolarHBondContact CE1-ND2 3.48Å; H393-N395 WeakPolarHBondContact NE2-CB 3.38Å; H393-N395 PolarHBondContact O-N 2.76Å; H393-N395 PolarHBondContact O-OD1 2.91Å
396	R	96.6	Very high	87.9	Confident	52 Å²	52	47 Å²	47	20%	0.196	26%	0.26	C	S	.	.	S	Bend	trans	-155.4	171.7	179.4	67.7	-179.6	179.5	-80.4	6.4	109.4	F232 F233 L278 P279 D280 F398	F232-R396 VanDerWaalsContact CZ-O 3.27Å; F232-R396 WeakPolarHBondContact CZ-O 3.14Å; F233-R396 WeakPolarHBondContact O-CA 3.49Å; L278-R396 HydrophobicContact CD1-CG 3.66Å; P279-R396 PolarHBondContact O-NE 3.24Å; P279-R396 PolarHBondContact O-NH2 3.42Å; D280-R396 IonicContact OD1-NH2 2.58Å; R396-F398 WeakPolarHBondContact O-CD1 3.32Å; R396-F398 PolarHBondContact O-N 2.84Å
397	P	97.2	Very high	90.5	Very high	30 Å²	30	39.7 Å²	39.7	20%	0.195	22%	0.215	C	C	.	.			trans	-54.1	135.4	-175	-29.5	36.8	0	0	0	113.7	F233 M284 V416 V417	F233-P397 WeakPolarHBondContact O-CD 3.46Å; M284-P397 VanDerWaalsContact CE-C 3.42Å; M284-P397 HydrophobicContact CE-CB 3.6Å; M284-P397 VanDerWaalsContact CE-O 3.27Å; M284-P397 WeakPolarHBondContact CE-O 3.35Å; P397-V416 WeakPolarHBondContact CA-O 3.48Å; P397-V417 HydrophobicContact CB-CG2 4.35Å; P397-V417 HydrophobicContact CG-CG1 4.2Å
398	F	98.1	Very high	92.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	160	-177	65.8	-92.2	0	0	0	111.3	F232 L276 V277 L278 P313 F315 F394 R396 K415 V416	F232-F398 HydrophobicContact CE2-CD1 4.31Å; F232-F398 HydrophobicContact CE2-CE1 4.08Å; F232-F398 HydrophobicContact CZ-CD1 4.41Å; F232-F398 HydrophobicContact CZ-CE1 4.41Å; L276-F398 HydrophobicContact CD2-CD2 4.37Å; L276-F398 HydrophobicContact CD2-CE2 4.13Å; V277-F398 CarbonylContact O-C 3.57Å; V277-F398 WeakPolarHBondContact O-CA 3.37Å; V277-F398 VanDerWaalsContact O-CB 3.3Å; V277-F398 WeakPolarHBondContact O-CB 3.33Å; L278-F398 HydrophobicContact CD1-CB 4.06Å; P313-F398 HydrophobicContact CG-CE1 3.95Å; P313-F398 HydrophobicContact CG-CZ 4.29Å; F315-F398 HydrophobicContact CD1-CZ 4.36Å; F315-F398 HydrophobicContact CE1-CE2 4.28Å; F315-F398 AromaticContact CE1-CZ 3.62Å; F315-F398 HydrophobicContact CE1-CZ 3.62Å; F315-F398 HydrophobicContact CZ-CE2 4.14Å; F315-F398 AromaticContact CZ-CZ 3.84Å; F315-F398 HydrophobicContact CZ-CZ 3.84Å; F394-F398 HydrophobicContact CB-CD1 4.23Å; F394-F398 HydrophobicContact CB-CE1 4.34Å; F394-F398 HydrophobicContact CD1-CB 3.77Å; F394-F398 AromaticContact CD1-CD1 3.91Å; F394-F398 HydrophobicContact CD1-CD1 3.91Å; F394-F398 AromaticContact CD1-CD2 3.92Å; F394-F398 HydrophobicContact CD1-CD2 3.92Å; F394-F398 HydrophobicContact CD1-CE1 4.47Å; F394-F398 HydrophobicContact CD1-CE2 4.48Å; F394-F398 AromaticContact CD1-CG 3.61Å; F394-F398 HydrophobicContact CD1-CG 3.61Å; F394-F398 HydrophobicContact CE1-CB 4.14Å; F394-F398 HydrophobicContact CE1-CD2 4.29Å; F394-F398 HydrophobicContact CE1-CG 4.24Å; R396-F398 WeakPolarHBondContact O-CD1 3.32Å; R396-F398 PolarHBondContact O-N 2.84Å; F398-K415 WeakPolarHBondContact O-CA 3.49Å; F398-V416 HydrophobicContact CD1-CB 4.16Å; F398-V416 HydrophobicContact CD2-CB 4.42Å; F398-V416 HydrophobicContact CD2-CG2 4.41Å; F398-V416 HydrophobicContact CE1-CB 3.72Å; F398-V416 HydrophobicContact CE1-CG1 3.84Å; F398-V416 HydrophobicContact CE1-CG2 4.27Å; F398-V416 HydrophobicContact CE2-CB 3.99Å; F398-V416 HydrophobicContact CE2-CG2 3.71Å; F398-V416 HydrophobicContact CG-CB 4.49Å; F398-V416 HydrophobicContact CZ-CB 3.62Å; F398-V416 HydrophobicContact CZ-CG1 3.91Å; F398-V416 HydrophobicContact CZ-CG2 3.63Å; F398-V416 PolarHBondContact N-O 3.38Å; F398-V416 VanDerWaalsContact N-O 3.13Å; F398-V416 PolarHBondContact O-N 3.36Å
399	L	98.3	Very high	94	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	145.4	174.8	-48.2	179.4	0	0	0	110.7	Y62 L276 V277 M284 V287 L291 L401 G414 K415	Y62-L399 HydrophobicContact CE2-CD2 4.39Å; Y62-L399 WeakPolarHBondContact OH-CD2 3.41Å; L276-L399 WeakPolarHBondContact CA-O 3.27Å; V277-L399 HydrophobicContact CB-CB 4.07Å; V277-L399 HydrophobicContact CB-CD1 4.46Å; V277-L399 HydrophobicContact CB-CG 4.45Å; V277-L399 PolarHBondContact N-O 3.36Å; V277-L399 PolarHBondContact O-N 3.37Å; M284-L399 HydrophobicContact CE-CD2 4.43Å; M284-L399 HydrophobicContact SD-CD2 3.9Å; M284-L399 HydrophobicContact SD-CG 4.34Å; V287-L399 HydrophobicContact CG1-CD1 3.98Å; L291-L399 HydrophobicContact CD2-CD1 4.28Å; L399-L401 HydrophobicContact CB-CD1 4.42Å; L399-G414 CarbonylContact C-O 3.55Å; L399-G414 WeakPolarHBondContact CA-O 3.38Å; L399-K415 HydrophobicContact CD2-CB 3.98Å; L399-K415 HydrophobicContact CD2-CG 4.01Å
400	L	97.5	Very high	95.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	124	176.7	169.6	63.8	0	0	0	109.1	F74 A274 L276 F315 V362 M364 L402 L413 G414	F74-L400 HydrophobicContact CE2-CD2 4.04Å; A274-L400 HydrophobicContact CB-CD1 4.36Å; L276-L400 HydrophobicContact CD2-CB 4.36Å; L276-L400 HydrophobicContact CD2-CD1 3.46Å; L276-L400 VanDerWaalsContact CD2-CD1 3.46Å; L276-L400 HydrophobicContact CD2-CG 4.5Å; F315-L400 HydrophobicContact CE2-CD2 4.37Å; F315-L400 HydrophobicContact CZ-CD2 4.3Å; V362-L400 HydrophobicContact CG1-CD2 4.15Å; M364-L400 HydrophobicContact CE-CD1 3.71Å; M364-L400 HydrophobicContact CE-CD2 3.76Å; M364-L400 HydrophobicContact CE-CG 4.4Å; L400-L402 HydrophobicContact CD1-CD2 4.31Å; L400-L402 HydrophobicContact CD1-CG 4.11Å; L400-L402 HydrophobicContact CG-CG 4.45Å; L400-L413 CarbonylContact O-C 3.51Å; L400-L413 WeakPolarHBondContact O-CA 3.45Å; L400-G414 PolarHBondContact N-O 3.35Å; L400-G414 PolarHBondContact O-N 2.92Å
401	L	98.1	Very high	95.8	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	129.2	169.2	-59.9	88.1	0	0	0	109.1	A274 L275 V277 L296 L399 L410 F412 L413	A274-L401 CarbonylContact C-O 3.58Å; A274-L401 WeakPolarHBondContact CA-O 3.48Å; L275-L401 HydrophobicContact CB-CB 4.21Å; L275-L401 HydrophobicContact CD2-CD1 4.5Å; L275-L401 PolarHBondContact N-O 2.86Å; L275-L401 PolarHBondContact O-N 2.89Å; V277-L401 HydrophobicContact CG2-CD1 4.33Å; L296-L401 HydrophobicContact CD1-CD2 4.4Å; L296-L401 HydrophobicContact CD2-CD2 3.86Å; L399-L401 HydrophobicContact CB-CD1 4.42Å; L401-L410 HydrophobicContact CB-CD1 3.81Å; L401-L410 HydrophobicContact CD2-CD1 4.03Å; L401-L410 HydrophobicContact CD2-CD2 4.47Å; L401-L410 HydrophobicContact CG-CD1 4.29Å; L401-F412 WeakPolarHBondContact CA-O 3.38Å; L401-L413 HydrophobicContact CD1-CD1 4.23Å; L401-L413 HydrophobicContact CD2-CD1 3.97Å; L401-L413 HydrophobicContact CG-CD1 3.65Å
402	L	96.8	Very high	96.2	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.9	175.3	-71.2	168.2	0	0	0	109.6	Y268 L273 A274 V362 L400 L410 L411 F412	Y268-L402 HydrophobicContact CE2-CD2 3.69Å; L273-L402 WeakPolarHBondContact O-CA 3.43Å; A274-L402 HydrophobicContact CB-CD2 3.65Å; V362-L402 HydrophobicContact CG2-CD1 4.05Å; L400-L402 HydrophobicContact CD1-CD2 4.31Å; L400-L402 HydrophobicContact CD1-CG 4.11Å; L400-L402 HydrophobicContact CG-CG 4.45Å; L402-L410 CarbonylContact O-C 3.53Å; L402-L411 WeakPolarHBondContact O-CA 3.4Å; L402-L411 WeakPolarHBondContact O-CB 3.33Å; L402-L411 PolarHBondContact O-N 2.95Å; L402-F412 HydrophobicContact CB-CB 4.07Å; L402-F412 HydrophobicContact CB-CD2 3.93Å; L402-F412 HydrophobicContact CD1-CB 4.08Å; L402-F412 HydrophobicContact CD1-CD2 3.66Å; L402-F412 HydrophobicContact CD1-CE2 4.46Å; L402-F412 HydrophobicContact CD1-CG 4.14Å; L402-F412 HydrophobicContact CG-CB 4.46Å; L402-F412 HydrophobicContact CG-CD2 4.42Å; L402-F412 PolarHBondContact N-O 3.34Å; L402-F412 PolarHBondContact O-N 3.13Å
403	W	95.8	Very high	96.3	Very high	42 Å²	42	22 Å²	22	16%	0.159	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	143	-176.4	-67.3	82.2	0	0	0	111.4	T55 A272 L273 L296 Q408 S409 L410	T55-W403 HydrophobicContact CG2-CH2 3.85Å; A272-W403 CarbonylContact C-O 3.56Å; A272-W403 WeakPolarHBondContact CA-O 3.08Å; L273-W403 HydrophobicContact CD1-CB 3.76Å; L273-W403 HydrophobicContact CD1-CG 3.98Å; L273-W403 HydrophobicContact CG-CB 4.01Å; L273-W403 PolarHBondContact N-O 3.44Å; L273-W403 PolarHBondContact O-N 3.2Å; L296-W403 HydrophobicContact CD1-CZ2 4.07Å; W403-Q408 WeakPolarHBondContact CZ3-O 3.49Å; W403-S409 WeakPolarHBondContact CA-O 3.41Å; W403-L410 HydrophobicContact CD2-CB 4.33Å; W403-L410 HydrophobicContact CD2-CD1 4.12Å; W403-L410 HydrophobicContact CE3-CB 4.12Å; W403-L410 HydrophobicContact CG-CD1 4.45Å; W403-L410 HydrophobicContact CH2-CB 3.89Å; W403-L410 HydrophobicContact CZ2-CB 4.09Å; W403-L410 HydrophobicContact CZ2-CD1 3.87Å; W403-L410 HydrophobicContact CZ2-CD2 4.41Å; W403-L410 HydrophobicContact CZ2-CG 4.35Å; W403-L410 HydrophobicContact CZ3-CB 3.91Å
404	E	95.4	Very high	96.3	Very high	11 Å²	11	20.5 Å²	20.5	5%	0.051	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	124.2	160	-160.3	-73.2	132.4	0	0	108.8	L126 L133 N271 T406 T407 Q408 S409 L411	L126-E404 HydrophobicContact CD2-CB 4.05Å; L126-E404 HydrophobicContact CD2-CG 3.79Å; L133-E404 HydrophobicContact CD2-CG 4.44Å; N271-E404 VanDerWaalsContact CB-OE1 3.25Å; N271-E404 WeakPolarHBondContact CB-OE1 3.39Å; N271-E404 CarbonylContact O-C 3.34Å; N271-E404 WeakPolarHBondContact O-CA 3.44Å; N271-E404 WeakPolarHBondContact O-CG 3.11Å; E404-T406 VanDerWaalsContact CD-N 3.3Å; E404-T406 WeakPolarHBondContact OE1-CB 3.42Å; E404-T406 PolarHBondContact OE1-N 3.03Å; E404-T406 PolarHBondContact OE1-OG1 3.05Å; E404-T406 WeakPolarHBondContact OE2-CB 3.49Å; E404-T406 PolarHBondContact OE2-N 3.11Å; E404-T406 VanDerWaalsContact OE2-N 3.11Å; E404-T407 VanDerWaalsContact OE2-CB 3.28Å; E404-T407 WeakPolarHBondContact OE2-CB 3.33Å; E404-T407 WeakPolarHBondContact OE2-CG2 3.45Å; E404-T407 PolarHBondContact OE2-N 2.91Å; E404-T407 PolarHBondContact OE2-OG1 3.14Å; E404-Q408 CarbonylContact O-C 3.5Å; E404-Q408 WeakPolarHBondContact O-CA 3.4Å; E404-Q408 PolarHBondContact O-N 3.33Å; E404-S409 PolarHBondContact N-O 3.36Å; E404-S409 PolarHBondContact O-N 3.12Å; E404-S409 VanDerWaalsContact O-N 3.1Å; E404-L411 HydrophobicContact CB-CD1 3.99Å; E404-L411 HydrophobicContact CB-CD2 4.05Å; E404-L411 HydrophobicContact CB-CG 4Å
405	V	94.1	Very high	96.2	Very high	74 Å²	74	21.1 Å²	21.1	45%	0.448	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-33.1	-165.4	177.4	0	0	0	0	112	N271 L273	N271-V405 HydrophobicContact CB-CB 4.29Å; N271-V405 PolarHBondContact O-N 3.33Å; L273-V405 HydrophobicContact CD2-CG2 3.87Å; L273-V405 HydrophobicContact CG-CG2 4.16Å
406	T	93.5	Very high	96.2	Very high	60 Å²	60	19.8 Å²	19.8	37%	0.368	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-44.4	-174.8	-46.5	0	0	0	0	112.1	Y47 T125 N271 E404	Y47-T406 PolarHBondContact OH-O 2.79Å; T125-T406 HydrophobicContact CG2-CG2 4.34Å; N271-T406 WeakPolarHBondContact CB-OG1 3.34Å; N271-T406 PolarHBondContact ND2-OG1 3.14Å; E404-T406 VanDerWaalsContact CD-N 3.3Å; E404-T406 WeakPolarHBondContact OE1-CB 3.42Å; E404-T406 PolarHBondContact OE1-N 3.03Å; E404-T406 PolarHBondContact OE1-OG1 3.05Å; E404-T406 WeakPolarHBondContact OE2-CB 3.49Å; E404-T406 PolarHBondContact OE2-N 3.11Å; E404-T406 VanDerWaalsContact OE2-N 3.11Å
407	T	94.5	Very high	96.2	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.006	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-11.4	-179.6	62.4	0	0	0	0	112.1	Y47 T51 L122 T125 L126 E404 S409	Y47-T407 HydrophobicContact CD1-CG2 4.4Å; Y47-T407 HydrophobicContact CD2-CG2 4.37Å; Y47-T407 HydrophobicContact CE1-CG2 4.13Å; Y47-T407 VanDerWaalsContact CE2-CA 3.49Å; Y47-T407 HydrophobicContact CE2-CG2 4.13Å; T51-T407 PolarHBondContact OG1-O 3.49Å; L122-T407 HydrophobicContact CD1-CG2 3.86Å; T125-T407 HydrophobicContact CG2-CG2 3.45Å; T125-T407 VanDerWaalsContact CG2-CG2 3.45Å; L126-T407 HydrophobicContact CD2-CG2 4.04Å; E404-T407 VanDerWaalsContact OE2-CB 3.28Å; E404-T407 WeakPolarHBondContact OE2-CB 3.33Å; E404-T407 WeakPolarHBondContact OE2-CG2 3.45Å; E404-T407 PolarHBondContact OE2-N 2.91Å; E404-T407 PolarHBondContact OE2-OG1 3.14Å; T407-S409 VanDerWaalsContact CB-OG 3.27Å; T407-S409 WeakPolarHBondContact CB-OG 3.33Å; T407-S409 PolarHBondContact O-N 3.43Å; T407-S409 VanDerWaalsContact OG1-CB 3.3Å; T407-S409 WeakPolarHBondContact OG1-CB 3.44Å; T407-S409 PolarHBondContact OG1-N 3.3Å; T407-S409 PolarHBondContact OG1-OG 3.14Å
408	Q	94.8	Very high	96	Very high	131 Å²	131	18.8 Å²	18.8	61%	0.612	10%	0.098	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.4	33.9	-171.1	-57.1	-176.8	-54.6	0	0	112	T51 W403 E404	T51-Q408 WeakPolarHBondContact CG2-O 3.49Å; W403-Q408 WeakPolarHBondContact CZ3-O 3.49Å; E404-Q408 CarbonylContact O-C 3.5Å; E404-Q408 WeakPolarHBondContact O-CA 3.4Å; E404-Q408 PolarHBondContact O-N 3.33Å
409	S	95	Very high	95.7	Very high	1 Å²	1	19 Å²	19	1%	0.007	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	132.4	-173.8	-55.1	0	0	0	0	111.5	L122 W403 E404 T407 L411	L122-S409 VanDerWaalsContact CD1-OG 3.23Å; L122-S409 WeakPolarHBondContact CD1-OG 3.09Å; W403-S409 WeakPolarHBondContact CA-O 3.41Å; E404-S409 PolarHBondContact N-O 3.36Å; E404-S409 PolarHBondContact O-N 3.12Å; E404-S409 VanDerWaalsContact O-N 3.1Å; T407-S409 VanDerWaalsContact CB-OG 3.27Å; T407-S409 WeakPolarHBondContact CB-OG 3.33Å; T407-S409 PolarHBondContact O-N 3.43Å; T407-S409 VanDerWaalsContact OG1-CB 3.3Å; T407-S409 WeakPolarHBondContact OG1-CB 3.44Å; T407-S409 PolarHBondContact OG1-N 3.3Å; T407-S409 PolarHBondContact OG1-OG 3.14Å; S409-L411 PolarHBondContact O-N 3.28Å; S409-L411 VanDerWaalsContact O-N 3.15Å
410	L	96.8	Very high	95.2	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	100.9	171.2	-178	60.6	0	0	0	109.2	A58 P77 V78 L401 L402 W403 F412 L413	A58-L410 HydrophobicContact CB-CD2 3.77Å; P77-L410 HydrophobicContact CG-CD2 3.99Å; P77-L410 HydrophobicContact CG-CG 3.99Å; V78-L410 WeakPolarHBondContact CG2-O 3.46Å; L401-L410 HydrophobicContact CB-CD1 3.81Å; L401-L410 HydrophobicContact CD2-CD1 4.03Å; L401-L410 HydrophobicContact CD2-CD2 4.47Å; L401-L410 HydrophobicContact CG-CD1 4.29Å; L402-L410 CarbonylContact O-C 3.53Å; W403-L410 HydrophobicContact CD2-CB 4.33Å; W403-L410 HydrophobicContact CD2-CD1 4.12Å; W403-L410 HydrophobicContact CE3-CB 4.12Å; W403-L410 HydrophobicContact CG-CD1 4.45Å; W403-L410 HydrophobicContact CH2-CB 3.89Å; W403-L410 HydrophobicContact CZ2-CB 4.09Å; W403-L410 HydrophobicContact CZ2-CD1 3.87Å; W403-L410 HydrophobicContact CZ2-CD2 4.41Å; W403-L410 HydrophobicContact CZ2-CG 4.35Å; W403-L410 HydrophobicContact CZ3-CB 3.91Å; L410-F412 VanDerWaalsContact CD1-O 3.22Å; L410-F412 WeakPolarHBondContact CD1-O 3.25Å; L410-L413 HydrophobicContact CD2-CB 4.23Å; L410-L413 HydrophobicContact CD2-CD2 4.36Å
411	L	95.6	Very high	94.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	-45.6	-179.6	-62	-176.5	0	0	0	111.5	S76 P77 L126 L135 F213 L402 E404 S409	S76-L411 WeakPolarHBondContact CA-O 3.38Å; S76-L411 WeakPolarHBondContact CB-O 3.41Å; S76-L411 PolarHBondContact OG-O 2.8Å; S76-L411 VanDerWaalsContact OG-O 3.06Å; P77-L411 WeakPolarHBondContact CD-O 3.35Å; L126-L411 HydrophobicContact CD1-CD2 4.43Å; L126-L411 HydrophobicContact CD2-CD2 4.41Å; L135-L411 HydrophobicContact CD1-CD1 4.12Å; L135-L411 HydrophobicContact CD2-CD1 4.04Å; L135-L411 HydrophobicContact CD2-CD2 3.98Å; F213-L411 HydrophobicContact CD2-CD1 3.82Å; F213-L411 HydrophobicContact CE2-CD1 4.05Å; L402-L411 WeakPolarHBondContact O-CA 3.4Å; L402-L411 WeakPolarHBondContact O-CB 3.33Å; L402-L411 PolarHBondContact O-N 2.95Å; E404-L411 HydrophobicContact CB-CD1 3.99Å; E404-L411 HydrophobicContact CB-CD2 4.05Å; E404-L411 HydrophobicContact CB-CG 4Å; S409-L411 PolarHBondContact O-N 3.28Å; S409-L411 VanDerWaalsContact O-N 3.15Å
412	F	96.5	Very high	92.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	147.2	179.4	-57.2	-90.8	0	0	0	111.4	F74 F75 I211 F213 A360 L401 L402 L410	F74-F412 AromaticContact CE1-CD1 3.51Å; F74-F412 HydrophobicContact CE1-CD1 3.51Å; F74-F412 AromaticContact CE1-CE1 3.93Å; F74-F412 HydrophobicContact CE1-CE1 3.93Å; F74-F412 HydrophobicContact CE1-CG 4.27Å; F74-F412 HydrophobicContact CE2-CB 3.68Å; F74-F412 HydrophobicContact CE2-CD1 4.12Å; F74-F412 HydrophobicContact CE2-CG 4.14Å; F74-F412 HydrophobicContact CZ-CB 3.62Å; F74-F412 AromaticContact CZ-CD1 3.23Å; F74-F412 HydrophobicContact CZ-CD1 3.23Å; F74-F412 HydrophobicContact CZ-CD2 4.46Å; F74-F412 AromaticContact CZ-CE1 3.95Å; F74-F412 HydrophobicContact CZ-CE1 3.95Å; F74-F412 AromaticContact CZ-CG 3.53Å; F74-F412 HydrophobicContact CZ-CG 3.53Å; F75-F412 WeakPolarHBondContact O-CA 3.46Å; I211-F412 HydrophobicContact CB-CZ 4.3Å; I211-F412 HydrophobicContact CD1-CE1 4.31Å; I211-F412 HydrophobicContact CD1-CE2 4.06Å; I211-F412 HydrophobicContact CD1-CZ 3.75Å; I211-F412 HydrophobicContact CG1-CE1 4.4Å; I211-F412 HydrophobicContact CG1-CE2 4.43Å; I211-F412 HydrophobicContact CG1-CZ 3.77Å; I211-F412 HydrophobicContact CG2-CD1 4.45Å; I211-F412 HydrophobicContact CG2-CE1 3.4Å; I211-F412 HydrophobicContact CG2-CZ 3.63Å; F213-F412 HydrophobicContact CB-CE2 3.45Å; F213-F412 VanDerWaalsContact CB-CE2 3.45Å; F213-F412 HydrophobicContact CB-CZ 3.82Å; F213-F412 HydrophobicContact CD2-CE2 4.5Å; F213-F412 AromaticContact CG-CE2 3.99Å; F213-F412 HydrophobicContact CG-CE2 3.99Å; A360-F412 HydrophobicContact CB-CD1 4.09Å; A360-F412 HydrophobicContact CB-CE1 3.91Å; L401-F412 WeakPolarHBondContact CA-O 3.38Å; L402-F412 HydrophobicContact CB-CB 4.07Å; L402-F412 HydrophobicContact CB-CD2 3.93Å; L402-F412 HydrophobicContact CD1-CB 4.08Å; L402-F412 HydrophobicContact CD1-CD2 3.66Å; L402-F412 HydrophobicContact CD1-CE2 4.46Å; L402-F412 HydrophobicContact CD1-CG 4.14Å; L402-F412 HydrophobicContact CG-CB 4.46Å; L402-F412 HydrophobicContact CG-CD2 4.42Å; L402-F412 PolarHBondContact N-O 3.34Å; L402-F412 PolarHBondContact O-N 3.13Å; L410-F412 VanDerWaalsContact CD1-O 3.22Å; L410-F412 WeakPolarHBondContact CD1-O 3.25Å
413	L	97.6	Very high	92.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	133	172.2	173.5	57.5	0	0	0	108.5	A58 L59 Y62 F75 P77 L291 L400 L401 L410	A58-L413 HydrophobicContact CB-CD2 4.22Å; L59-L413 HydrophobicContact CD2-CD2 4.08Å; Y62-L413 HydrophobicContact CD2-CD1 4.17Å; Y62-L413 HydrophobicContact CD2-CD2 4.02Å; Y62-L413 HydrophobicContact CD2-CG 3.8Å; Y62-L413 HydrophobicContact CG-CD2 3.95Å; Y62-L413 HydrophobicContact CG-CG 4.24Å; F75-L413 HydrophobicContact CE1-CB 4.33Å; F75-L413 HydrophobicContact CE1-CD2 4.34Å; F75-L413 HydrophobicContact CE1-CG 4.25Å; F75-L413 HydrophobicContact CZ-CB 4.18Å; F75-L413 HydrophobicContact CZ-CD2 3.89Å; F75-L413 HydrophobicContact CZ-CG 4.21Å; F75-L413 PolarHBondContact N-O 3.43Å; F75-L413 PolarHBondContact O-N 3.37Å; P77-L413 HydrophobicContact CG-CB 4.41Å; L291-L413 HydrophobicContact CD2-CD1 4.49Å; L400-L413 CarbonylContact O-C 3.51Å; L400-L413 WeakPolarHBondContact O-CA 3.45Å; L401-L413 HydrophobicContact CD1-CD1 4.23Å; L401-L413 HydrophobicContact CD2-CD1 3.97Å; L401-L413 HydrophobicContact CG-CD1 3.65Å; L410-L413 HydrophobicContact CD2-CB 4.23Å; L410-L413 HydrophobicContact CD2-CD2 4.36Å
414	G	95.8	Very high	92	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	171.2	178.3	0	0	0	0	0	115.5	I73 L399 L400	I73-G414 CarbonylContact O-C 3.31Å; I73-G414 WeakPolarHBondContact O-CA 3.13Å; L399-G414 CarbonylContact C-O 3.55Å; L399-G414 WeakPolarHBondContact CA-O 3.38Å; L400-G414 PolarHBondContact N-O 3.35Å; L400-G414 PolarHBondContact O-N 2.92Å
415	K	96.6	Very high	91.8	Very high	12 Å²	12	30.6 Å²	30.6	5%	0.052	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	122.6	175.1	-177.7	179.9	61.9	-174.5	0	107.5	Y62 D69 G71 N72 I73 M284 E288 F398 L399 V417	Y62-K415 HydrophobicContact CE2-CB 4.15Å; D69-K415 PolarHBondContact O-NZ 3.07Å; D69-K415 VanDerWaalsContact O-NZ 3.11Å; G71-K415 WeakPolarHBondContact O-CE 3.49Å; N72-K415 WeakPolarHBondContact CA-O 3.16Å; I73-K415 HydrophobicContact CB-CB 4.14Å; I73-K415 PolarHBondContact N-O 2.72Å; I73-K415 PolarHBondContact O-N 2.82Å; M284-K415 HydrophobicContact CE-CG 4.45Å; M284-K415 HydrophobicContact SD-CD 4.5Å; E288-K415 WeakPolarHBondContact OE1-CD 3.19Å; E288-K415 IonicContact OE1-NZ 3.31Å; F398-K415 WeakPolarHBondContact O-CA 3.49Å; L399-K415 HydrophobicContact CD2-CB 3.98Å; L399-K415 HydrophobicContact CD2-CG 4.01Å; K415-V417 HydrophobicContact CD-CG2 3.84Å; K415-V417 HydrophobicContact CG-CG2 3.79Å
416	V	96.7	Very high	91.7	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	106.8	174	-176.2	0	0	0	0	107.2	F315 I317 P397 F398 P419	F315-V416 HydrophobicContact CD2-CG2 4.32Å; F315-V416 HydrophobicContact CE2-CG2 3.73Å; F315-V416 HydrophobicContact CZ-CG2 3.92Å; I317-V416 HydrophobicContact CD1-CG2 3.97Å; P397-V416 WeakPolarHBondContact CA-O 3.48Å; F398-V416 HydrophobicContact CD1-CB 4.16Å; F398-V416 HydrophobicContact CD2-CB 4.42Å; F398-V416 HydrophobicContact CD2-CG2 4.41Å; F398-V416 HydrophobicContact CE1-CB 3.72Å; F398-V416 HydrophobicContact CE1-CG1 3.84Å; F398-V416 HydrophobicContact CE1-CG2 4.27Å; F398-V416 HydrophobicContact CE2-CB 3.99Å; F398-V416 HydrophobicContact CE2-CG2 3.71Å; F398-V416 HydrophobicContact CG-CB 4.49Å; F398-V416 HydrophobicContact CZ-CB 3.62Å; F398-V416 HydrophobicContact CZ-CG1 3.91Å; F398-V416 HydrophobicContact CZ-CG2 3.63Å; F398-V416 PolarHBondContact N-O 3.38Å; F398-V416 VanDerWaalsContact N-O 3.13Å; F398-V416 PolarHBondContact O-N 3.36Å; V416-P419 HydrophobicContact CG1-CB 4.24Å
417	V	95.3	Very high	91.6	Very high	17 Å²	17	26.1 Å²	26.1	10%	0.103	17%	0.168	C	C	.	.	S	Bend	trans	-100.3	-37.7	174.2	179.9	0	0	0	0	110.6	G71 N72 F232 V234 P397 K415	G71-V417 VanDerWaalsContact O-CG2 3.24Å; G71-V417 WeakPolarHBondContact O-CG2 3.33Å; N72-V417 PolarHBondContact OD1-N 3.38Å; F232-V417 VanDerWaalsContact CE1-O 3.28Å; F232-V417 WeakPolarHBondContact CE1-O 3.45Å; V234-V417 HydrophobicContact CG1-CG1 3.9Å; P397-V417 HydrophobicContact CB-CG2 4.35Å; P397-V417 HydrophobicContact CG-CG1 4.2Å; K415-V417 HydrophobicContact CD-CG2 3.84Å; K415-V417 HydrophobicContact CG-CG2 3.79Å
418	N	93.4	Very high	91.4	Very high	43 Å²	43	27.7 Å²	27.7	23%	0.23	18%	0.179	C	C	.	.			trans	-131.7	105.7	177.8	-177.9	-14.3	0	0	0	110.4	N72 L240 V420 A421	N72-N418 PolarHBondContact ND2-O 2.75Å; N72-N418 PolarHBondContact OD1-N 2.86Å; L240-N418 HydrophobicContact CD1-CB 4.5Å; L240-N418 WeakPolarHBondContact CD1-OD1 3.5Å; N418-V420 VanDerWaalsContact C-N 3.25Å; N418-V420 PolarHBondContact O-N 3.15Å; N418-V420 VanDerWaalsContact OD1-CG2 3.24Å; N418-V420 WeakPolarHBondContact OD1-CG2 3.36Å; N418-V420 PolarHBondContact OD1-N 3.26Å; N418-A421 HydrophobicContact CB-CB 3.97Å; N418-A421 PolarHBondContact O-N 3.32Å; N418-A421 PolarHBondContact OD1-N 2.76Å
419	P	91.6	Very high	91.1	Very high	6 Å²	6	20.4 Å²	20.4	4%	0.039	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-7.4	-178.3	31	-38.3	0	0	0	114.8	F232 V242 P313 F315 V416	F232-P419 HydrophobicContact CB-CG 4.3Å; F232-P419 HydrophobicContact CD1-CG 4.01Å; F232-P419 HydrophobicContact CD2-CG 3.88Å; F232-P419 HydrophobicContact CE1-CG 4.31Å; F232-P419 HydrophobicContact CE2-CG 4.17Å; F232-P419 HydrophobicContact CG-CG 3.79Å; F232-P419 HydrophobicContact CZ-CG 4.37Å; V242-P419 HydrophobicContact CG1-CG 3.6Å; P313-P419 HydrophobicContact CB-CB 4.31Å; F315-P419 HydrophobicContact CB-CB 3.7Å; F315-P419 WeakPolarHBondContact CB-O 3.36Å; F315-P419 HydrophobicContact CG-CB 4.46Å; V416-P419 HydrophobicContact CG1-CB 4.24Å
420	V	88.5	Confident	90.8	Very high	84 Å²	84	21.8 Å²	21.8	51%	0.509	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-1.8	176.6	-47.4	0	0	0	0	113.5	L240 V242 N418 G422	L240-V420 HydrophobicContact CD1-CG2 4.03Å; V242-V420 HydrophobicContact CG1-CG1 3.88Å; N418-V420 VanDerWaalsContact C-N 3.25Å; N418-V420 PolarHBondContact O-N 3.15Å; N418-V420 VanDerWaalsContact OD1-CG2 3.24Å; N418-V420 WeakPolarHBondContact OD1-CG2 3.36Å; N418-V420 PolarHBondContact OD1-N 3.26Å; V420-G422 VanDerWaalsContact C-N 3.31Å; V420-G422 PolarHBondContact O-N 3.46Å
421	A	79.6	Confident	90.3	Very high	60 Å²	60	23.7 Å²	23.7	50%	0.496	17%	0.172	S	C	.	.			trans	-93.5	30.1	-178.2	0	0	0	0	0	113.5	N418	N418-A421 HydrophobicContact CB-CB 3.97Å; N418-A421 PolarHBondContact O-N 3.32Å; N418-A421 PolarHBondContact OD1-N 2.76Å
422	G	56.8	Low	89.9	Confident	61 Å²	61	25.8 Å²	25.8	63%	0.629	19%	0.188	S	C	*	.			trans	-65.3	0	-172.6	0	0	0	0	0	115.5	S316 S318 V420	S316-G422 WeakPolarHBondContact O-CA 3.35Å; S318-G422 PolarHBondContact OG-OXT 3.4Å; V420-G422 VanDerWaalsContact C-N 3.31Å; V420-G422 PolarHBondContact O-N 3.46Å

Retrieved 422 of 422 residues in 886.3 ms (Link to these results)

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